USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1155 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: A1006 GLN : amide:sc= 0.0218 K(o=-0.83,f=-2.2!) USER MOD Set 1.2: A1007 GLN : amide:sc= -0.855 K(o=-0.83,f=-2.2) USER MOD Set 2.1: A 928 ASN : amide:sc= -5.61! C(o=-4.4!,f=-7.9!) USER MOD Set 2.2: A 968 THR OG1 : rot 127:sc= 1.25 USER MOD Set 3.1: A 954 MET CE :methyl 164:sc= -0.126 (180deg=-0.446) USER MOD Set 3.2: A1021 MET CE :methyl 157:sc= -0.0979 (180deg=-1.33) USER MOD Single : A 909 SER OG : rot 180:sc= 0 USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 921 SER OG : rot -12:sc= 1.28 USER MOD Single : A 922 ASN :FLIP amide:sc= -1.33 F(o=-4.6!,f=-1.3) USER MOD Single : A 924 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00488) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 67:sc= 1.27 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 1.24 (180deg=1.24) USER MOD Single : A 939 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 940 SER OG : rot -53:sc= 1.2 USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -157:sc= -0.106 (180deg=-0.578) USER MOD Single : A 944 GLN : amide:sc= -0.592 X(o=-0.59,f=-1.1) USER MOD Single : A 951 TYR OH : rot -149:sc= -2.27! USER MOD Single : A 956 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0739) USER MOD Single : A 964 THR OG1 : rot 96:sc= 1.25 USER MOD Single : A 972 SER OG : rot 90:sc= 1.24 USER MOD Single : A 979 SER OG : rot 180:sc= 0.0401 USER MOD Single : A 980 THR OG1 : rot 81:sc= -2.08! USER MOD Single : A 981 HIS :FLIP no HE2:sc= -0.0611 F(o=-0.73,f=-0.061) USER MOD Single : A 986 MET CE :methyl 159:sc= -0.257 (180deg=-0.94) USER MOD Single : A 988 GLN :FLIP amide:sc= -1.11 F(o=-5.4!,f=-1.1) USER MOD Single : A 989 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.033) USER MOD Single : A 992 ASN : amide:sc= -0.527 K(o=-0.53,f=-3!) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= 1.27 K(o=1.3,f=-0.082) USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 MET CE :methyl -123:sc= -3.28 (180deg=-5.76!) USER MOD Single : A1003 LYS NZ :NH3+ -170:sc= -0.0229 (180deg=-0.138) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1011 THR OG1 : rot 180:sc= 0.0997 USER MOD Single : A1012 SER OG : rot 180:sc= 0.0237 USER MOD Single : A1014 GLN :FLIP amide:sc= -3.07! C(o=-3.9!,f=-3.1!) USER MOD Single : A1015 GLN : amide:sc=-0.00171 K(o=-0.0017,f=-0.84) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1018 LYS NZ :NH3+ -169:sc= 1.31 (180deg=1.19) USER MOD Single : A1019 LYS NZ :NH3+ 170:sc=-0.00493 (180deg=-0.121) USER MOD Single : A1020 GLN :FLIP amide:sc= -0.888 F(o=-1.5,f=-0.89) USER MOD Single : A1023 THR OG1 : rot 79:sc= 0.886 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=-0.00099) USER MOD Single : A1033 LYS NZ :NH3+ -158:sc= -0.183 (180deg=-0.987) USER MOD Single : A1034 ASN : amide:sc= 0.949 K(o=0.95,f=-0.3) USER MOD Single : A1041 GLN : amide:sc= -0.339 X(o=-0.34,f=0) USER MOD Single : A1045 LYS NZ :NH3+ -152:sc= 1.11 (180deg=0.789) USER MOD Single : A1046 MET CE :methyl -171:sc= 0 (180deg=-0.0492) USER MOD Single : A1048 SER OG : rot 180:sc= -0.443 USER MOD Single : A1049 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A1050 SER OG : rot 180:sc= 0 USER MOD Single : A1053 HIS : no HE2:sc= -5.07! C(o=-5.1!,f=-6.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 908 -21.140 -4.999 1.029 1.00 0.00 N ATOM 2 CA GLY A 908 -20.000 -5.900 0.740 1.00 0.00 C ATOM 3 C GLY A 908 -20.044 -7.157 1.579 1.00 0.00 C ATOM 4 O GLY A 908 -20.655 -7.174 2.646 1.00 0.00 O ATOM 0 HA2 GLY A 908 -20.009 -6.169 -0.316 1.00 0.00 H new ATOM 0 HA3 GLY A 908 -19.065 -5.372 0.926 1.00 0.00 H new ATOM 9 N SER A 909 -19.404 -8.208 1.096 1.00 0.00 N ATOM 10 CA SER A 909 -19.371 -9.474 1.806 1.00 0.00 C ATOM 11 C SER A 909 -18.085 -9.599 2.614 1.00 0.00 C ATOM 12 O SER A 909 -16.983 -9.492 2.069 1.00 0.00 O ATOM 13 CB SER A 909 -19.492 -10.639 0.819 1.00 0.00 C ATOM 14 OG SER A 909 -19.512 -11.890 1.491 1.00 0.00 O ATOM 0 H SER A 909 -18.898 -8.209 0.210 1.00 0.00 H new ATOM 0 HA SER A 909 -20.216 -9.507 2.493 1.00 0.00 H new ATOM 0 HB2 SER A 909 -20.403 -10.526 0.231 1.00 0.00 H new ATOM 0 HB3 SER A 909 -18.656 -10.613 0.120 1.00 0.00 H new ATOM 0 HG SER A 909 -19.592 -12.613 0.834 1.00 0.00 H new ATOM 20 N PRO A 910 -18.211 -9.807 3.933 1.00 0.00 N ATOM 21 CA PRO A 910 -17.070 -10.041 4.809 1.00 0.00 C ATOM 22 C PRO A 910 -16.657 -11.511 4.816 1.00 0.00 C ATOM 23 O PRO A 910 -15.716 -11.906 5.505 1.00 0.00 O ATOM 24 CB PRO A 910 -17.607 -9.623 6.175 1.00 0.00 C ATOM 25 CG PRO A 910 -19.063 -9.948 6.122 1.00 0.00 C ATOM 26 CD PRO A 910 -19.486 -9.810 4.680 1.00 0.00 C ATOM 0 HA PRO A 910 -16.178 -9.496 4.501 1.00 0.00 H new ATOM 0 HB2 PRO A 910 -17.109 -10.164 6.979 1.00 0.00 H new ATOM 0 HB3 PRO A 910 -17.444 -8.561 6.357 1.00 0.00 H new ATOM 0 HG2 PRO A 910 -19.247 -10.959 6.484 1.00 0.00 H new ATOM 0 HG3 PRO A 910 -19.634 -9.272 6.759 1.00 0.00 H new ATOM 0 HD2 PRO A 910 -20.128 -10.635 4.371 1.00 0.00 H new ATOM 0 HD3 PRO A 910 -20.048 -8.891 4.515 1.00 0.00 H new ATOM 34 N GLY A 911 -17.377 -12.317 4.046 1.00 0.00 N ATOM 35 CA GLY A 911 -17.093 -13.732 3.975 1.00 0.00 C ATOM 36 C GLY A 911 -16.622 -14.148 2.600 1.00 0.00 C ATOM 37 O GLY A 911 -17.347 -14.811 1.858 1.00 0.00 O ATOM 0 H GLY A 911 -18.158 -12.010 3.466 1.00 0.00 H new ATOM 0 HA2 GLY A 911 -16.330 -13.986 4.711 1.00 0.00 H new ATOM 0 HA3 GLY A 911 -17.989 -14.295 4.237 1.00 0.00 H new ATOM 40 N ILE A 912 -15.406 -13.750 2.255 1.00 0.00 N ATOM 41 CA ILE A 912 -14.828 -14.103 0.974 1.00 0.00 C ATOM 42 C ILE A 912 -14.213 -15.491 1.064 1.00 0.00 C ATOM 43 O ILE A 912 -13.171 -15.682 1.694 1.00 0.00 O ATOM 44 CB ILE A 912 -13.752 -13.086 0.531 1.00 0.00 C ATOM 45 CG1 ILE A 912 -14.357 -11.679 0.457 1.00 0.00 C ATOM 46 CG2 ILE A 912 -13.161 -13.488 -0.816 1.00 0.00 C ATOM 47 CD1 ILE A 912 -13.356 -10.594 0.107 1.00 0.00 C ATOM 0 H ILE A 912 -14.802 -13.181 2.848 1.00 0.00 H new ATOM 0 HA ILE A 912 -15.624 -14.091 0.229 1.00 0.00 H new ATOM 0 HB ILE A 912 -12.949 -13.081 1.268 1.00 0.00 H new ATOM 0 HG12 ILE A 912 -15.155 -11.676 -0.286 1.00 0.00 H new ATOM 0 HG13 ILE A 912 -14.815 -11.441 1.417 1.00 0.00 H new ATOM 0 HG21 ILE A 912 -12.405 -12.761 -1.113 1.00 0.00 H new ATOM 0 HG22 ILE A 912 -12.704 -14.474 -0.733 1.00 0.00 H new ATOM 0 HG23 ILE A 912 -13.951 -13.517 -1.566 1.00 0.00 H new ATOM 0 HD11 ILE A 912 -13.862 -9.629 0.074 1.00 0.00 H new ATOM 0 HD12 ILE A 912 -12.570 -10.567 0.862 1.00 0.00 H new ATOM 0 HD13 ILE A 912 -12.916 -10.806 -0.867 1.00 0.00 H new ATOM 59 N SER A 913 -14.876 -16.457 0.458 1.00 0.00 N ATOM 60 CA SER A 913 -14.443 -17.837 0.527 1.00 0.00 C ATOM 61 C SER A 913 -13.515 -18.163 -0.637 1.00 0.00 C ATOM 62 O SER A 913 -13.940 -18.197 -1.796 1.00 0.00 O ATOM 63 CB SER A 913 -15.659 -18.765 0.518 1.00 0.00 C ATOM 64 OG SER A 913 -15.291 -20.096 0.827 1.00 0.00 O ATOM 0 H SER A 913 -15.723 -16.308 -0.091 1.00 0.00 H new ATOM 0 HA SER A 913 -13.892 -17.987 1.455 1.00 0.00 H new ATOM 0 HB2 SER A 913 -16.395 -18.411 1.241 1.00 0.00 H new ATOM 0 HB3 SER A 913 -16.135 -18.735 -0.462 1.00 0.00 H new ATOM 0 HG SER A 913 -16.088 -20.667 0.816 1.00 0.00 H new ATOM 70 N GLY A 914 -12.246 -18.379 -0.327 1.00 0.00 N ATOM 71 CA GLY A 914 -11.278 -18.712 -1.352 1.00 0.00 C ATOM 72 C GLY A 914 -10.649 -17.480 -1.969 1.00 0.00 C ATOM 73 O GLY A 914 -9.530 -17.106 -1.618 1.00 0.00 O ATOM 0 H GLY A 914 -11.868 -18.330 0.619 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -10.497 -19.339 -0.922 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -11.764 -19.298 -2.132 1.00 0.00 H new ATOM 75 N GLY A 915 -11.362 -16.855 -2.899 1.00 0.00 N ATOM 76 CA GLY A 915 -10.870 -15.644 -3.537 1.00 0.00 C ATOM 77 C GLY A 915 -9.936 -15.936 -4.698 1.00 0.00 C ATOM 78 O GLY A 915 -9.896 -15.196 -5.685 1.00 0.00 O ATOM 0 H GLY A 915 -12.277 -17.166 -3.225 1.00 0.00 H new ATOM 0 HA2 GLY A 915 -11.716 -15.056 -3.894 1.00 0.00 H new ATOM 0 HA3 GLY A 915 -10.348 -15.035 -2.799 1.00 0.00 H new ATOM 81 N GLY A 916 -9.188 -17.022 -4.586 1.00 0.00 N ATOM 82 CA GLY A 916 -8.261 -17.399 -5.629 1.00 0.00 C ATOM 83 C GLY A 916 -6.880 -16.829 -5.395 1.00 0.00 C ATOM 84 O GLY A 916 -6.366 -16.070 -6.225 1.00 0.00 O ATOM 0 H GLY A 916 -9.208 -17.653 -3.785 1.00 0.00 H new ATOM 0 HA2 GLY A 916 -8.200 -18.486 -5.684 1.00 0.00 H new ATOM 0 HA3 GLY A 916 -8.638 -17.052 -6.591 1.00 0.00 H new ATOM 87 N GLY A 917 -6.291 -17.179 -4.251 1.00 0.00 N ATOM 88 CA GLY A 917 -4.943 -16.743 -3.929 1.00 0.00 C ATOM 89 C GLY A 917 -3.942 -17.201 -4.969 1.00 0.00 C ATOM 90 O GLY A 917 -3.913 -18.377 -5.331 1.00 0.00 O ATOM 0 H GLY A 917 -6.729 -17.762 -3.538 1.00 0.00 H new ATOM 0 HA2 GLY A 917 -4.920 -15.656 -3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 917 -4.658 -17.134 -2.952 1.00 0.00 H new ATOM 93 N GLY A 918 -3.102 -16.287 -5.434 1.00 0.00 N ATOM 94 CA GLY A 918 -2.238 -16.595 -6.570 1.00 0.00 C ATOM 95 C GLY A 918 -1.668 -15.357 -7.225 1.00 0.00 C ATOM 96 O GLY A 918 -2.103 -14.258 -6.904 1.00 0.00 O ATOM 0 H GLY A 918 -2.999 -15.346 -5.054 1.00 0.00 H new ATOM 0 HA2 GLY A 918 -1.420 -17.233 -6.236 1.00 0.00 H new ATOM 0 HA3 GLY A 918 -2.804 -17.163 -7.308 1.00 0.00 H new ATOM 99 N ILE A 919 -0.692 -15.556 -8.130 1.00 0.00 N ATOM 100 CA ILE A 919 0.038 -14.492 -8.821 1.00 0.00 C ATOM 101 C ILE A 919 -0.823 -13.502 -9.644 1.00 0.00 C ATOM 102 O ILE A 919 -0.450 -13.129 -10.759 1.00 0.00 O ATOM 103 CB ILE A 919 1.080 -15.139 -9.754 1.00 0.00 C ATOM 104 CG1 ILE A 919 0.394 -15.963 -10.850 1.00 0.00 C ATOM 105 CG2 ILE A 919 2.028 -16.021 -8.955 1.00 0.00 C ATOM 106 CD1 ILE A 919 1.353 -16.536 -11.868 1.00 0.00 C ATOM 0 H ILE A 919 -0.385 -16.489 -8.404 1.00 0.00 H new ATOM 0 HA ILE A 919 0.487 -13.889 -8.032 1.00 0.00 H new ATOM 0 HB ILE A 919 1.652 -14.342 -10.229 1.00 0.00 H new ATOM 0 HG12 ILE A 919 -0.160 -16.779 -10.386 1.00 0.00 H new ATOM 0 HG13 ILE A 919 -0.334 -15.335 -11.363 1.00 0.00 H new ATOM 0 HG21 ILE A 919 2.759 -16.472 -9.627 1.00 0.00 H new ATOM 0 HG22 ILE A 919 2.545 -15.417 -8.209 1.00 0.00 H new ATOM 0 HG23 ILE A 919 1.461 -16.807 -8.456 1.00 0.00 H new ATOM 0 HD11 ILE A 919 0.796 -17.106 -12.612 1.00 0.00 H new ATOM 0 HD12 ILE A 919 1.889 -15.724 -12.360 1.00 0.00 H new ATOM 0 HD13 ILE A 919 2.066 -17.191 -11.368 1.00 0.00 H new ATOM 118 N ARG A 920 -1.931 -13.034 -9.092 1.00 0.00 N ATOM 119 CA ARG A 920 -2.785 -12.086 -9.794 1.00 0.00 C ATOM 120 C ARG A 920 -3.316 -11.015 -8.843 1.00 0.00 C ATOM 121 O ARG A 920 -4.213 -10.249 -9.202 1.00 0.00 O ATOM 122 CB ARG A 920 -3.947 -12.817 -10.470 1.00 0.00 C ATOM 123 CG ARG A 920 -4.870 -13.519 -9.481 1.00 0.00 C ATOM 124 CD ARG A 920 -5.971 -14.293 -10.187 1.00 0.00 C ATOM 125 NE ARG A 920 -6.957 -14.832 -9.244 1.00 0.00 N ATOM 126 CZ ARG A 920 -8.038 -15.525 -9.609 1.00 0.00 C ATOM 127 NH1 ARG A 920 -8.223 -15.853 -10.884 1.00 0.00 N ATOM 128 NH2 ARG A 920 -8.926 -15.906 -8.694 1.00 0.00 N ATOM 0 H ARG A 920 -2.261 -13.294 -8.162 1.00 0.00 H new ATOM 0 HA ARG A 920 -2.185 -11.593 -10.558 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -4.527 -12.102 -11.054 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -3.548 -13.552 -11.170 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -4.287 -14.200 -8.861 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -5.315 -12.782 -8.813 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -6.472 -13.640 -10.901 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -5.530 -15.111 -10.757 1.00 0.00 H new ATOM 0 HE ARG A 920 -6.807 -14.667 -8.249 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -7.538 -15.575 -11.587 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -9.050 -16.383 -11.160 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -8.781 -15.669 -7.713 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -9.752 -16.435 -8.974 1.00 0.00 H new ATOM 142 N SER A 921 -2.748 -10.964 -7.639 1.00 0.00 N ATOM 143 CA SER A 921 -3.099 -9.959 -6.633 1.00 0.00 C ATOM 144 C SER A 921 -4.563 -10.046 -6.255 1.00 0.00 C ATOM 145 O SER A 921 -5.154 -9.072 -5.793 1.00 0.00 O ATOM 146 CB SER A 921 -2.739 -8.559 -7.136 1.00 0.00 C ATOM 147 OG SER A 921 -1.370 -8.497 -7.515 1.00 0.00 O ATOM 0 H SER A 921 -2.029 -11.619 -7.332 1.00 0.00 H new ATOM 0 HA SER A 921 -2.520 -10.160 -5.732 1.00 0.00 H new ATOM 0 HB2 SER A 921 -3.369 -8.300 -7.987 1.00 0.00 H new ATOM 0 HB3 SER A 921 -2.939 -7.824 -6.356 1.00 0.00 H new ATOM 0 HG SER A 921 -0.907 -9.302 -7.203 1.00 0.00 H new ATOM 153 N ASN A 922 -5.115 -11.245 -6.434 1.00 0.00 N ATOM 154 CA ASN A 922 -6.502 -11.556 -6.096 1.00 0.00 C ATOM 155 C ASN A 922 -7.422 -10.400 -6.468 1.00 0.00 C ATOM 156 O ASN A 922 -7.218 -9.727 -7.481 1.00 0.00 O ATOM 157 CB ASN A 922 -6.642 -11.886 -4.601 1.00 0.00 C ATOM 158 CG ASN A 922 -5.607 -12.876 -4.100 1.00 0.00 C ATOM 159 OD1 ASN A 922 -5.194 -13.798 -4.953 1.00 0.00 O flip ATOM 160 ND2 ASN A 922 -5.190 -12.821 -2.947 1.00 0.00 N flip ATOM 0 H ASN A 922 -4.604 -12.038 -6.823 1.00 0.00 H new ATOM 0 HA ASN A 922 -6.797 -12.433 -6.672 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -6.561 -10.965 -4.025 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -7.638 -12.290 -4.418 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -5.531 -12.096 -2.316 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -4.503 -13.500 -2.620 1.00 0.00 H new ATOM 167 N ASP A 923 -8.467 -10.213 -5.695 1.00 0.00 N ATOM 168 CA ASP A 923 -9.396 -9.136 -5.968 1.00 0.00 C ATOM 169 C ASP A 923 -9.361 -8.047 -4.898 1.00 0.00 C ATOM 170 O ASP A 923 -9.035 -6.911 -5.185 1.00 0.00 O ATOM 171 CB ASP A 923 -10.822 -9.676 -6.165 1.00 0.00 C ATOM 172 CG ASP A 923 -11.458 -10.224 -4.901 1.00 0.00 C ATOM 173 OD1 ASP A 923 -11.139 -11.367 -4.511 1.00 0.00 O ATOM 174 OD2 ASP A 923 -12.288 -9.514 -4.293 1.00 0.00 O ATOM 0 H ASP A 923 -8.695 -10.784 -4.881 1.00 0.00 H new ATOM 0 HA ASP A 923 -9.074 -8.669 -6.899 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -11.450 -8.877 -6.558 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -10.800 -10.463 -6.918 1.00 0.00 H new ATOM 179 N LYS A 924 -9.651 -8.362 -3.660 1.00 0.00 N ATOM 180 CA LYS A 924 -9.957 -7.299 -2.727 1.00 0.00 C ATOM 181 C LYS A 924 -8.722 -6.493 -2.333 1.00 0.00 C ATOM 182 O LYS A 924 -8.831 -5.303 -2.077 1.00 0.00 O ATOM 183 CB LYS A 924 -10.683 -7.836 -1.512 1.00 0.00 C ATOM 184 CG LYS A 924 -11.563 -6.792 -0.845 1.00 0.00 C ATOM 185 CD LYS A 924 -12.691 -6.362 -1.777 1.00 0.00 C ATOM 186 CE LYS A 924 -13.299 -5.032 -1.370 1.00 0.00 C ATOM 187 NZ LYS A 924 -13.922 -5.078 -0.022 1.00 0.00 N ATOM 0 H LYS A 924 -9.682 -9.309 -3.281 1.00 0.00 H new ATOM 0 HA LYS A 924 -10.624 -6.607 -3.240 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -11.297 -8.687 -1.807 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -9.953 -8.204 -0.791 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -11.981 -7.197 0.077 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -10.962 -5.925 -0.569 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -12.310 -6.288 -2.795 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -13.467 -7.127 -1.782 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -12.526 -4.264 -1.383 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -14.050 -4.740 -2.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -14.352 -4.156 0.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -14.656 -5.815 -0.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -13.195 -5.296 0.689 1.00 0.00 H new ATOM 201 N VAL A 925 -7.546 -7.114 -2.326 1.00 0.00 N ATOM 202 CA VAL A 925 -6.314 -6.382 -2.017 1.00 0.00 C ATOM 203 C VAL A 925 -6.021 -5.343 -3.107 1.00 0.00 C ATOM 204 O VAL A 925 -5.520 -4.259 -2.829 1.00 0.00 O ATOM 205 CB VAL A 925 -5.102 -7.329 -1.823 1.00 0.00 C ATOM 206 CG1 VAL A 925 -5.237 -8.103 -0.529 1.00 0.00 C ATOM 207 CG2 VAL A 925 -4.982 -8.293 -2.989 1.00 0.00 C ATOM 0 H VAL A 925 -7.416 -8.106 -2.527 1.00 0.00 H new ATOM 0 HA VAL A 925 -6.472 -5.867 -1.069 1.00 0.00 H new ATOM 0 HB VAL A 925 -4.200 -6.719 -1.779 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -4.378 -8.763 -0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -5.280 -7.407 0.309 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -6.150 -8.697 -0.554 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -4.125 -8.948 -2.833 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -5.889 -8.893 -3.060 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -4.845 -7.731 -3.913 1.00 0.00 H new ATOM 217 N TYR A 926 -6.411 -5.655 -4.331 1.00 0.00 N ATOM 218 CA TYR A 926 -6.309 -4.721 -5.457 1.00 0.00 C ATOM 219 C TYR A 926 -7.418 -3.709 -5.363 1.00 0.00 C ATOM 220 O TYR A 926 -7.297 -2.602 -5.877 1.00 0.00 O ATOM 221 CB TYR A 926 -6.345 -5.461 -6.813 1.00 0.00 C ATOM 222 CG TYR A 926 -7.525 -5.082 -7.689 1.00 0.00 C ATOM 223 CD1 TYR A 926 -8.754 -5.688 -7.511 1.00 0.00 C ATOM 224 CD2 TYR A 926 -7.418 -4.103 -8.664 1.00 0.00 C ATOM 225 CE1 TYR A 926 -9.848 -5.347 -8.260 1.00 0.00 C ATOM 226 CE2 TYR A 926 -8.508 -3.747 -9.433 1.00 0.00 C ATOM 227 CZ TYR A 926 -9.726 -4.372 -9.230 1.00 0.00 C ATOM 228 OH TYR A 926 -10.813 -4.021 -9.998 1.00 0.00 O ATOM 0 H TYR A 926 -6.808 -6.561 -4.580 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.349 -4.208 -5.402 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -5.422 -5.253 -7.354 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -6.372 -6.535 -6.629 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -8.855 -6.455 -6.757 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -6.469 -3.612 -8.824 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -10.797 -5.836 -8.094 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -8.410 -2.983 -10.190 1.00 0.00 H new ATOM 0 HH TYR A 926 -10.553 -3.319 -10.631 1.00 0.00 H new ATOM 238 N GLU A 927 -8.478 -4.053 -4.692 1.00 0.00 N ATOM 239 CA GLU A 927 -9.512 -3.092 -4.440 1.00 0.00 C ATOM 240 C GLU A 927 -9.131 -2.144 -3.312 1.00 0.00 C ATOM 241 O GLU A 927 -9.613 -1.011 -3.273 1.00 0.00 O ATOM 242 CB GLU A 927 -10.854 -3.734 -4.205 1.00 0.00 C ATOM 243 CG GLU A 927 -11.891 -3.014 -4.993 1.00 0.00 C ATOM 244 CD GLU A 927 -13.228 -2.946 -4.290 1.00 0.00 C ATOM 245 OE1 GLU A 927 -13.429 -2.016 -3.478 1.00 0.00 O ATOM 246 OE2 GLU A 927 -14.079 -3.824 -4.535 1.00 0.00 O ATOM 0 H GLU A 927 -8.649 -4.984 -4.312 1.00 0.00 H new ATOM 0 HA GLU A 927 -9.613 -2.496 -5.347 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -10.823 -4.784 -4.497 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -11.102 -3.705 -3.144 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -11.544 -2.002 -5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -12.018 -3.510 -5.955 1.00 0.00 H new ATOM 253 N ASN A 928 -8.266 -2.561 -2.415 1.00 0.00 N ATOM 254 CA ASN A 928 -7.774 -1.652 -1.390 1.00 0.00 C ATOM 255 C ASN A 928 -6.725 -0.727 -2.016 1.00 0.00 C ATOM 256 O ASN A 928 -6.572 0.427 -1.624 1.00 0.00 O ATOM 257 CB ASN A 928 -7.195 -2.437 -0.210 1.00 0.00 C ATOM 258 CG ASN A 928 -8.066 -3.622 0.179 1.00 0.00 C ATOM 259 OD1 ASN A 928 -7.561 -4.668 0.582 1.00 0.00 O ATOM 260 ND2 ASN A 928 -9.379 -3.476 0.064 1.00 0.00 N ATOM 0 H ASN A 928 -7.890 -3.508 -2.369 1.00 0.00 H new ATOM 0 HA ASN A 928 -8.595 -1.048 -1.003 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -6.197 -2.792 -0.467 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -7.086 -1.772 0.647 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -10.001 -4.245 0.313 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -9.767 -2.595 -0.274 1.00 0.00 H new ATOM 267 N VAL A 929 -6.032 -1.259 -3.020 1.00 0.00 N ATOM 268 CA VAL A 929 -5.041 -0.516 -3.811 1.00 0.00 C ATOM 269 C VAL A 929 -5.727 0.350 -4.861 1.00 0.00 C ATOM 270 O VAL A 929 -5.202 1.410 -5.203 1.00 0.00 O ATOM 271 CB VAL A 929 -4.005 -1.437 -4.499 1.00 0.00 C ATOM 272 CG1 VAL A 929 -3.005 -0.626 -5.302 1.00 0.00 C ATOM 273 CG2 VAL A 929 -3.284 -2.302 -3.480 1.00 0.00 C ATOM 0 H VAL A 929 -6.141 -2.229 -3.315 1.00 0.00 H new ATOM 0 HA VAL A 929 -4.501 0.115 -3.105 1.00 0.00 H new ATOM 0 HB VAL A 929 -4.547 -2.090 -5.183 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -2.288 -1.297 -5.775 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -3.530 -0.057 -6.069 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -2.477 0.060 -4.639 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -2.562 -2.940 -3.990 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -2.764 -1.665 -2.765 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -4.008 -2.923 -2.953 1.00 0.00 H new ATOM 283 N THR A 930 -6.880 -0.039 -5.357 1.00 0.00 N ATOM 284 CA THR A 930 -7.656 0.880 -6.171 1.00 0.00 C ATOM 285 C THR A 930 -7.943 2.139 -5.349 1.00 0.00 C ATOM 286 O THR A 930 -7.860 3.262 -5.846 1.00 0.00 O ATOM 287 CB THR A 930 -8.976 0.238 -6.654 1.00 0.00 C ATOM 288 OG1 THR A 930 -8.694 -0.946 -7.412 1.00 0.00 O ATOM 289 CG2 THR A 930 -9.780 1.204 -7.512 1.00 0.00 C ATOM 0 H THR A 930 -7.296 -0.960 -5.219 1.00 0.00 H new ATOM 0 HA THR A 930 -7.081 1.136 -7.061 1.00 0.00 H new ATOM 0 HB THR A 930 -9.566 -0.016 -5.773 1.00 0.00 H new ATOM 0 HG1 THR A 930 -8.305 -1.626 -6.824 1.00 0.00 H new ATOM 0 HG21 THR A 930 -10.702 0.722 -7.836 1.00 0.00 H new ATOM 0 HG22 THR A 930 -10.020 2.094 -6.930 1.00 0.00 H new ATOM 0 HG23 THR A 930 -9.194 1.489 -8.386 1.00 0.00 H new ATOM 297 N GLY A 931 -8.240 1.920 -4.072 1.00 0.00 N ATOM 298 CA GLY A 931 -8.480 3.016 -3.155 1.00 0.00 C ATOM 299 C GLY A 931 -7.217 3.781 -2.766 1.00 0.00 C ATOM 300 O GLY A 931 -7.176 5.004 -2.898 1.00 0.00 O ATOM 0 H GLY A 931 -8.319 0.993 -3.654 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -9.188 3.709 -3.609 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -8.950 2.626 -2.252 1.00 0.00 H new ATOM 304 N LEU A 932 -6.183 3.077 -2.298 1.00 0.00 N ATOM 305 CA LEU A 932 -4.964 3.749 -1.822 1.00 0.00 C ATOM 306 C LEU A 932 -4.247 4.526 -2.929 1.00 0.00 C ATOM 307 O LEU A 932 -3.852 5.673 -2.721 1.00 0.00 O ATOM 308 CB LEU A 932 -4.010 2.751 -1.130 1.00 0.00 C ATOM 309 CG LEU A 932 -3.177 1.820 -2.009 1.00 0.00 C ATOM 310 CD1 LEU A 932 -1.814 2.429 -2.298 1.00 0.00 C ATOM 311 CD2 LEU A 932 -3.015 0.474 -1.322 1.00 0.00 C ATOM 0 H LEU A 932 -6.161 2.059 -2.237 1.00 0.00 H new ATOM 0 HA LEU A 932 -5.282 4.484 -1.083 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -3.323 3.324 -0.508 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -4.606 2.131 -0.460 1.00 0.00 H new ATOM 0 HG LEU A 932 -3.695 1.679 -2.957 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -1.237 1.749 -2.925 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -1.943 3.380 -2.816 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -1.284 2.595 -1.360 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -2.420 -0.187 -1.952 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -2.512 0.612 -0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -3.996 0.030 -1.155 1.00 0.00 H new ATOM 323 N VAL A 933 -4.092 3.913 -4.105 1.00 0.00 N ATOM 324 CA VAL A 933 -3.392 4.561 -5.213 1.00 0.00 C ATOM 325 C VAL A 933 -4.167 5.776 -5.689 1.00 0.00 C ATOM 326 O VAL A 933 -3.589 6.822 -6.005 1.00 0.00 O ATOM 327 CB VAL A 933 -3.167 3.598 -6.402 1.00 0.00 C ATOM 328 CG1 VAL A 933 -2.637 4.341 -7.621 1.00 0.00 C ATOM 329 CG2 VAL A 933 -2.204 2.496 -6.012 1.00 0.00 C ATOM 0 H VAL A 933 -4.439 2.977 -4.312 1.00 0.00 H new ATOM 0 HA VAL A 933 -2.416 4.868 -4.838 1.00 0.00 H new ATOM 0 HB VAL A 933 -4.130 3.158 -6.661 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -2.489 3.637 -8.440 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -3.355 5.103 -7.923 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -1.687 4.815 -7.374 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -2.055 1.826 -6.859 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -1.248 2.933 -5.723 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -2.614 1.934 -5.173 1.00 0.00 H new ATOM 339 N LYS A 934 -5.482 5.636 -5.723 1.00 0.00 N ATOM 340 CA LYS A 934 -6.338 6.735 -6.135 1.00 0.00 C ATOM 341 C LYS A 934 -6.176 7.931 -5.203 1.00 0.00 C ATOM 342 O LYS A 934 -6.188 9.068 -5.664 1.00 0.00 O ATOM 343 CB LYS A 934 -7.801 6.277 -6.250 1.00 0.00 C ATOM 344 CG LYS A 934 -8.833 7.270 -5.724 1.00 0.00 C ATOM 345 CD LYS A 934 -9.216 6.964 -4.282 1.00 0.00 C ATOM 346 CE LYS A 934 -10.202 7.979 -3.729 1.00 0.00 C ATOM 347 NZ LYS A 934 -10.741 7.562 -2.407 1.00 0.00 N ATOM 0 H LYS A 934 -5.976 4.780 -5.473 1.00 0.00 H new ATOM 0 HA LYS A 934 -6.028 7.062 -7.128 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -8.020 6.070 -7.298 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -7.915 5.337 -5.709 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -8.432 8.282 -5.788 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -9.723 7.239 -6.353 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -9.652 5.967 -4.226 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -8.319 6.955 -3.663 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -9.711 8.947 -3.632 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -11.024 8.108 -4.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -11.410 8.280 -2.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -11.232 6.650 -2.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -9.959 7.464 -1.729 1.00 0.00 H new ATOM 361 N ALA A 935 -5.977 7.696 -3.913 1.00 0.00 N ATOM 362 CA ALA A 935 -5.759 8.791 -2.978 1.00 0.00 C ATOM 363 C ALA A 935 -4.459 9.527 -3.298 1.00 0.00 C ATOM 364 O ALA A 935 -4.410 10.756 -3.274 1.00 0.00 O ATOM 365 CB ALA A 935 -5.734 8.261 -1.554 1.00 0.00 C ATOM 0 H ALA A 935 -5.962 6.766 -3.493 1.00 0.00 H new ATOM 0 HA ALA A 935 -6.581 9.500 -3.076 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.570 9.087 -0.861 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -6.686 7.781 -1.328 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -4.928 7.535 -1.450 1.00 0.00 H new ATOM 371 N VAL A 936 -3.422 8.754 -3.615 1.00 0.00 N ATOM 372 CA VAL A 936 -2.096 9.284 -3.940 1.00 0.00 C ATOM 373 C VAL A 936 -2.170 10.433 -4.944 1.00 0.00 C ATOM 374 O VAL A 936 -1.996 11.594 -4.580 1.00 0.00 O ATOM 375 CB VAL A 936 -1.192 8.176 -4.519 1.00 0.00 C ATOM 376 CG1 VAL A 936 0.193 8.708 -4.846 1.00 0.00 C ATOM 377 CG2 VAL A 936 -1.109 6.997 -3.564 1.00 0.00 C ATOM 0 H VAL A 936 -3.477 7.736 -3.654 1.00 0.00 H new ATOM 0 HA VAL A 936 -1.673 9.661 -3.009 1.00 0.00 H new ATOM 0 HB VAL A 936 -1.641 7.831 -5.450 1.00 0.00 H new ATOM 0 HG11 VAL A 936 0.806 7.903 -5.252 1.00 0.00 H new ATOM 0 HG12 VAL A 936 0.111 9.508 -5.582 1.00 0.00 H new ATOM 0 HG13 VAL A 936 0.657 9.095 -3.939 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -0.467 6.227 -3.991 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -0.694 7.328 -2.612 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.107 6.589 -3.402 1.00 0.00 H new ATOM 387 N ILE A 937 -2.439 10.108 -6.194 1.00 0.00 N ATOM 388 CA ILE A 937 -2.476 11.099 -7.266 1.00 0.00 C ATOM 389 C ILE A 937 -3.616 12.106 -7.089 1.00 0.00 C ATOM 390 O ILE A 937 -3.425 13.322 -7.272 1.00 0.00 O ATOM 391 CB ILE A 937 -2.621 10.413 -8.638 1.00 0.00 C ATOM 392 CG1 ILE A 937 -3.823 9.459 -8.631 1.00 0.00 C ATOM 393 CG2 ILE A 937 -1.341 9.668 -8.991 1.00 0.00 C ATOM 394 CD1 ILE A 937 -4.100 8.810 -9.970 1.00 0.00 C ATOM 0 H ILE A 937 -2.638 9.155 -6.500 1.00 0.00 H new ATOM 0 HA ILE A 937 -1.531 11.641 -7.219 1.00 0.00 H new ATOM 0 HB ILE A 937 -2.795 11.175 -9.397 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -3.651 8.679 -7.889 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -4.709 10.009 -8.315 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -1.456 9.187 -9.963 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -0.509 10.372 -9.030 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -1.140 8.911 -8.233 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -4.964 8.151 -9.883 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -4.305 9.581 -10.713 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -3.231 8.230 -10.280 1.00 0.00 H new ATOM 406 N GLU A 938 -4.775 11.626 -6.689 1.00 0.00 N ATOM 407 CA GLU A 938 -5.965 12.466 -6.695 1.00 0.00 C ATOM 408 C GLU A 938 -5.865 13.540 -5.629 1.00 0.00 C ATOM 409 O GLU A 938 -6.001 14.737 -5.918 1.00 0.00 O ATOM 410 CB GLU A 938 -7.233 11.638 -6.483 1.00 0.00 C ATOM 411 CG GLU A 938 -8.507 12.466 -6.480 1.00 0.00 C ATOM 412 CD GLU A 938 -9.753 11.621 -6.329 1.00 0.00 C ATOM 413 OE1 GLU A 938 -10.190 11.023 -7.333 1.00 0.00 O ATOM 414 OE2 GLU A 938 -10.308 11.565 -5.213 1.00 0.00 O ATOM 0 H GLU A 938 -4.923 10.672 -6.359 1.00 0.00 H new ATOM 0 HA GLU A 938 -6.027 12.941 -7.674 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -7.301 10.885 -7.268 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.154 11.104 -5.536 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -8.463 13.190 -5.666 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -8.568 13.034 -7.408 1.00 0.00 H new ATOM 421 N MET A 939 -5.577 13.131 -4.406 1.00 0.00 N ATOM 422 CA MET A 939 -5.589 14.075 -3.313 1.00 0.00 C ATOM 423 C MET A 939 -4.367 14.971 -3.408 1.00 0.00 C ATOM 424 O MET A 939 -4.391 16.121 -2.974 1.00 0.00 O ATOM 425 CB MET A 939 -5.634 13.359 -1.962 1.00 0.00 C ATOM 426 CG MET A 939 -6.803 12.401 -1.801 1.00 0.00 C ATOM 427 SD MET A 939 -8.407 13.199 -1.985 1.00 0.00 S ATOM 428 CE MET A 939 -9.494 11.797 -1.732 1.00 0.00 C ATOM 0 H MET A 939 -5.337 12.173 -4.152 1.00 0.00 H new ATOM 0 HA MET A 939 -6.489 14.685 -3.386 1.00 0.00 H new ATOM 0 HB2 MET A 939 -4.705 12.806 -1.826 1.00 0.00 H new ATOM 0 HB3 MET A 939 -5.679 14.106 -1.169 1.00 0.00 H new ATOM 0 HG2 MET A 939 -6.715 11.604 -2.539 1.00 0.00 H new ATOM 0 HG3 MET A 939 -6.748 11.933 -0.818 1.00 0.00 H new ATOM 0 HE1 MET A 939 -10.531 12.121 -1.814 1.00 0.00 H new ATOM 0 HE2 MET A 939 -9.291 11.038 -2.487 1.00 0.00 H new ATOM 0 HE3 MET A 939 -9.322 11.378 -0.741 1.00 0.00 H new ATOM 438 N SER A 940 -3.301 14.432 -4.021 1.00 0.00 N ATOM 439 CA SER A 940 -2.021 15.122 -4.088 1.00 0.00 C ATOM 440 C SER A 940 -2.195 16.505 -4.693 1.00 0.00 C ATOM 441 O SER A 940 -1.568 17.465 -4.262 1.00 0.00 O ATOM 442 CB SER A 940 -1.001 14.335 -4.917 1.00 0.00 C ATOM 443 OG SER A 940 -1.313 14.375 -6.295 1.00 0.00 O ATOM 0 H SER A 940 -3.309 13.519 -4.475 1.00 0.00 H new ATOM 0 HA SER A 940 -1.646 15.211 -3.068 1.00 0.00 H new ATOM 0 HB2 SER A 940 -0.005 14.747 -4.756 1.00 0.00 H new ATOM 0 HB3 SER A 940 -0.977 13.299 -4.578 1.00 0.00 H new ATOM 0 HG SER A 940 -2.240 14.088 -6.429 1.00 0.00 H new ATOM 449 N SER A 941 -3.035 16.587 -5.731 1.00 0.00 N ATOM 450 CA SER A 941 -3.316 17.851 -6.400 1.00 0.00 C ATOM 451 C SER A 941 -4.584 18.520 -5.857 1.00 0.00 C ATOM 452 O SER A 941 -4.802 19.710 -6.078 1.00 0.00 O ATOM 453 CB SER A 941 -3.460 17.598 -7.905 1.00 0.00 C ATOM 454 OG SER A 941 -3.678 18.802 -8.623 1.00 0.00 O ATOM 0 H SER A 941 -3.531 15.787 -6.123 1.00 0.00 H new ATOM 0 HA SER A 941 -2.486 18.530 -6.208 1.00 0.00 H new ATOM 0 HB2 SER A 941 -2.560 17.109 -8.279 1.00 0.00 H new ATOM 0 HB3 SER A 941 -4.291 16.914 -8.081 1.00 0.00 H new ATOM 0 HG SER A 941 -3.763 18.602 -9.579 1.00 0.00 H new ATOM 460 N LYS A 942 -5.411 17.774 -5.129 1.00 0.00 N ATOM 461 CA LYS A 942 -6.654 18.349 -4.618 1.00 0.00 C ATOM 462 C LYS A 942 -6.397 19.117 -3.325 1.00 0.00 C ATOM 463 O LYS A 942 -7.292 19.797 -2.820 1.00 0.00 O ATOM 464 CB LYS A 942 -7.746 17.299 -4.432 1.00 0.00 C ATOM 465 CG LYS A 942 -8.446 16.909 -5.720 1.00 0.00 C ATOM 466 CD LYS A 942 -9.474 15.822 -5.474 1.00 0.00 C ATOM 467 CE LYS A 942 -10.445 15.696 -6.637 1.00 0.00 C ATOM 468 NZ LYS A 942 -11.251 16.933 -6.821 1.00 0.00 N ATOM 0 H LYS A 942 -5.251 16.797 -4.884 1.00 0.00 H new ATOM 0 HA LYS A 942 -7.021 19.049 -5.369 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -7.307 16.408 -3.984 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -8.486 17.679 -3.728 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -8.933 17.783 -6.152 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -7.711 16.562 -6.446 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -8.967 14.870 -5.318 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -10.026 16.043 -4.561 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -9.891 15.484 -7.551 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -11.111 14.851 -6.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -12.131 16.702 -7.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -11.481 17.339 -5.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -10.705 17.624 -7.375 1.00 0.00 H new ATOM 482 N ILE A 943 -5.194 18.959 -2.776 1.00 0.00 N ATOM 483 CA ILE A 943 -4.713 19.827 -1.696 1.00 0.00 C ATOM 484 C ILE A 943 -5.063 21.299 -1.940 1.00 0.00 C ATOM 485 O ILE A 943 -5.513 21.986 -1.025 1.00 0.00 O ATOM 486 CB ILE A 943 -3.182 19.709 -1.499 1.00 0.00 C ATOM 487 CG1 ILE A 943 -2.422 20.107 -2.771 1.00 0.00 C ATOM 488 CG2 ILE A 943 -2.814 18.296 -1.091 1.00 0.00 C ATOM 489 CD1 ILE A 943 -0.916 20.123 -2.605 1.00 0.00 C ATOM 0 H ILE A 943 -4.531 18.237 -3.060 1.00 0.00 H new ATOM 0 HA ILE A 943 -5.221 19.484 -0.795 1.00 0.00 H new ATOM 0 HB ILE A 943 -2.892 20.398 -0.705 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -2.683 19.413 -3.570 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -2.754 21.096 -3.087 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -1.735 18.226 -0.956 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -3.314 18.045 -0.156 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -3.128 17.599 -1.868 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -0.449 20.413 -3.546 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -0.643 20.838 -1.829 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -0.571 19.129 -2.320 1.00 0.00 H new ATOM 501 N GLN A 944 -4.872 21.751 -3.186 1.00 0.00 N ATOM 502 CA GLN A 944 -5.073 23.148 -3.578 1.00 0.00 C ATOM 503 C GLN A 944 -4.058 24.060 -2.881 1.00 0.00 C ATOM 504 O GLN A 944 -4.072 24.211 -1.662 1.00 0.00 O ATOM 505 CB GLN A 944 -6.509 23.612 -3.286 1.00 0.00 C ATOM 506 CG GLN A 944 -6.830 24.983 -3.863 1.00 0.00 C ATOM 507 CD GLN A 944 -6.734 25.011 -5.378 1.00 0.00 C ATOM 508 OE1 GLN A 944 -7.013 24.018 -6.051 1.00 0.00 O ATOM 509 NE2 GLN A 944 -6.316 26.141 -5.923 1.00 0.00 N ATOM 0 H GLN A 944 -4.571 21.151 -3.955 1.00 0.00 H new ATOM 0 HA GLN A 944 -4.914 23.215 -4.654 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -7.209 22.882 -3.693 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -6.663 23.635 -2.207 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -7.835 25.275 -3.560 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -6.144 25.720 -3.445 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -6.095 26.942 -5.331 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -6.215 26.212 -6.935 1.00 0.00 H new ATOM 518 N PRO A 945 -3.160 24.685 -3.659 1.00 0.00 N ATOM 519 CA PRO A 945 -2.090 25.530 -3.113 1.00 0.00 C ATOM 520 C PRO A 945 -2.590 26.874 -2.572 1.00 0.00 C ATOM 521 O PRO A 945 -2.349 27.926 -3.168 1.00 0.00 O ATOM 522 CB PRO A 945 -1.163 25.744 -4.309 1.00 0.00 C ATOM 523 CG PRO A 945 -2.043 25.605 -5.503 1.00 0.00 C ATOM 524 CD PRO A 945 -3.107 24.609 -5.131 1.00 0.00 C ATOM 0 HA PRO A 945 -1.611 25.058 -2.256 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -0.695 26.728 -4.275 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -0.359 25.008 -4.323 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -2.486 26.564 -5.773 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -1.474 25.262 -6.367 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -4.067 24.863 -5.580 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -2.852 23.605 -5.471 1.00 0.00 H new ATOM 532 N ALA A 946 -3.315 26.816 -1.460 1.00 0.00 N ATOM 533 CA ALA A 946 -3.744 28.004 -0.722 1.00 0.00 C ATOM 534 C ALA A 946 -4.351 27.588 0.624 1.00 0.00 C ATOM 535 O ALA A 946 -3.851 27.994 1.675 1.00 0.00 O ATOM 536 CB ALA A 946 -4.713 28.867 -1.531 1.00 0.00 C ATOM 0 H ALA A 946 -3.625 25.939 -1.041 1.00 0.00 H new ATOM 0 HA ALA A 946 -2.866 28.623 -0.536 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -5.004 29.737 -0.942 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -4.227 29.196 -2.450 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -5.600 28.284 -1.779 1.00 0.00 H new ATOM 542 N PRO A 947 -5.430 26.771 0.631 1.00 0.00 N ATOM 543 CA PRO A 947 -5.951 26.182 1.850 1.00 0.00 C ATOM 544 C PRO A 947 -5.353 24.800 2.089 1.00 0.00 C ATOM 545 O PRO A 947 -5.140 24.038 1.148 1.00 0.00 O ATOM 546 CB PRO A 947 -7.446 26.086 1.564 1.00 0.00 C ATOM 547 CG PRO A 947 -7.554 25.903 0.083 1.00 0.00 C ATOM 548 CD PRO A 947 -6.249 26.365 -0.529 1.00 0.00 C ATOM 0 HA PRO A 947 -5.716 26.760 2.744 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -7.895 25.249 2.098 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -7.967 26.987 1.888 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -7.743 24.858 -0.161 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -8.389 26.479 -0.315 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -5.770 25.566 -1.095 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -6.404 27.196 -1.218 1.00 0.00 H new ATOM 556 N PRO A 948 -5.051 24.452 3.340 1.00 0.00 N ATOM 557 CA PRO A 948 -4.465 23.160 3.653 1.00 0.00 C ATOM 558 C PRO A 948 -5.433 22.014 3.437 1.00 0.00 C ATOM 559 O PRO A 948 -6.585 22.062 3.867 1.00 0.00 O ATOM 560 CB PRO A 948 -4.087 23.262 5.138 1.00 0.00 C ATOM 561 CG PRO A 948 -4.242 24.706 5.498 1.00 0.00 C ATOM 562 CD PRO A 948 -5.249 25.272 4.540 1.00 0.00 C ATOM 0 HA PRO A 948 -3.616 22.947 3.003 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -4.734 22.634 5.751 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -3.064 22.924 5.306 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -4.581 24.816 6.528 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -3.290 25.231 5.417 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -6.265 25.188 4.925 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -5.070 26.329 4.342 1.00 0.00 H new ATOM 570 N GLU A 949 -4.946 20.981 2.760 1.00 0.00 N ATOM 571 CA GLU A 949 -5.646 19.705 2.677 1.00 0.00 C ATOM 572 C GLU A 949 -5.794 19.131 4.078 1.00 0.00 C ATOM 573 O GLU A 949 -6.563 18.194 4.302 1.00 0.00 O ATOM 574 CB GLU A 949 -4.828 18.719 1.835 1.00 0.00 C ATOM 575 CG GLU A 949 -5.534 17.422 1.509 1.00 0.00 C ATOM 576 CD GLU A 949 -4.546 16.339 1.120 1.00 0.00 C ATOM 577 OE1 GLU A 949 -3.569 16.133 1.874 1.00 0.00 O ATOM 578 OE2 GLU A 949 -4.713 15.711 0.059 1.00 0.00 O ATOM 0 H GLU A 949 -4.060 21.004 2.256 1.00 0.00 H new ATOM 0 HA GLU A 949 -6.623 19.860 2.220 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -4.546 19.207 0.902 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -3.904 18.489 2.366 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -6.114 17.095 2.372 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -6.239 17.584 0.693 1.00 0.00 H new ATOM 585 N GLU A 950 -5.006 19.701 5.006 1.00 0.00 N ATOM 586 CA GLU A 950 -4.824 19.166 6.346 1.00 0.00 C ATOM 587 C GLU A 950 -3.922 17.942 6.290 1.00 0.00 C ATOM 588 O GLU A 950 -3.244 17.633 7.267 1.00 0.00 O ATOM 589 CB GLU A 950 -6.165 18.871 7.018 1.00 0.00 C ATOM 590 CG GLU A 950 -6.983 20.117 7.306 1.00 0.00 C ATOM 591 CD GLU A 950 -6.392 20.949 8.422 1.00 0.00 C ATOM 592 OE1 GLU A 950 -5.375 21.635 8.188 1.00 0.00 O ATOM 593 OE2 GLU A 950 -6.936 20.907 9.547 1.00 0.00 O ATOM 0 H GLU A 950 -4.476 20.555 4.834 1.00 0.00 H new ATOM 0 HA GLU A 950 -4.335 19.918 6.965 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -6.744 18.205 6.379 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -5.985 18.339 7.952 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -7.050 20.722 6.402 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -8.000 19.828 7.571 1.00 0.00 H new ATOM 600 N TYR A 951 -3.863 17.316 5.105 1.00 0.00 N ATOM 601 CA TYR A 951 -2.971 16.193 4.802 1.00 0.00 C ATOM 602 C TYR A 951 -3.252 14.955 5.667 1.00 0.00 C ATOM 603 O TYR A 951 -3.335 13.849 5.151 1.00 0.00 O ATOM 604 CB TYR A 951 -1.508 16.663 4.872 1.00 0.00 C ATOM 605 CG TYR A 951 -1.164 17.690 3.791 1.00 0.00 C ATOM 606 CD1 TYR A 951 -2.038 18.729 3.498 1.00 0.00 C ATOM 607 CD2 TYR A 951 0.011 17.618 3.050 1.00 0.00 C ATOM 608 CE1 TYR A 951 -1.764 19.651 2.512 1.00 0.00 C ATOM 609 CE2 TYR A 951 0.279 18.540 2.054 1.00 0.00 C ATOM 610 CZ TYR A 951 -0.605 19.549 1.796 1.00 0.00 C ATOM 611 OH TYR A 951 -0.335 20.447 0.801 1.00 0.00 O ATOM 0 H TYR A 951 -4.449 17.585 4.314 1.00 0.00 H new ATOM 0 HA TYR A 951 -3.170 15.861 3.783 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -1.317 17.097 5.853 1.00 0.00 H new ATOM 0 HB3 TYR A 951 -0.849 15.801 4.771 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -2.957 18.816 4.058 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.723 16.832 3.255 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -2.461 20.450 2.306 1.00 0.00 H new ATOM 0 HE2 TYR A 951 1.190 18.462 1.479 1.00 0.00 H new ATOM 0 HH TYR A 951 0.196 20.011 0.102 1.00 0.00 H new ATOM 621 N VAL A 952 -3.403 15.149 6.967 1.00 0.00 N ATOM 622 CA VAL A 952 -3.858 14.108 7.881 1.00 0.00 C ATOM 623 C VAL A 952 -5.181 13.479 7.410 1.00 0.00 C ATOM 624 O VAL A 952 -5.334 12.267 7.472 1.00 0.00 O ATOM 625 CB VAL A 952 -4.047 14.656 9.315 1.00 0.00 C ATOM 626 CG1 VAL A 952 -4.352 13.531 10.294 1.00 0.00 C ATOM 627 CG2 VAL A 952 -2.822 15.439 9.760 1.00 0.00 C ATOM 0 H VAL A 952 -3.212 16.041 7.424 1.00 0.00 H new ATOM 0 HA VAL A 952 -3.081 13.343 7.888 1.00 0.00 H new ATOM 0 HB VAL A 952 -4.900 15.334 9.305 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -4.480 13.944 11.294 1.00 0.00 H new ATOM 0 HG12 VAL A 952 -5.268 13.023 9.991 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -3.527 12.819 10.299 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -2.978 15.815 10.771 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -1.949 14.787 9.746 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -2.660 16.277 9.082 1.00 0.00 H new ATOM 637 N PRO A 953 -6.183 14.282 6.988 1.00 0.00 N ATOM 638 CA PRO A 953 -7.421 13.748 6.406 1.00 0.00 C ATOM 639 C PRO A 953 -7.155 12.756 5.269 1.00 0.00 C ATOM 640 O PRO A 953 -7.831 11.740 5.138 1.00 0.00 O ATOM 641 CB PRO A 953 -8.115 15.012 5.901 1.00 0.00 C ATOM 642 CG PRO A 953 -7.725 16.020 6.904 1.00 0.00 C ATOM 643 CD PRO A 953 -6.273 15.738 7.168 1.00 0.00 C ATOM 0 HA PRO A 953 -8.014 13.175 7.119 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -7.780 15.286 4.901 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -9.197 14.888 5.852 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -7.872 17.033 6.528 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -8.320 15.928 7.813 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -5.625 16.272 6.473 1.00 0.00 H new ATOM 0 HD3 PRO A 953 -5.979 16.040 8.173 1.00 0.00 H new ATOM 651 N MET A 954 -6.151 13.074 4.451 1.00 0.00 N ATOM 652 CA MET A 954 -5.699 12.185 3.381 1.00 0.00 C ATOM 653 C MET A 954 -4.921 11.016 3.976 1.00 0.00 C ATOM 654 O MET A 954 -5.014 9.885 3.502 1.00 0.00 O ATOM 655 CB MET A 954 -4.844 12.963 2.376 1.00 0.00 C ATOM 656 CG MET A 954 -3.814 12.118 1.640 1.00 0.00 C ATOM 657 SD MET A 954 -4.534 10.908 0.517 1.00 0.00 S ATOM 658 CE MET A 954 -3.045 10.134 -0.112 1.00 0.00 C ATOM 0 H MET A 954 -5.631 13.950 4.511 1.00 0.00 H new ATOM 0 HA MET A 954 -6.564 11.787 2.851 1.00 0.00 H new ATOM 0 HB2 MET A 954 -5.502 13.432 1.644 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.328 13.767 2.902 1.00 0.00 H new ATOM 0 HG2 MET A 954 -3.154 12.777 1.075 1.00 0.00 H new ATOM 0 HG3 MET A 954 -3.195 11.598 2.371 1.00 0.00 H new ATOM 0 HE1 MET A 954 -3.301 9.190 -0.593 1.00 0.00 H new ATOM 0 HE2 MET A 954 -2.571 10.794 -0.838 1.00 0.00 H new ATOM 0 HE3 MET A 954 -2.356 9.947 0.712 1.00 0.00 H new ATOM 668 N VAL A 955 -4.166 11.300 5.026 1.00 0.00 N ATOM 669 CA VAL A 955 -3.571 10.243 5.849 1.00 0.00 C ATOM 670 C VAL A 955 -4.659 9.260 6.298 1.00 0.00 C ATOM 671 O VAL A 955 -4.458 8.047 6.294 1.00 0.00 O ATOM 672 CB VAL A 955 -2.860 10.811 7.101 1.00 0.00 C ATOM 673 CG1 VAL A 955 -2.401 9.690 8.011 1.00 0.00 C ATOM 674 CG2 VAL A 955 -1.677 11.679 6.716 1.00 0.00 C ATOM 0 H VAL A 955 -3.948 12.248 5.333 1.00 0.00 H new ATOM 0 HA VAL A 955 -2.826 9.736 5.236 1.00 0.00 H new ATOM 0 HB VAL A 955 -3.581 11.429 7.635 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -1.904 10.111 8.885 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -3.263 9.105 8.331 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.705 9.046 7.473 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -1.199 12.063 7.617 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.960 11.086 6.149 1.00 0.00 H new ATOM 0 HG23 VAL A 955 -2.021 12.513 6.105 1.00 0.00 H new ATOM 684 N LYS A 956 -5.813 9.797 6.662 1.00 0.00 N ATOM 685 CA LYS A 956 -6.973 8.993 7.024 1.00 0.00 C ATOM 686 C LYS A 956 -7.517 8.212 5.820 1.00 0.00 C ATOM 687 O LYS A 956 -8.005 7.093 5.964 1.00 0.00 O ATOM 688 CB LYS A 956 -8.050 9.913 7.624 1.00 0.00 C ATOM 689 CG LYS A 956 -9.470 9.360 7.578 1.00 0.00 C ATOM 690 CD LYS A 956 -10.260 9.943 6.412 1.00 0.00 C ATOM 691 CE LYS A 956 -11.664 9.359 6.330 1.00 0.00 C ATOM 692 NZ LYS A 956 -11.650 7.921 5.949 1.00 0.00 N ATOM 0 H LYS A 956 -5.973 10.803 6.715 1.00 0.00 H new ATOM 0 HA LYS A 956 -6.675 8.253 7.766 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -7.791 10.121 8.662 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -8.030 10.865 7.093 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -9.436 8.274 7.489 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -9.980 9.587 8.514 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -10.323 11.026 6.521 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -9.730 9.747 5.480 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -12.161 9.474 7.293 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -12.248 9.921 5.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -12.621 7.603 5.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -11.068 7.793 5.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -11.250 7.359 6.728 1.00 0.00 H new ATOM 706 N GLU A 957 -7.402 8.799 4.636 1.00 0.00 N ATOM 707 CA GLU A 957 -7.978 8.236 3.431 1.00 0.00 C ATOM 708 C GLU A 957 -7.123 7.078 2.902 1.00 0.00 C ATOM 709 O GLU A 957 -7.636 6.003 2.586 1.00 0.00 O ATOM 710 CB GLU A 957 -8.093 9.368 2.407 1.00 0.00 C ATOM 711 CG GLU A 957 -8.091 8.926 0.962 1.00 0.00 C ATOM 712 CD GLU A 957 -9.374 8.242 0.537 1.00 0.00 C ATOM 713 OE1 GLU A 957 -10.462 8.699 0.941 1.00 0.00 O ATOM 714 OE2 GLU A 957 -9.305 7.258 -0.229 1.00 0.00 O ATOM 0 H GLU A 957 -6.906 9.678 4.488 1.00 0.00 H new ATOM 0 HA GLU A 957 -8.964 7.818 3.636 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -9.012 9.921 2.601 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -7.266 10.061 2.560 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -7.924 9.795 0.325 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -7.255 8.246 0.800 1.00 0.00 H new ATOM 721 N VAL A 958 -5.815 7.285 2.855 1.00 0.00 N ATOM 722 CA VAL A 958 -4.901 6.267 2.350 1.00 0.00 C ATOM 723 C VAL A 958 -4.489 5.312 3.468 1.00 0.00 C ATOM 724 O VAL A 958 -4.191 4.143 3.219 1.00 0.00 O ATOM 725 CB VAL A 958 -3.655 6.897 1.686 1.00 0.00 C ATOM 726 CG1 VAL A 958 -2.829 7.670 2.702 1.00 0.00 C ATOM 727 CG2 VAL A 958 -2.812 5.839 0.991 1.00 0.00 C ATOM 0 H VAL A 958 -5.362 8.147 3.160 1.00 0.00 H new ATOM 0 HA VAL A 958 -5.431 5.700 1.584 1.00 0.00 H new ATOM 0 HB VAL A 958 -4.000 7.600 0.928 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -1.958 8.103 2.209 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -3.435 8.466 3.134 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.500 6.995 3.493 1.00 0.00 H new ATOM 0 HG21 VAL A 958 -1.942 6.310 0.533 1.00 0.00 H new ATOM 0 HG22 VAL A 958 -2.482 5.100 1.721 1.00 0.00 H new ATOM 0 HG23 VAL A 958 -3.407 5.348 0.221 1.00 0.00 H new ATOM 737 N GLY A 959 -4.500 5.801 4.702 1.00 0.00 N ATOM 738 CA GLY A 959 -4.260 4.934 5.836 1.00 0.00 C ATOM 739 C GLY A 959 -5.351 3.894 5.947 1.00 0.00 C ATOM 740 O GLY A 959 -5.092 2.726 6.248 1.00 0.00 O ATOM 0 H GLY A 959 -4.670 6.779 4.936 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -3.292 4.444 5.729 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -4.218 5.525 6.751 1.00 0.00 H new ATOM 744 N LEU A 960 -6.576 4.326 5.673 1.00 0.00 N ATOM 745 CA LEU A 960 -7.716 3.429 5.614 1.00 0.00 C ATOM 746 C LEU A 960 -7.524 2.419 4.487 1.00 0.00 C ATOM 747 O LEU A 960 -7.848 1.246 4.630 1.00 0.00 O ATOM 748 CB LEU A 960 -9.005 4.219 5.376 1.00 0.00 C ATOM 749 CG LEU A 960 -10.298 3.410 5.497 1.00 0.00 C ATOM 750 CD1 LEU A 960 -10.634 3.152 6.956 1.00 0.00 C ATOM 751 CD2 LEU A 960 -11.439 4.133 4.803 1.00 0.00 C ATOM 0 H LEU A 960 -6.803 5.303 5.487 1.00 0.00 H new ATOM 0 HA LEU A 960 -7.793 2.903 6.566 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -9.043 5.043 6.088 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -8.963 4.660 4.380 1.00 0.00 H new ATOM 0 HG LEU A 960 -10.151 2.447 5.008 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -11.557 2.575 7.020 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -9.823 2.593 7.423 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -10.763 4.103 7.473 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -12.353 3.546 4.897 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -11.586 5.109 5.265 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -11.199 4.264 3.748 1.00 0.00 H new ATOM 763 N ALA A 961 -6.966 2.875 3.378 1.00 0.00 N ATOM 764 CA ALA A 961 -6.805 2.031 2.204 1.00 0.00 C ATOM 765 C ALA A 961 -5.745 0.948 2.426 1.00 0.00 C ATOM 766 O ALA A 961 -5.942 -0.202 2.039 1.00 0.00 O ATOM 767 CB ALA A 961 -6.480 2.887 1.000 1.00 0.00 C ATOM 0 H ALA A 961 -6.616 3.826 3.265 1.00 0.00 H new ATOM 0 HA ALA A 961 -7.746 1.512 2.020 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -6.360 2.251 0.123 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -7.291 3.595 0.827 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -5.554 3.433 1.181 1.00 0.00 H new ATOM 773 N LEU A 962 -4.641 1.304 3.075 1.00 0.00 N ATOM 774 CA LEU A 962 -3.623 0.328 3.470 1.00 0.00 C ATOM 775 C LEU A 962 -4.144 -0.615 4.546 1.00 0.00 C ATOM 776 O LEU A 962 -3.898 -1.803 4.453 1.00 0.00 O ATOM 777 CB LEU A 962 -2.345 1.008 3.981 1.00 0.00 C ATOM 778 CG LEU A 962 -1.673 0.271 5.144 1.00 0.00 C ATOM 779 CD1 LEU A 962 -0.849 -0.908 4.640 1.00 0.00 C ATOM 780 CD2 LEU A 962 -0.815 1.214 5.967 1.00 0.00 C ATOM 0 H LEU A 962 -4.425 2.265 3.341 1.00 0.00 H new ATOM 0 HA LEU A 962 -3.384 -0.243 2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -1.635 1.091 3.158 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -2.587 2.023 4.298 1.00 0.00 H new ATOM 0 HG LEU A 962 -2.461 -0.117 5.790 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -0.383 -1.414 5.485 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -1.498 -1.607 4.112 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -0.076 -0.548 3.961 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -0.351 0.663 6.785 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -0.040 1.646 5.334 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -1.437 2.011 6.374 1.00 0.00 H new ATOM 792 N ARG A 963 -4.834 -0.140 5.569 1.00 0.00 N ATOM 793 CA ARG A 963 -5.320 -1.073 6.588 1.00 0.00 C ATOM 794 C ARG A 963 -6.340 -2.029 5.990 1.00 0.00 C ATOM 795 O ARG A 963 -6.442 -3.180 6.414 1.00 0.00 O ATOM 796 CB ARG A 963 -5.953 -0.375 7.773 1.00 0.00 C ATOM 797 CG ARG A 963 -7.250 0.320 7.400 1.00 0.00 C ATOM 798 CD ARG A 963 -8.072 0.693 8.615 1.00 0.00 C ATOM 799 NE ARG A 963 -7.406 1.699 9.441 1.00 0.00 N ATOM 800 CZ ARG A 963 -8.027 2.468 10.333 1.00 0.00 C ATOM 801 NH1 ARG A 963 -9.333 2.341 10.537 1.00 0.00 N ATOM 802 NH2 ARG A 963 -7.330 3.358 11.026 1.00 0.00 N ATOM 0 H ARG A 963 -5.066 0.842 5.720 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.444 -1.616 6.942 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -6.146 -1.103 8.561 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -5.254 0.356 8.178 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -7.026 1.219 6.826 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -7.837 -0.333 6.754 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -9.042 1.073 8.294 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -8.261 -0.199 9.212 1.00 0.00 H new ATOM 0 HE ARG A 963 -6.400 1.820 9.326 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -9.867 1.651 10.009 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -9.802 2.934 11.222 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -6.326 3.450 10.874 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -7.798 3.951 11.711 1.00 0.00 H new ATOM 816 N THR A 964 -7.086 -1.553 5.008 1.00 0.00 N ATOM 817 CA THR A 964 -8.037 -2.407 4.322 1.00 0.00 C ATOM 818 C THR A 964 -7.256 -3.420 3.505 1.00 0.00 C ATOM 819 O THR A 964 -7.593 -4.604 3.452 1.00 0.00 O ATOM 820 CB THR A 964 -8.996 -1.608 3.409 1.00 0.00 C ATOM 821 OG1 THR A 964 -9.619 -0.553 4.156 1.00 0.00 O ATOM 822 CG2 THR A 964 -10.077 -2.518 2.859 1.00 0.00 C ATOM 0 H THR A 964 -7.052 -0.591 4.671 1.00 0.00 H new ATOM 0 HA THR A 964 -8.661 -2.903 5.065 1.00 0.00 H new ATOM 0 HB THR A 964 -8.417 -1.189 2.586 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.118 0.279 4.027 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.745 -1.943 2.218 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.618 -3.319 2.279 1.00 0.00 H new ATOM 0 HG23 THR A 964 -10.646 -2.947 3.684 1.00 0.00 H new ATOM 830 N LEU A 965 -6.171 -2.935 2.917 1.00 0.00 N ATOM 831 CA LEU A 965 -5.243 -3.775 2.179 1.00 0.00 C ATOM 832 C LEU A 965 -4.617 -4.793 3.108 1.00 0.00 C ATOM 833 O LEU A 965 -4.533 -5.980 2.791 1.00 0.00 O ATOM 834 CB LEU A 965 -4.141 -2.920 1.548 1.00 0.00 C ATOM 835 CG LEU A 965 -3.041 -3.703 0.835 1.00 0.00 C ATOM 836 CD1 LEU A 965 -3.582 -4.314 -0.439 1.00 0.00 C ATOM 837 CD2 LEU A 965 -1.852 -2.805 0.540 1.00 0.00 C ATOM 0 H LEU A 965 -5.911 -1.949 2.939 1.00 0.00 H new ATOM 0 HA LEU A 965 -5.792 -4.290 1.391 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -4.598 -2.235 0.834 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -3.684 -2.310 2.328 1.00 0.00 H new ATOM 0 HG LEU A 965 -2.702 -4.507 1.489 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -2.790 -4.870 -0.940 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -4.403 -4.989 -0.199 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -3.943 -3.523 -1.097 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -1.078 -3.381 0.032 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -2.169 -1.980 -0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.454 -2.409 1.474 1.00 0.00 H new ATOM 849 N LEU A 966 -4.221 -4.322 4.279 1.00 0.00 N ATOM 850 CA LEU A 966 -3.473 -5.130 5.208 1.00 0.00 C ATOM 851 C LEU A 966 -4.368 -6.234 5.739 1.00 0.00 C ATOM 852 O LEU A 966 -3.920 -7.341 5.973 1.00 0.00 O ATOM 853 CB LEU A 966 -2.926 -4.246 6.346 1.00 0.00 C ATOM 854 CG LEU A 966 -2.007 -4.936 7.363 1.00 0.00 C ATOM 855 CD1 LEU A 966 -1.033 -3.932 7.959 1.00 0.00 C ATOM 856 CD2 LEU A 966 -2.816 -5.586 8.477 1.00 0.00 C ATOM 0 H LEU A 966 -4.411 -3.374 4.604 1.00 0.00 H new ATOM 0 HA LEU A 966 -2.621 -5.589 4.707 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -2.380 -3.415 5.901 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -3.772 -3.819 6.884 1.00 0.00 H new ATOM 0 HG LEU A 966 -1.450 -5.713 6.839 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -0.387 -4.435 8.679 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -0.424 -3.500 7.165 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -1.589 -3.140 8.461 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -2.140 -6.068 9.184 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -3.400 -4.825 8.994 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -3.488 -6.332 8.051 1.00 0.00 H new ATOM 868 N ALA A 967 -5.645 -5.903 5.908 1.00 0.00 N ATOM 869 CA ALA A 967 -6.646 -6.851 6.375 1.00 0.00 C ATOM 870 C ALA A 967 -6.950 -7.915 5.328 1.00 0.00 C ATOM 871 O ALA A 967 -7.034 -9.090 5.671 1.00 0.00 O ATOM 872 CB ALA A 967 -7.918 -6.128 6.790 1.00 0.00 C ATOM 0 H ALA A 967 -6.013 -4.969 5.724 1.00 0.00 H new ATOM 0 HA ALA A 967 -6.233 -7.359 7.247 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -8.653 -6.855 7.136 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -7.693 -5.428 7.595 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -8.321 -5.582 5.937 1.00 0.00 H new ATOM 878 N THR A 968 -7.098 -7.536 4.063 1.00 0.00 N ATOM 879 CA THR A 968 -7.353 -8.534 3.032 1.00 0.00 C ATOM 880 C THR A 968 -6.152 -9.474 2.900 1.00 0.00 C ATOM 881 O THR A 968 -6.310 -10.687 2.779 1.00 0.00 O ATOM 882 CB THR A 968 -7.688 -7.900 1.667 1.00 0.00 C ATOM 883 OG1 THR A 968 -8.583 -6.797 1.856 1.00 0.00 O ATOM 884 CG2 THR A 968 -8.348 -8.926 0.757 1.00 0.00 C ATOM 0 H THR A 968 -7.048 -6.572 3.733 1.00 0.00 H new ATOM 0 HA THR A 968 -8.229 -9.103 3.344 1.00 0.00 H new ATOM 0 HB THR A 968 -6.763 -7.553 1.206 1.00 0.00 H new ATOM 0 HG1 THR A 968 -8.212 -5.998 1.427 1.00 0.00 H new ATOM 0 HG21 THR A 968 -8.579 -8.465 -0.203 1.00 0.00 H new ATOM 0 HG22 THR A 968 -7.670 -9.765 0.603 1.00 0.00 H new ATOM 0 HG23 THR A 968 -9.268 -9.283 1.219 1.00 0.00 H new ATOM 892 N VAL A 969 -4.955 -8.902 2.960 1.00 0.00 N ATOM 893 CA VAL A 969 -3.709 -9.684 2.990 1.00 0.00 C ATOM 894 C VAL A 969 -3.580 -10.468 4.297 1.00 0.00 C ATOM 895 O VAL A 969 -3.164 -11.624 4.284 1.00 0.00 O ATOM 896 CB VAL A 969 -2.448 -8.807 2.807 1.00 0.00 C ATOM 897 CG1 VAL A 969 -1.197 -9.668 2.746 1.00 0.00 C ATOM 898 CG2 VAL A 969 -2.558 -7.952 1.562 1.00 0.00 C ATOM 0 H VAL A 969 -4.813 -7.892 2.989 1.00 0.00 H new ATOM 0 HA VAL A 969 -3.771 -10.373 2.148 1.00 0.00 H new ATOM 0 HB VAL A 969 -2.373 -8.147 3.671 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -0.322 -9.030 2.617 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -1.100 -10.234 3.672 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -1.271 -10.358 1.905 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -1.659 -7.345 1.457 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -2.667 -8.594 0.688 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -3.428 -7.300 1.644 1.00 0.00 H new ATOM 908 N ASP A 970 -3.990 -9.883 5.404 1.00 0.00 N ATOM 909 CA ASP A 970 -3.865 -10.556 6.698 1.00 0.00 C ATOM 910 C ASP A 970 -4.783 -11.758 6.710 1.00 0.00 C ATOM 911 O ASP A 970 -4.443 -12.841 7.196 1.00 0.00 O ATOM 912 CB ASP A 970 -4.222 -9.604 7.846 1.00 0.00 C ATOM 913 CG ASP A 970 -4.310 -10.301 9.187 1.00 0.00 C ATOM 914 OD1 ASP A 970 -3.254 -10.651 9.749 1.00 0.00 O ATOM 915 OD2 ASP A 970 -5.435 -10.479 9.694 1.00 0.00 O ATOM 0 H ASP A 970 -4.409 -8.954 5.443 1.00 0.00 H new ATOM 0 HA ASP A 970 -2.832 -10.875 6.840 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -3.473 -8.814 7.902 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -5.176 -9.124 7.629 1.00 0.00 H new ATOM 920 N GLU A 971 -5.938 -11.554 6.115 1.00 0.00 N ATOM 921 CA GLU A 971 -6.944 -12.576 6.025 1.00 0.00 C ATOM 922 C GLU A 971 -6.558 -13.604 4.953 1.00 0.00 C ATOM 923 O GLU A 971 -7.006 -14.750 4.976 1.00 0.00 O ATOM 924 CB GLU A 971 -8.275 -11.904 5.730 1.00 0.00 C ATOM 925 CG GLU A 971 -9.478 -12.808 5.930 1.00 0.00 C ATOM 926 CD GLU A 971 -10.782 -12.041 5.948 1.00 0.00 C ATOM 927 OE1 GLU A 971 -11.330 -11.764 4.864 1.00 0.00 O ATOM 928 OE2 GLU A 971 -11.267 -11.715 7.054 1.00 0.00 O ATOM 0 H GLU A 971 -6.202 -10.670 5.680 1.00 0.00 H new ATOM 0 HA GLU A 971 -7.030 -13.123 6.964 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -8.379 -11.029 6.372 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -8.270 -11.545 4.701 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -9.508 -13.550 5.132 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -9.367 -13.353 6.868 1.00 0.00 H new ATOM 935 N SER A 972 -5.695 -13.182 4.025 1.00 0.00 N ATOM 936 CA SER A 972 -5.104 -14.100 3.055 1.00 0.00 C ATOM 937 C SER A 972 -4.082 -14.997 3.751 1.00 0.00 C ATOM 938 O SER A 972 -3.732 -16.056 3.243 1.00 0.00 O ATOM 939 CB SER A 972 -4.460 -13.345 1.874 1.00 0.00 C ATOM 940 OG SER A 972 -5.422 -12.562 1.192 1.00 0.00 O ATOM 0 H SER A 972 -5.392 -12.213 3.927 1.00 0.00 H new ATOM 0 HA SER A 972 -5.900 -14.720 2.642 1.00 0.00 H new ATOM 0 HB2 SER A 972 -3.657 -12.705 2.240 1.00 0.00 H new ATOM 0 HB3 SER A 972 -4.009 -14.058 1.183 1.00 0.00 H new ATOM 0 HG SER A 972 -5.462 -11.670 1.595 1.00 0.00 H new ATOM 946 N LEU A 973 -3.632 -14.594 4.942 1.00 0.00 N ATOM 947 CA LEU A 973 -2.659 -15.388 5.684 1.00 0.00 C ATOM 948 C LEU A 973 -3.285 -16.717 6.110 1.00 0.00 C ATOM 949 O LEU A 973 -2.698 -17.773 5.875 1.00 0.00 O ATOM 950 CB LEU A 973 -2.109 -14.610 6.896 1.00 0.00 C ATOM 951 CG LEU A 973 -0.924 -15.253 7.633 1.00 0.00 C ATOM 952 CD1 LEU A 973 -0.109 -14.185 8.348 1.00 0.00 C ATOM 953 CD2 LEU A 973 -1.398 -16.297 8.638 1.00 0.00 C ATOM 0 H LEU A 973 -3.923 -13.733 5.406 1.00 0.00 H new ATOM 0 HA LEU A 973 -1.813 -15.600 5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -1.806 -13.619 6.558 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -2.921 -14.469 7.610 1.00 0.00 H new ATOM 0 HG LEU A 973 -0.299 -15.751 6.891 1.00 0.00 H new ATOM 0 HD11 LEU A 973 0.728 -14.652 8.867 1.00 0.00 H new ATOM 0 HD12 LEU A 973 0.270 -13.468 7.620 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -0.741 -13.668 9.071 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -0.536 -16.734 9.143 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -2.049 -15.825 9.374 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -1.948 -17.080 8.117 1.00 0.00 H new ATOM 965 N PRO A 974 -4.476 -16.710 6.750 1.00 0.00 N ATOM 966 CA PRO A 974 -5.193 -17.956 7.019 1.00 0.00 C ATOM 967 C PRO A 974 -6.006 -18.466 5.822 1.00 0.00 C ATOM 968 O PRO A 974 -6.613 -19.535 5.903 1.00 0.00 O ATOM 969 CB PRO A 974 -6.112 -17.588 8.179 1.00 0.00 C ATOM 970 CG PRO A 974 -6.404 -16.144 7.977 1.00 0.00 C ATOM 971 CD PRO A 974 -5.177 -15.551 7.334 1.00 0.00 C ATOM 0 HA PRO A 974 -4.504 -18.772 7.237 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -7.025 -18.183 8.167 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -5.629 -17.765 9.140 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -7.280 -16.009 7.342 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -6.621 -15.654 8.926 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -5.442 -14.820 6.570 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.554 -15.036 8.065 1.00 0.00 H new ATOM 979 N VAL A 975 -6.020 -17.724 4.712 1.00 0.00 N ATOM 980 CA VAL A 975 -6.747 -18.173 3.524 1.00 0.00 C ATOM 981 C VAL A 975 -6.006 -19.333 2.840 1.00 0.00 C ATOM 982 O VAL A 975 -6.634 -20.219 2.259 1.00 0.00 O ATOM 983 CB VAL A 975 -7.031 -17.020 2.520 1.00 0.00 C ATOM 984 CG1 VAL A 975 -6.039 -16.998 1.365 1.00 0.00 C ATOM 985 CG2 VAL A 975 -8.457 -17.119 1.996 1.00 0.00 C ATOM 0 H VAL A 975 -5.546 -16.827 4.611 1.00 0.00 H new ATOM 0 HA VAL A 975 -7.719 -18.531 3.864 1.00 0.00 H new ATOM 0 HB VAL A 975 -6.910 -16.082 3.061 1.00 0.00 H new ATOM 0 HG11 VAL A 975 -6.281 -16.175 0.693 1.00 0.00 H new ATOM 0 HG12 VAL A 975 -5.030 -16.864 1.755 1.00 0.00 H new ATOM 0 HG13 VAL A 975 -6.095 -17.940 0.819 1.00 0.00 H new ATOM 0 HG21 VAL A 975 -8.644 -16.306 1.294 1.00 0.00 H new ATOM 0 HG22 VAL A 975 -8.593 -18.075 1.490 1.00 0.00 H new ATOM 0 HG23 VAL A 975 -9.156 -17.047 2.829 1.00 0.00 H new ATOM 995 N LEU A 976 -4.674 -19.339 2.917 1.00 0.00 N ATOM 996 CA LEU A 976 -3.906 -20.512 2.503 1.00 0.00 C ATOM 997 C LEU A 976 -3.312 -21.205 3.731 1.00 0.00 C ATOM 998 O LEU A 976 -3.197 -20.595 4.794 1.00 0.00 O ATOM 999 CB LEU A 976 -2.814 -20.200 1.438 1.00 0.00 C ATOM 1000 CG LEU A 976 -1.952 -18.929 1.592 1.00 0.00 C ATOM 1001 CD1 LEU A 976 -2.676 -17.715 1.048 1.00 0.00 C ATOM 1002 CD2 LEU A 976 -1.533 -18.692 3.033 1.00 0.00 C ATOM 0 H LEU A 976 -4.113 -18.558 3.257 1.00 0.00 H new ATOM 0 HA LEU A 976 -4.601 -21.190 2.008 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.137 -21.053 1.403 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -3.308 -20.146 0.468 1.00 0.00 H new ATOM 0 HG LEU A 976 -1.045 -19.089 1.009 1.00 0.00 H new ATOM 0 HD11 LEU A 976 -2.048 -16.832 1.168 1.00 0.00 H new ATOM 0 HD12 LEU A 976 -2.893 -17.864 -0.010 1.00 0.00 H new ATOM 0 HD13 LEU A 976 -3.609 -17.573 1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -0.928 -17.787 3.092 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -2.420 -18.577 3.656 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -0.949 -19.542 3.387 1.00 0.00 H new ATOM 1014 N PRO A 977 -2.967 -22.497 3.622 1.00 0.00 N ATOM 1015 CA PRO A 977 -2.468 -23.281 4.747 1.00 0.00 C ATOM 1016 C PRO A 977 -0.986 -23.053 5.043 1.00 0.00 C ATOM 1017 O PRO A 977 -0.116 -23.595 4.358 1.00 0.00 O ATOM 1018 CB PRO A 977 -2.705 -24.738 4.315 1.00 0.00 C ATOM 1019 CG PRO A 977 -3.371 -24.671 2.975 1.00 0.00 C ATOM 1020 CD PRO A 977 -3.061 -23.315 2.413 1.00 0.00 C ATOM 0 HA PRO A 977 -2.977 -23.001 5.669 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -1.764 -25.285 4.256 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -3.333 -25.261 5.036 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -3.000 -25.457 2.318 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -4.447 -24.815 3.069 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.130 -23.312 1.845 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -3.845 -22.963 1.742 1.00 0.00 H new ATOM 1028 N ALA A 978 -0.724 -22.210 6.041 1.00 0.00 N ATOM 1029 CA ALA A 978 0.604 -22.065 6.645 1.00 0.00 C ATOM 1030 C ALA A 978 1.640 -21.417 5.719 1.00 0.00 C ATOM 1031 O ALA A 978 1.918 -20.237 5.853 1.00 0.00 O ATOM 1032 CB ALA A 978 1.110 -23.411 7.151 1.00 0.00 C ATOM 0 H ALA A 978 -1.431 -21.604 6.457 1.00 0.00 H new ATOM 0 HA ALA A 978 0.479 -21.380 7.483 1.00 0.00 H new ATOM 0 HB1 ALA A 978 2.097 -23.285 7.596 1.00 0.00 H new ATOM 0 HB2 ALA A 978 0.421 -23.800 7.900 1.00 0.00 H new ATOM 0 HB3 ALA A 978 1.174 -24.112 6.319 1.00 0.00 H new ATOM 1038 N SER A 979 2.167 -22.187 4.772 1.00 0.00 N ATOM 1039 CA SER A 979 3.378 -21.840 4.008 1.00 0.00 C ATOM 1040 C SER A 979 3.502 -20.352 3.637 1.00 0.00 C ATOM 1041 O SER A 979 4.497 -19.706 3.970 1.00 0.00 O ATOM 1042 CB SER A 979 3.416 -22.696 2.747 1.00 0.00 C ATOM 1043 OG SER A 979 3.101 -24.045 3.053 1.00 0.00 O ATOM 0 H SER A 979 1.764 -23.085 4.504 1.00 0.00 H new ATOM 0 HA SER A 979 4.228 -22.042 4.660 1.00 0.00 H new ATOM 0 HB2 SER A 979 2.707 -22.308 2.015 1.00 0.00 H new ATOM 0 HB3 SER A 979 4.405 -22.641 2.293 1.00 0.00 H new ATOM 0 HG SER A 979 3.128 -24.581 2.233 1.00 0.00 H new ATOM 1049 N THR A 980 2.494 -19.807 2.971 1.00 0.00 N ATOM 1050 CA THR A 980 2.575 -18.452 2.426 1.00 0.00 C ATOM 1051 C THR A 980 2.558 -17.373 3.528 1.00 0.00 C ATOM 1052 O THR A 980 2.829 -16.199 3.266 1.00 0.00 O ATOM 1053 CB THR A 980 1.421 -18.227 1.425 1.00 0.00 C ATOM 1054 OG1 THR A 980 1.367 -19.336 0.520 1.00 0.00 O ATOM 1055 CG2 THR A 980 1.598 -16.942 0.634 1.00 0.00 C ATOM 0 H THR A 980 1.608 -20.280 2.793 1.00 0.00 H new ATOM 0 HA THR A 980 3.531 -18.357 1.911 1.00 0.00 H new ATOM 0 HB THR A 980 0.493 -18.144 1.991 1.00 0.00 H new ATOM 0 HG1 THR A 980 0.895 -20.083 0.945 1.00 0.00 H new ATOM 0 HG21 THR A 980 0.764 -16.823 -0.058 1.00 0.00 H new ATOM 0 HG22 THR A 980 1.625 -16.094 1.319 1.00 0.00 H new ATOM 0 HG23 THR A 980 2.532 -16.986 0.073 1.00 0.00 H new ATOM 1063 N HIS A 981 2.299 -17.792 4.765 1.00 0.00 N ATOM 1064 CA HIS A 981 2.154 -16.874 5.905 1.00 0.00 C ATOM 1065 C HIS A 981 3.320 -15.890 6.061 1.00 0.00 C ATOM 1066 O HIS A 981 3.090 -14.749 6.428 1.00 0.00 O ATOM 1067 CB HIS A 981 1.939 -17.645 7.226 1.00 0.00 C ATOM 1068 CG HIS A 981 3.164 -18.293 7.816 1.00 0.00 C ATOM 1069 ND1 HIS A 981 4.178 -18.978 7.240 1.00 0.00 N flip ATOM 1070 CD2 HIS A 981 3.424 -18.301 9.167 1.00 0.00 C flip ATOM 1071 CE1 HIS A 981 5.022 -19.382 8.243 1.00 0.00 C flip ATOM 1072 NE2 HIS A 981 4.543 -18.959 9.397 1.00 0.00 N flip ATOM 0 H HIS A 981 2.183 -18.775 5.011 1.00 0.00 H new ATOM 0 HA HIS A 981 1.268 -16.281 5.681 1.00 0.00 H new ATOM 0 HB2 HIS A 981 1.525 -16.957 7.963 1.00 0.00 H new ATOM 0 HB3 HIS A 981 1.189 -18.418 7.055 1.00 0.00 H new ATOM 0 HD1 HIS A 981 4.294 -19.161 6.243 1.00 0.00 H new ATOM 0 HD2 HIS A 981 2.806 -17.839 9.923 1.00 0.00 H new ATOM 0 HE1 HIS A 981 5.929 -19.952 8.110 1.00 0.00 H new ATOM 1081 N ARG A 982 4.550 -16.290 5.752 1.00 0.00 N ATOM 1082 CA ARG A 982 5.698 -15.427 6.063 1.00 0.00 C ATOM 1083 C ARG A 982 5.907 -14.353 5.002 1.00 0.00 C ATOM 1084 O ARG A 982 6.523 -13.327 5.282 1.00 0.00 O ATOM 1085 CB ARG A 982 6.986 -16.218 6.307 1.00 0.00 C ATOM 1086 CG ARG A 982 7.302 -17.221 5.206 1.00 0.00 C ATOM 1087 CD ARG A 982 8.801 -17.402 5.015 1.00 0.00 C ATOM 1088 NE ARG A 982 9.379 -16.350 4.175 1.00 0.00 N ATOM 1089 CZ ARG A 982 10.687 -16.189 3.970 1.00 0.00 C ATOM 1090 NH1 ARG A 982 11.562 -16.990 4.564 1.00 0.00 N ATOM 1091 NH2 ARG A 982 11.117 -15.220 3.171 1.00 0.00 N ATOM 0 H ARG A 982 4.780 -17.176 5.301 1.00 0.00 H new ATOM 0 HA ARG A 982 5.451 -14.927 7.000 1.00 0.00 H new ATOM 0 HB2 ARG A 982 7.818 -15.521 6.402 1.00 0.00 H new ATOM 0 HB3 ARG A 982 6.903 -16.747 7.256 1.00 0.00 H new ATOM 0 HG2 ARG A 982 6.849 -18.182 5.449 1.00 0.00 H new ATOM 0 HG3 ARG A 982 6.855 -16.886 4.270 1.00 0.00 H new ATOM 0 HD2 ARG A 982 9.293 -17.400 5.988 1.00 0.00 H new ATOM 0 HD3 ARG A 982 8.994 -18.374 4.562 1.00 0.00 H new ATOM 0 HE ARG A 982 8.740 -15.699 3.718 1.00 0.00 H new ATOM 0 HH11 ARG A 982 11.236 -17.734 5.181 1.00 0.00 H new ATOM 0 HH12 ARG A 982 12.561 -16.862 4.404 1.00 0.00 H new ATOM 0 HH21 ARG A 982 10.447 -14.600 2.715 1.00 0.00 H new ATOM 0 HH22 ARG A 982 12.117 -15.095 3.013 1.00 0.00 H new ATOM 1105 N GLU A 983 5.390 -14.551 3.807 1.00 0.00 N ATOM 1106 CA GLU A 983 5.364 -13.471 2.834 1.00 0.00 C ATOM 1107 C GLU A 983 4.246 -12.516 3.164 1.00 0.00 C ATOM 1108 O GLU A 983 4.363 -11.306 2.982 1.00 0.00 O ATOM 1109 CB GLU A 983 5.174 -13.999 1.431 1.00 0.00 C ATOM 1110 CG GLU A 983 6.483 -14.171 0.679 1.00 0.00 C ATOM 1111 CD GLU A 983 7.407 -15.181 1.333 1.00 0.00 C ATOM 1112 OE1 GLU A 983 8.050 -14.840 2.348 1.00 0.00 O ATOM 1113 OE2 GLU A 983 7.499 -16.320 0.831 1.00 0.00 O ATOM 0 H GLU A 983 4.988 -15.432 3.487 1.00 0.00 H new ATOM 0 HA GLU A 983 6.322 -12.954 2.879 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.659 -14.958 1.476 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.530 -13.317 0.876 1.00 0.00 H new ATOM 0 HG2 GLU A 983 6.271 -14.487 -0.343 1.00 0.00 H new ATOM 0 HG3 GLU A 983 6.990 -13.208 0.616 1.00 0.00 H new ATOM 1120 N ILE A 984 3.177 -13.075 3.687 1.00 0.00 N ATOM 1121 CA ILE A 984 2.020 -12.304 4.075 1.00 0.00 C ATOM 1122 C ILE A 984 2.374 -11.493 5.301 1.00 0.00 C ATOM 1123 O ILE A 984 1.880 -10.380 5.483 1.00 0.00 O ATOM 1124 CB ILE A 984 0.820 -13.220 4.365 1.00 0.00 C ATOM 1125 CG1 ILE A 984 0.464 -14.023 3.116 1.00 0.00 C ATOM 1126 CG2 ILE A 984 -0.369 -12.414 4.849 1.00 0.00 C ATOM 1127 CD1 ILE A 984 -0.426 -15.209 3.378 1.00 0.00 C ATOM 0 H ILE A 984 3.087 -14.077 3.855 1.00 0.00 H new ATOM 0 HA ILE A 984 1.735 -11.641 3.258 1.00 0.00 H new ATOM 0 HB ILE A 984 1.094 -13.915 5.159 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -0.029 -13.363 2.402 1.00 0.00 H new ATOM 0 HG13 ILE A 984 1.384 -14.370 2.646 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -1.206 -13.084 5.048 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -0.102 -11.885 5.764 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -0.655 -11.693 4.084 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -0.631 -15.724 2.440 1.00 0.00 H new ATOM 0 HD12 ILE A 984 0.072 -15.892 4.066 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -1.364 -14.870 3.818 1.00 0.00 H new ATOM 1139 N GLU A 985 3.275 -12.030 6.106 1.00 0.00 N ATOM 1140 CA GLU A 985 3.780 -11.307 7.247 1.00 0.00 C ATOM 1141 C GLU A 985 4.535 -10.071 6.795 1.00 0.00 C ATOM 1142 O GLU A 985 4.206 -8.951 7.172 1.00 0.00 O ATOM 1143 CB GLU A 985 4.725 -12.187 8.070 1.00 0.00 C ATOM 1144 CG GLU A 985 4.020 -13.301 8.828 1.00 0.00 C ATOM 1145 CD GLU A 985 4.946 -14.041 9.769 1.00 0.00 C ATOM 1146 OE1 GLU A 985 5.757 -14.861 9.295 1.00 0.00 O ATOM 1147 OE2 GLU A 985 4.871 -13.798 10.994 1.00 0.00 O ATOM 0 H GLU A 985 3.668 -12.964 5.986 1.00 0.00 H new ATOM 0 HA GLU A 985 2.928 -11.016 7.862 1.00 0.00 H new ATOM 0 HB2 GLU A 985 5.469 -12.626 7.405 1.00 0.00 H new ATOM 0 HB3 GLU A 985 5.263 -11.560 8.781 1.00 0.00 H new ATOM 0 HG2 GLU A 985 3.191 -12.880 9.397 1.00 0.00 H new ATOM 0 HG3 GLU A 985 3.593 -14.006 8.115 1.00 0.00 H new ATOM 1154 N MET A 986 5.513 -10.294 5.922 1.00 0.00 N ATOM 1155 CA MET A 986 6.456 -9.253 5.542 1.00 0.00 C ATOM 1156 C MET A 986 5.800 -8.183 4.686 1.00 0.00 C ATOM 1157 O MET A 986 6.043 -6.991 4.857 1.00 0.00 O ATOM 1158 CB MET A 986 7.638 -9.866 4.784 1.00 0.00 C ATOM 1159 CG MET A 986 8.616 -10.611 5.682 1.00 0.00 C ATOM 1160 SD MET A 986 10.053 -11.244 4.789 1.00 0.00 S ATOM 1161 CE MET A 986 10.717 -9.735 4.083 1.00 0.00 C ATOM 0 H MET A 986 5.671 -11.191 5.464 1.00 0.00 H new ATOM 0 HA MET A 986 6.810 -8.780 6.458 1.00 0.00 H new ATOM 0 HB2 MET A 986 7.257 -10.552 4.027 1.00 0.00 H new ATOM 0 HB3 MET A 986 8.171 -9.075 4.258 1.00 0.00 H new ATOM 0 HG2 MET A 986 8.953 -9.944 6.475 1.00 0.00 H new ATOM 0 HG3 MET A 986 8.099 -11.442 6.163 1.00 0.00 H new ATOM 0 HE1 MET A 986 11.767 -9.883 3.831 1.00 0.00 H new ATOM 0 HE2 MET A 986 10.160 -9.479 3.182 1.00 0.00 H new ATOM 0 HE3 MET A 986 10.628 -8.925 4.807 1.00 0.00 H new ATOM 1171 N ALA A 987 4.964 -8.633 3.765 1.00 0.00 N ATOM 1172 CA ALA A 987 4.357 -7.758 2.778 1.00 0.00 C ATOM 1173 C ALA A 987 3.418 -6.741 3.412 1.00 0.00 C ATOM 1174 O ALA A 987 3.514 -5.544 3.136 1.00 0.00 O ATOM 1175 CB ALA A 987 3.616 -8.589 1.752 1.00 0.00 C ATOM 0 H ALA A 987 4.688 -9.611 3.681 1.00 0.00 H new ATOM 0 HA ALA A 987 5.155 -7.197 2.292 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.161 -7.932 1.011 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.314 -9.264 1.257 1.00 0.00 H new ATOM 0 HB3 ALA A 987 2.839 -9.171 2.248 1.00 0.00 H new ATOM 1181 N GLN A 988 2.497 -7.211 4.248 1.00 0.00 N ATOM 1182 CA GLN A 988 1.577 -6.300 4.924 1.00 0.00 C ATOM 1183 C GLN A 988 2.337 -5.319 5.830 1.00 0.00 C ATOM 1184 O GLN A 988 1.888 -4.193 6.044 1.00 0.00 O ATOM 1185 CB GLN A 988 0.496 -7.071 5.697 1.00 0.00 C ATOM 1186 CG GLN A 988 0.993 -7.830 6.914 1.00 0.00 C ATOM 1187 CD GLN A 988 -0.045 -8.806 7.445 1.00 0.00 C ATOM 1188 OE1 GLN A 988 -1.319 -8.505 7.217 1.00 0.00 O flip ATOM 1189 NE2 GLN A 988 0.295 -9.825 8.042 1.00 0.00 N flip ATOM 0 H GLN A 988 2.368 -8.198 4.471 1.00 0.00 H new ATOM 0 HA GLN A 988 1.068 -5.711 4.162 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -0.273 -6.367 6.016 1.00 0.00 H new ATOM 0 HB3 GLN A 988 0.019 -7.777 5.017 1.00 0.00 H new ATOM 0 HG2 GLN A 988 1.902 -8.374 6.655 1.00 0.00 H new ATOM 0 HG3 GLN A 988 1.258 -7.122 7.699 1.00 0.00 H new ATOM 0 HE21 GLN A 988 1.284 -10.019 8.197 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -0.412 -10.476 8.383 1.00 0.00 H new ATOM 1198 N LYS A 989 3.498 -5.743 6.329 1.00 0.00 N ATOM 1199 CA LYS A 989 4.387 -4.859 7.089 1.00 0.00 C ATOM 1200 C LYS A 989 5.018 -3.813 6.191 1.00 0.00 C ATOM 1201 O LYS A 989 5.179 -2.656 6.570 1.00 0.00 O ATOM 1202 CB LYS A 989 5.537 -5.638 7.694 1.00 0.00 C ATOM 1203 CG LYS A 989 5.145 -6.624 8.769 1.00 0.00 C ATOM 1204 CD LYS A 989 6.266 -7.618 8.994 1.00 0.00 C ATOM 1205 CE LYS A 989 5.912 -8.645 10.057 1.00 0.00 C ATOM 1206 NZ LYS A 989 5.835 -8.035 11.410 1.00 0.00 N ATOM 0 H LYS A 989 3.847 -6.695 6.221 1.00 0.00 H new ATOM 0 HA LYS A 989 3.771 -4.396 7.860 1.00 0.00 H new ATOM 0 HB2 LYS A 989 6.050 -6.177 6.897 1.00 0.00 H new ATOM 0 HB3 LYS A 989 6.253 -4.932 8.114 1.00 0.00 H new ATOM 0 HG2 LYS A 989 4.925 -6.095 9.696 1.00 0.00 H new ATOM 0 HG3 LYS A 989 4.235 -7.149 8.478 1.00 0.00 H new ATOM 0 HD2 LYS A 989 6.491 -8.128 8.058 1.00 0.00 H new ATOM 0 HD3 LYS A 989 7.169 -7.085 9.292 1.00 0.00 H new ATOM 0 HE2 LYS A 989 4.956 -9.107 9.812 1.00 0.00 H new ATOM 0 HE3 LYS A 989 6.659 -9.439 10.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 5.692 -8.782 12.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 6.720 -7.529 11.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 5.038 -7.367 11.445 1.00 0.00 H new ATOM 1220 N LEU A 990 5.456 -4.274 5.025 1.00 0.00 N ATOM 1221 CA LEU A 990 6.151 -3.429 4.071 1.00 0.00 C ATOM 1222 C LEU A 990 5.399 -2.126 3.784 1.00 0.00 C ATOM 1223 O LEU A 990 5.916 -1.038 4.047 1.00 0.00 O ATOM 1224 CB LEU A 990 6.359 -4.211 2.783 1.00 0.00 C ATOM 1225 CG LEU A 990 6.588 -3.350 1.561 1.00 0.00 C ATOM 1226 CD1 LEU A 990 8.008 -2.803 1.544 1.00 0.00 C ATOM 1227 CD2 LEU A 990 6.288 -4.143 0.299 1.00 0.00 C ATOM 0 H LEU A 990 5.338 -5.240 4.719 1.00 0.00 H new ATOM 0 HA LEU A 990 7.110 -3.146 4.505 1.00 0.00 H new ATOM 0 HB2 LEU A 990 7.213 -4.876 2.910 1.00 0.00 H new ATOM 0 HB3 LEU A 990 5.487 -4.842 2.610 1.00 0.00 H new ATOM 0 HG LEU A 990 5.908 -2.499 1.600 1.00 0.00 H new ATOM 0 HD11 LEU A 990 8.150 -2.187 0.656 1.00 0.00 H new ATOM 0 HD12 LEU A 990 8.176 -2.199 2.436 1.00 0.00 H new ATOM 0 HD13 LEU A 990 8.717 -3.631 1.528 1.00 0.00 H new ATOM 0 HD21 LEU A 990 6.456 -3.514 -0.575 1.00 0.00 H new ATOM 0 HD22 LEU A 990 6.943 -5.013 0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.249 -4.472 0.315 1.00 0.00 H new ATOM 1239 N LEU A 991 4.176 -2.234 3.275 1.00 0.00 N ATOM 1240 CA LEU A 991 3.373 -1.051 2.973 1.00 0.00 C ATOM 1241 C LEU A 991 3.073 -0.306 4.256 1.00 0.00 C ATOM 1242 O LEU A 991 2.990 0.917 4.280 1.00 0.00 O ATOM 1243 CB LEU A 991 2.065 -1.454 2.307 1.00 0.00 C ATOM 1244 CG LEU A 991 1.522 -0.484 1.252 1.00 0.00 C ATOM 1245 CD1 LEU A 991 0.866 0.727 1.902 1.00 0.00 C ATOM 1246 CD2 LEU A 991 2.639 -0.049 0.319 1.00 0.00 C ATOM 0 H LEU A 991 3.720 -3.122 3.064 1.00 0.00 H new ATOM 0 HA LEU A 991 3.933 -0.409 2.293 1.00 0.00 H new ATOM 0 HB2 LEU A 991 2.204 -2.428 1.839 1.00 0.00 H new ATOM 0 HB3 LEU A 991 1.309 -1.578 3.082 1.00 0.00 H new ATOM 0 HG LEU A 991 0.759 -1.003 0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 991 0.491 1.397 1.128 1.00 0.00 H new ATOM 0 HD12 LEU A 991 0.038 0.399 2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 991 1.599 1.254 2.513 1.00 0.00 H new ATOM 0 HD21 LEU A 991 2.243 0.640 -0.427 1.00 0.00 H new ATOM 0 HD22 LEU A 991 3.420 0.449 0.894 1.00 0.00 H new ATOM 0 HD23 LEU A 991 3.057 -0.923 -0.180 1.00 0.00 H new ATOM 1258 N ASN A 992 2.924 -1.078 5.318 1.00 0.00 N ATOM 1259 CA ASN A 992 2.678 -0.551 6.648 1.00 0.00 C ATOM 1260 C ASN A 992 3.727 0.501 7.011 1.00 0.00 C ATOM 1261 O ASN A 992 3.386 1.623 7.396 1.00 0.00 O ATOM 1262 CB ASN A 992 2.697 -1.712 7.637 1.00 0.00 C ATOM 1263 CG ASN A 992 2.331 -1.328 9.062 1.00 0.00 C ATOM 1264 OD1 ASN A 992 2.617 -0.228 9.533 1.00 0.00 O ATOM 1265 ND2 ASN A 992 1.676 -2.246 9.759 1.00 0.00 N ATOM 0 H ASN A 992 2.971 -2.096 5.281 1.00 0.00 H new ATOM 0 HA ASN A 992 1.705 -0.062 6.682 1.00 0.00 H new ATOM 0 HB2 ASN A 992 2.005 -2.480 7.291 1.00 0.00 H new ATOM 0 HB3 ASN A 992 3.692 -2.157 7.638 1.00 0.00 H new ATOM 0 HD21 ASN A 992 1.392 -2.051 10.719 1.00 0.00 H new ATOM 0 HD22 ASN A 992 1.456 -3.147 9.335 1.00 0.00 H new ATOM 1272 N SER A 993 4.994 0.150 6.866 1.00 0.00 N ATOM 1273 CA SER A 993 6.074 1.074 7.180 1.00 0.00 C ATOM 1274 C SER A 993 6.223 2.151 6.099 1.00 0.00 C ATOM 1275 O SER A 993 6.410 3.318 6.420 1.00 0.00 O ATOM 1276 CB SER A 993 7.390 0.316 7.387 1.00 0.00 C ATOM 1277 OG SER A 993 8.438 1.183 7.784 1.00 0.00 O ATOM 0 H SER A 993 5.301 -0.764 6.534 1.00 0.00 H new ATOM 0 HA SER A 993 5.821 1.580 8.112 1.00 0.00 H new ATOM 0 HB2 SER A 993 7.250 -0.456 8.144 1.00 0.00 H new ATOM 0 HB3 SER A 993 7.667 -0.191 6.463 1.00 0.00 H new ATOM 0 HG SER A 993 9.261 0.666 7.908 1.00 0.00 H new ATOM 1283 N ASP A 994 6.136 1.773 4.833 1.00 0.00 N ATOM 1284 CA ASP A 994 6.270 2.753 3.747 1.00 0.00 C ATOM 1285 C ASP A 994 5.173 3.830 3.805 1.00 0.00 C ATOM 1286 O ASP A 994 5.417 4.993 3.499 1.00 0.00 O ATOM 1287 CB ASP A 994 6.307 2.064 2.382 1.00 0.00 C ATOM 1288 CG ASP A 994 7.673 1.468 2.091 1.00 0.00 C ATOM 1289 OD1 ASP A 994 8.138 0.622 2.885 1.00 0.00 O ATOM 1290 OD2 ASP A 994 8.296 1.853 1.078 1.00 0.00 O ATOM 0 H ASP A 994 5.976 0.813 4.527 1.00 0.00 H new ATOM 0 HA ASP A 994 7.223 3.263 3.888 1.00 0.00 H new ATOM 0 HB2 ASP A 994 5.553 1.278 2.351 1.00 0.00 H new ATOM 0 HB3 ASP A 994 6.050 2.783 1.604 1.00 0.00 H new ATOM 1295 N LEU A 995 3.964 3.439 4.195 1.00 0.00 N ATOM 1296 CA LEU A 995 2.876 4.390 4.438 1.00 0.00 C ATOM 1297 C LEU A 995 3.114 5.158 5.731 1.00 0.00 C ATOM 1298 O LEU A 995 2.590 6.253 5.903 1.00 0.00 O ATOM 1299 CB LEU A 995 1.505 3.695 4.433 1.00 0.00 C ATOM 1300 CG LEU A 995 0.292 4.603 4.670 1.00 0.00 C ATOM 1301 CD1 LEU A 995 -0.888 4.140 3.833 1.00 0.00 C ATOM 1302 CD2 LEU A 995 -0.094 4.617 6.142 1.00 0.00 C ATOM 0 H LEU A 995 3.708 2.464 4.351 1.00 0.00 H new ATOM 0 HA LEU A 995 2.868 5.109 3.619 1.00 0.00 H new ATOM 0 HB2 LEU A 995 1.377 3.194 3.474 1.00 0.00 H new ATOM 0 HB3 LEU A 995 1.509 2.920 5.199 1.00 0.00 H new ATOM 0 HG LEU A 995 0.565 5.615 4.372 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -1.741 4.795 4.013 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -0.621 4.174 2.777 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -1.151 3.118 4.108 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -0.957 5.268 6.286 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -0.345 3.606 6.462 1.00 0.00 H new ATOM 0 HD23 LEU A 995 0.743 4.988 6.734 1.00 0.00 H new ATOM 1314 N ALA A 996 3.947 4.638 6.606 1.00 0.00 N ATOM 1315 CA ALA A 996 4.398 5.437 7.746 1.00 0.00 C ATOM 1316 C ALA A 996 5.431 6.472 7.279 1.00 0.00 C ATOM 1317 O ALA A 996 5.571 7.543 7.879 1.00 0.00 O ATOM 1318 CB ALA A 996 4.950 4.562 8.863 1.00 0.00 C ATOM 0 H ALA A 996 4.323 3.691 6.562 1.00 0.00 H new ATOM 0 HA ALA A 996 3.538 5.965 8.159 1.00 0.00 H new ATOM 0 HB1 ALA A 996 5.275 5.191 9.692 1.00 0.00 H new ATOM 0 HB2 ALA A 996 4.173 3.880 9.208 1.00 0.00 H new ATOM 0 HB3 ALA A 996 5.798 3.988 8.490 1.00 0.00 H new ATOM 1324 N GLU A 997 6.114 6.171 6.180 1.00 0.00 N ATOM 1325 CA GLU A 997 7.006 7.132 5.527 1.00 0.00 C ATOM 1326 C GLU A 997 6.174 8.153 4.778 1.00 0.00 C ATOM 1327 O GLU A 997 6.469 9.349 4.803 1.00 0.00 O ATOM 1328 CB GLU A 997 7.940 6.425 4.546 1.00 0.00 C ATOM 1329 CG GLU A 997 8.589 5.188 5.125 1.00 0.00 C ATOM 1330 CD GLU A 997 9.499 5.497 6.295 1.00 0.00 C ATOM 1331 OE1 GLU A 997 8.996 5.661 7.424 1.00 0.00 O ATOM 1332 OE2 GLU A 997 10.728 5.584 6.087 1.00 0.00 O ATOM 0 H GLU A 997 6.068 5.263 5.717 1.00 0.00 H new ATOM 0 HA GLU A 997 7.610 7.623 6.290 1.00 0.00 H new ATOM 0 HB2 GLU A 997 7.377 6.148 3.654 1.00 0.00 H new ATOM 0 HB3 GLU A 997 8.717 7.121 4.229 1.00 0.00 H new ATOM 0 HG2 GLU A 997 7.813 4.493 5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 997 9.163 4.686 4.346 1.00 0.00 H new ATOM 1339 N LEU A 998 5.119 7.675 4.142 1.00 0.00 N ATOM 1340 CA LEU A 998 4.202 8.536 3.418 1.00 0.00 C ATOM 1341 C LEU A 998 3.634 9.629 4.323 1.00 0.00 C ATOM 1342 O LEU A 998 3.626 10.808 3.968 1.00 0.00 O ATOM 1343 CB LEU A 998 3.048 7.715 2.865 1.00 0.00 C ATOM 1344 CG LEU A 998 1.721 8.475 2.772 1.00 0.00 C ATOM 1345 CD1 LEU A 998 1.511 9.025 1.376 1.00 0.00 C ATOM 1346 CD2 LEU A 998 0.558 7.599 3.191 1.00 0.00 C ATOM 0 H LEU A 998 4.875 6.685 4.113 1.00 0.00 H new ATOM 0 HA LEU A 998 4.759 9.003 2.606 1.00 0.00 H new ATOM 0 HB2 LEU A 998 3.317 7.354 1.872 1.00 0.00 H new ATOM 0 HB3 LEU A 998 2.907 6.837 3.496 1.00 0.00 H new ATOM 0 HG LEU A 998 1.768 9.317 3.463 1.00 0.00 H new ATOM 0 HD11 LEU A 998 0.562 9.560 1.335 1.00 0.00 H new ATOM 0 HD12 LEU A 998 2.324 9.707 1.128 1.00 0.00 H new ATOM 0 HD13 LEU A 998 1.495 8.203 0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.370 8.165 3.115 1.00 0.00 H new ATOM 0 HD22 LEU A 998 0.506 6.727 2.539 1.00 0.00 H new ATOM 0 HD23 LEU A 998 0.701 7.273 4.221 1.00 0.00 H new ATOM 1358 N ILE A 999 3.190 9.219 5.508 1.00 0.00 N ATOM 1359 CA ILE A 999 2.510 10.117 6.446 1.00 0.00 C ATOM 1360 C ILE A 999 3.440 11.221 6.940 1.00 0.00 C ATOM 1361 O ILE A 999 3.039 12.374 7.027 1.00 0.00 O ATOM 1362 CB ILE A 999 1.950 9.336 7.660 1.00 0.00 C ATOM 1363 CG1 ILE A 999 0.878 8.342 7.208 1.00 0.00 C ATOM 1364 CG2 ILE A 999 1.381 10.289 8.704 1.00 0.00 C ATOM 1365 CD1 ILE A 999 0.398 7.425 8.313 1.00 0.00 C ATOM 0 H ILE A 999 3.289 8.262 5.847 1.00 0.00 H new ATOM 0 HA ILE A 999 1.683 10.574 5.902 1.00 0.00 H new ATOM 0 HB ILE A 999 2.771 8.782 8.115 1.00 0.00 H new ATOM 0 HG12 ILE A 999 0.027 8.894 6.810 1.00 0.00 H new ATOM 0 HG13 ILE A 999 1.275 7.738 6.392 1.00 0.00 H new ATOM 0 HG21 ILE A 999 0.994 9.716 9.547 1.00 0.00 H new ATOM 0 HG22 ILE A 999 2.167 10.960 9.051 1.00 0.00 H new ATOM 0 HG23 ILE A 999 0.575 10.874 8.262 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -0.361 6.748 7.920 1.00 0.00 H new ATOM 0 HD12 ILE A 999 1.238 6.846 8.696 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -0.030 8.020 9.120 1.00 0.00 H new ATOM 1377 N ASN A1000 4.683 10.865 7.248 1.00 0.00 N ATOM 1378 CA ASN A1000 5.655 11.837 7.760 1.00 0.00 C ATOM 1379 C ASN A1000 5.889 12.981 6.774 1.00 0.00 C ATOM 1380 O ASN A1000 5.987 14.146 7.157 1.00 0.00 O ATOM 1381 CB ASN A1000 6.982 11.144 8.082 1.00 0.00 C ATOM 1382 CG ASN A1000 7.007 10.579 9.489 1.00 0.00 C ATOM 1383 OD1 ASN A1000 7.419 11.257 10.431 1.00 0.00 O ATOM 1384 ND2 ASN A1000 6.558 9.344 9.651 1.00 0.00 N ATOM 0 H ASN A1000 5.044 9.916 7.154 1.00 0.00 H new ATOM 0 HA ASN A1000 5.239 12.264 8.673 1.00 0.00 H new ATOM 0 HB2 ASN A1000 7.153 10.340 7.366 1.00 0.00 H new ATOM 0 HB3 ASN A1000 7.799 11.855 7.963 1.00 0.00 H new ATOM 0 HD21 ASN A1000 6.545 8.924 10.580 1.00 0.00 H new ATOM 0 HD22 ASN A1000 6.225 8.813 8.847 1.00 0.00 H new ATOM 1391 N LYS A1001 5.938 12.641 5.497 1.00 0.00 N ATOM 1392 CA LYS A1001 6.218 13.616 4.450 1.00 0.00 C ATOM 1393 C LYS A1001 4.959 14.421 4.184 1.00 0.00 C ATOM 1394 O LYS A1001 4.987 15.640 4.003 1.00 0.00 O ATOM 1395 CB LYS A1001 6.678 12.911 3.168 1.00 0.00 C ATOM 1396 CG LYS A1001 7.700 11.808 3.406 1.00 0.00 C ATOM 1397 CD LYS A1001 8.923 12.311 4.159 1.00 0.00 C ATOM 1398 CE LYS A1001 9.891 11.177 4.463 1.00 0.00 C ATOM 1399 NZ LYS A1001 11.069 11.639 5.244 1.00 0.00 N ATOM 0 H LYS A1001 5.787 11.692 5.156 1.00 0.00 H new ATOM 0 HA LYS A1001 7.019 14.280 4.775 1.00 0.00 H new ATOM 0 HB2 LYS A1001 5.809 12.486 2.666 1.00 0.00 H new ATOM 0 HB3 LYS A1001 7.106 13.651 2.491 1.00 0.00 H new ATOM 0 HG2 LYS A1001 7.235 11.000 3.970 1.00 0.00 H new ATOM 0 HG3 LYS A1001 8.011 11.390 2.448 1.00 0.00 H new ATOM 0 HD2 LYS A1001 9.428 13.074 3.567 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.610 12.784 5.090 1.00 0.00 H new ATOM 0 HE2 LYS A1001 9.371 10.397 5.020 1.00 0.00 H new ATOM 0 HE3 LYS A1001 10.229 10.730 3.528 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 11.701 10.834 5.428 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 11.581 12.365 4.703 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 10.750 12.042 6.148 1.00 0.00 H new ATOM 1413 N MET A1002 3.847 13.716 4.247 1.00 0.00 N ATOM 1414 CA MET A1002 2.538 14.316 4.111 1.00 0.00 C ATOM 1415 C MET A1002 2.330 15.317 5.231 1.00 0.00 C ATOM 1416 O MET A1002 1.647 16.333 5.086 1.00 0.00 O ATOM 1417 CB MET A1002 1.471 13.220 4.195 1.00 0.00 C ATOM 1418 CG MET A1002 0.050 13.743 4.272 1.00 0.00 C ATOM 1419 SD MET A1002 -1.062 12.915 3.122 1.00 0.00 S ATOM 1420 CE MET A1002 -0.740 11.192 3.491 1.00 0.00 C ATOM 0 H MET A1002 3.828 12.707 4.395 1.00 0.00 H new ATOM 0 HA MET A1002 2.461 14.825 3.150 1.00 0.00 H new ATOM 0 HB2 MET A1002 1.561 12.572 3.323 1.00 0.00 H new ATOM 0 HB3 MET A1002 1.668 12.603 5.072 1.00 0.00 H new ATOM 0 HG2 MET A1002 -0.325 13.616 5.288 1.00 0.00 H new ATOM 0 HG3 MET A1002 0.050 14.813 4.064 1.00 0.00 H new ATOM 0 HE1 MET A1002 -0.424 10.678 2.583 1.00 0.00 H new ATOM 0 HE2 MET A1002 0.048 11.122 4.241 1.00 0.00 H new ATOM 0 HE3 MET A1002 -1.648 10.726 3.874 1.00 0.00 H new ATOM 1430 N LYS A1003 2.989 15.042 6.342 1.00 0.00 N ATOM 1431 CA LYS A1003 2.706 15.729 7.572 1.00 0.00 C ATOM 1432 C LYS A1003 3.246 17.148 7.538 1.00 0.00 C ATOM 1433 O LYS A1003 2.549 18.098 7.886 1.00 0.00 O ATOM 1434 CB LYS A1003 3.293 14.979 8.761 1.00 0.00 C ATOM 1435 CG LYS A1003 2.334 14.884 9.931 1.00 0.00 C ATOM 1436 CD LYS A1003 1.200 13.914 9.635 1.00 0.00 C ATOM 1437 CE LYS A1003 0.140 13.938 10.725 1.00 0.00 C ATOM 1438 NZ LYS A1003 0.708 13.700 12.078 1.00 0.00 N ATOM 0 H LYS A1003 3.727 14.341 6.409 1.00 0.00 H new ATOM 0 HA LYS A1003 1.623 15.771 7.685 1.00 0.00 H new ATOM 0 HB2 LYS A1003 3.575 13.974 8.447 1.00 0.00 H new ATOM 0 HB3 LYS A1003 4.205 15.480 9.085 1.00 0.00 H new ATOM 0 HG2 LYS A1003 2.873 14.557 10.821 1.00 0.00 H new ATOM 0 HG3 LYS A1003 1.925 15.870 10.150 1.00 0.00 H new ATOM 0 HD2 LYS A1003 0.744 14.169 8.678 1.00 0.00 H new ATOM 0 HD3 LYS A1003 1.600 12.905 9.539 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -0.368 14.903 10.712 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -0.613 13.179 10.512 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -0.065 13.558 12.759 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 1.311 12.853 12.057 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 1.276 14.523 12.366 1.00 0.00 H new ATOM 1452 N LEU A1004 4.489 17.287 7.105 1.00 0.00 N ATOM 1453 CA LEU A1004 5.122 18.597 7.016 1.00 0.00 C ATOM 1454 C LEU A1004 4.636 19.358 5.792 1.00 0.00 C ATOM 1455 O LEU A1004 4.822 20.565 5.702 1.00 0.00 O ATOM 1456 CB LEU A1004 6.653 18.494 6.980 1.00 0.00 C ATOM 1457 CG LEU A1004 7.357 18.126 8.298 1.00 0.00 C ATOM 1458 CD1 LEU A1004 7.020 19.128 9.389 1.00 0.00 C ATOM 1459 CD2 LEU A1004 7.006 16.713 8.740 1.00 0.00 C ATOM 0 H LEU A1004 5.081 16.511 6.809 1.00 0.00 H new ATOM 0 HA LEU A1004 4.836 19.143 7.915 1.00 0.00 H new ATOM 0 HB2 LEU A1004 6.926 17.751 6.231 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.049 19.450 6.639 1.00 0.00 H new ATOM 0 HG LEU A1004 8.432 18.161 8.118 1.00 0.00 H new ATOM 0 HD11 LEU A1004 7.529 18.847 10.311 1.00 0.00 H new ATOM 0 HD12 LEU A1004 7.346 20.122 9.083 1.00 0.00 H new ATOM 0 HD13 LEU A1004 5.943 19.135 9.557 1.00 0.00 H new ATOM 0 HD21 LEU A1004 7.520 16.486 9.674 1.00 0.00 H new ATOM 0 HD22 LEU A1004 5.929 16.636 8.890 1.00 0.00 H new ATOM 0 HD23 LEU A1004 7.317 16.004 7.973 1.00 0.00 H new ATOM 1471 N ALA A1005 3.974 18.686 4.869 1.00 0.00 N ATOM 1472 CA ALA A1005 3.536 19.369 3.666 1.00 0.00 C ATOM 1473 C ALA A1005 2.324 20.256 3.961 1.00 0.00 C ATOM 1474 O ALA A1005 2.157 21.288 3.337 1.00 0.00 O ATOM 1475 CB ALA A1005 3.283 18.393 2.537 1.00 0.00 C ATOM 0 H ALA A1005 3.733 17.696 4.924 1.00 0.00 H new ATOM 0 HA ALA A1005 4.339 20.024 3.329 1.00 0.00 H new ATOM 0 HB1 ALA A1005 2.956 18.938 1.651 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.202 17.851 2.312 1.00 0.00 H new ATOM 0 HB3 ALA A1005 2.508 17.686 2.834 1.00 0.00 H new ATOM 1481 N GLN A1006 1.478 19.852 4.900 1.00 0.00 N ATOM 1482 CA GLN A1006 0.473 20.765 5.477 1.00 0.00 C ATOM 1483 C GLN A1006 1.123 21.750 6.449 1.00 0.00 C ATOM 1484 O GLN A1006 0.694 22.908 6.501 1.00 0.00 O ATOM 1485 CB GLN A1006 -0.683 20.005 6.147 1.00 0.00 C ATOM 1486 CG GLN A1006 -0.285 19.131 7.328 1.00 0.00 C ATOM 1487 CD GLN A1006 -0.222 19.895 8.635 1.00 0.00 C ATOM 1488 OE1 GLN A1006 -0.956 20.862 8.837 1.00 0.00 O ATOM 1489 NE2 GLN A1006 0.663 19.477 9.521 1.00 0.00 N ATOM 0 H GLN A1006 1.459 18.907 5.283 1.00 0.00 H new ATOM 0 HA GLN A1006 0.044 21.334 4.652 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -1.425 20.729 6.485 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -1.167 19.378 5.398 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -1.000 18.314 7.425 1.00 0.00 H new ATOM 0 HG3 GLN A1006 0.688 18.682 7.129 1.00 0.00 H new ATOM 0 HE21 GLN A1006 1.252 18.671 9.312 1.00 0.00 H new ATOM 0 HE22 GLN A1006 0.758 19.960 10.414 1.00 0.00 H new ATOM 1498 N GLN A1007 2.173 21.330 7.163 1.00 0.00 N ATOM 1499 CA GLN A1007 2.901 22.240 8.056 1.00 0.00 C ATOM 1500 C GLN A1007 3.230 23.539 7.339 1.00 0.00 C ATOM 1501 O GLN A1007 3.059 24.629 7.886 1.00 0.00 O ATOM 1502 CB GLN A1007 4.177 21.585 8.583 1.00 0.00 C ATOM 1503 CG GLN A1007 3.919 20.529 9.644 1.00 0.00 C ATOM 1504 CD GLN A1007 3.271 21.098 10.891 1.00 0.00 C ATOM 1505 OE1 GLN A1007 2.492 20.421 11.561 1.00 0.00 O ATOM 1506 NE2 GLN A1007 3.609 22.332 11.230 1.00 0.00 N ATOM 0 H GLN A1007 2.535 20.377 7.142 1.00 0.00 H new ATOM 0 HA GLN A1007 2.258 22.464 8.907 1.00 0.00 H new ATOM 0 HB2 GLN A1007 4.713 21.130 7.751 1.00 0.00 H new ATOM 0 HB3 GLN A1007 4.827 22.355 8.998 1.00 0.00 H new ATOM 0 HG2 GLN A1007 3.278 19.752 9.229 1.00 0.00 H new ATOM 0 HG3 GLN A1007 4.862 20.053 9.914 1.00 0.00 H new ATOM 0 HE21 GLN A1007 4.258 22.861 10.648 1.00 0.00 H new ATOM 0 HE22 GLN A1007 3.220 22.754 12.073 1.00 0.00 H new ATOM 1515 N TYR A1008 3.691 23.432 6.105 1.00 0.00 N ATOM 1516 CA TYR A1008 3.824 24.609 5.279 1.00 0.00 C ATOM 1517 C TYR A1008 3.182 24.398 3.922 1.00 0.00 C ATOM 1518 O TYR A1008 3.787 24.691 2.890 1.00 0.00 O ATOM 1519 CB TYR A1008 5.284 25.039 5.137 1.00 0.00 C ATOM 1520 CG TYR A1008 5.764 25.887 6.288 1.00 0.00 C ATOM 1521 CD1 TYR A1008 6.183 25.307 7.476 1.00 0.00 C ATOM 1522 CD2 TYR A1008 5.772 27.271 6.193 1.00 0.00 C ATOM 1523 CE1 TYR A1008 6.598 26.081 8.538 1.00 0.00 C ATOM 1524 CE2 TYR A1008 6.192 28.054 7.246 1.00 0.00 C ATOM 1525 CZ TYR A1008 6.600 27.457 8.419 1.00 0.00 C ATOM 1526 OH TYR A1008 7.005 28.242 9.474 1.00 0.00 O ATOM 0 H TYR A1008 3.974 22.557 5.663 1.00 0.00 H new ATOM 0 HA TYR A1008 3.295 25.419 5.780 1.00 0.00 H new ATOM 0 HB2 TYR A1008 5.912 24.152 5.060 1.00 0.00 H new ATOM 0 HB3 TYR A1008 5.404 25.596 4.208 1.00 0.00 H new ATOM 0 HD1 TYR A1008 6.184 24.231 7.570 1.00 0.00 H new ATOM 0 HD2 TYR A1008 5.444 27.742 5.279 1.00 0.00 H new ATOM 0 HE1 TYR A1008 6.920 25.615 9.457 1.00 0.00 H new ATOM 0 HE2 TYR A1008 6.201 29.130 7.153 1.00 0.00 H new ATOM 0 HH TYR A1008 6.946 29.187 9.220 1.00 0.00 H new ATOM 1536 N VAL A1009 1.951 23.869 3.928 1.00 0.00 N ATOM 1537 CA VAL A1009 1.102 23.859 2.733 1.00 0.00 C ATOM 1538 C VAL A1009 1.035 25.255 2.145 1.00 0.00 C ATOM 1539 O VAL A1009 0.787 25.449 0.957 1.00 0.00 O ATOM 1540 CB VAL A1009 -0.331 23.367 3.056 1.00 0.00 C ATOM 1541 CG1 VAL A1009 -0.969 24.258 4.110 1.00 0.00 C ATOM 1542 CG2 VAL A1009 -1.186 23.328 1.797 1.00 0.00 C ATOM 0 H VAL A1009 1.522 23.442 4.749 1.00 0.00 H new ATOM 0 HA VAL A1009 1.543 23.169 2.014 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.266 22.353 3.451 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -1.976 23.901 4.327 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -0.370 24.231 5.020 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -1.019 25.282 3.739 1.00 0.00 H new ATOM 0 HG21 VAL A1009 -2.188 22.980 2.048 1.00 0.00 H new ATOM 0 HG22 VAL A1009 -1.247 24.328 1.367 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -0.737 22.649 1.073 1.00 0.00 H new ATOM 1552 N MET A1010 1.270 26.215 3.021 1.00 0.00 N ATOM 1553 CA MET A1010 1.347 27.611 2.651 1.00 0.00 C ATOM 1554 C MET A1010 2.264 27.806 1.441 1.00 0.00 C ATOM 1555 O MET A1010 1.905 28.528 0.512 1.00 0.00 O ATOM 1556 CB MET A1010 1.857 28.438 3.833 1.00 0.00 C ATOM 1557 CG MET A1010 1.160 28.129 5.150 1.00 0.00 C ATOM 1558 SD MET A1010 -0.634 28.293 5.046 1.00 0.00 S ATOM 1559 CE MET A1010 -1.123 27.687 6.661 1.00 0.00 C ATOM 0 H MET A1010 1.413 26.043 4.016 1.00 0.00 H new ATOM 0 HA MET A1010 0.347 27.949 2.380 1.00 0.00 H new ATOM 0 HB2 MET A1010 2.927 28.264 3.950 1.00 0.00 H new ATOM 0 HB3 MET A1010 1.729 29.496 3.605 1.00 0.00 H new ATOM 0 HG2 MET A1010 1.410 27.114 5.459 1.00 0.00 H new ATOM 0 HG3 MET A1010 1.538 28.800 5.922 1.00 0.00 H new ATOM 0 HE1 MET A1010 -2.209 27.726 6.751 1.00 0.00 H new ATOM 0 HE2 MET A1010 -0.786 26.658 6.781 1.00 0.00 H new ATOM 0 HE3 MET A1010 -0.673 28.309 7.435 1.00 0.00 H new ATOM 1569 N THR A1011 3.436 27.150 1.437 1.00 0.00 N ATOM 1570 CA THR A1011 4.391 27.321 0.331 1.00 0.00 C ATOM 1571 C THR A1011 5.349 26.127 0.133 1.00 0.00 C ATOM 1572 O THR A1011 4.975 25.069 -0.421 1.00 0.00 O ATOM 1573 CB THR A1011 5.252 28.598 0.518 1.00 0.00 C ATOM 1574 OG1 THR A1011 5.602 28.757 1.902 1.00 0.00 O ATOM 1575 CG2 THR A1011 4.542 29.847 0.009 1.00 0.00 C ATOM 0 H THR A1011 3.740 26.510 2.170 1.00 0.00 H new ATOM 0 HA THR A1011 3.763 27.401 -0.556 1.00 0.00 H new ATOM 0 HB THR A1011 6.158 28.473 -0.075 1.00 0.00 H new ATOM 0 HG1 THR A1011 6.147 29.564 2.011 1.00 0.00 H new ATOM 0 HG21 THR A1011 5.182 30.716 0.160 1.00 0.00 H new ATOM 0 HG22 THR A1011 4.327 29.735 -1.054 1.00 0.00 H new ATOM 0 HG23 THR A1011 3.609 29.984 0.556 1.00 0.00 H new ATOM 1583 N SER A1012 6.579 26.316 0.618 1.00 0.00 N ATOM 1584 CA SER A1012 7.719 25.477 0.268 1.00 0.00 C ATOM 1585 C SER A1012 7.493 24.008 0.590 1.00 0.00 C ATOM 1586 O SER A1012 7.475 23.173 -0.320 1.00 0.00 O ATOM 1587 CB SER A1012 8.977 25.996 0.974 1.00 0.00 C ATOM 1588 OG SER A1012 8.735 26.207 2.357 1.00 0.00 O ATOM 0 H SER A1012 6.810 27.065 1.271 1.00 0.00 H new ATOM 0 HA SER A1012 7.849 25.539 -0.812 1.00 0.00 H new ATOM 0 HB2 SER A1012 9.790 25.281 0.849 1.00 0.00 H new ATOM 0 HB3 SER A1012 9.299 26.929 0.511 1.00 0.00 H new ATOM 0 HG SER A1012 9.552 26.536 2.786 1.00 0.00 H new ATOM 1594 N LEU A1013 7.339 23.689 1.876 1.00 0.00 N ATOM 1595 CA LEU A1013 7.109 22.318 2.312 1.00 0.00 C ATOM 1596 C LEU A1013 6.071 21.620 1.485 1.00 0.00 C ATOM 1597 O LEU A1013 6.260 20.469 1.110 1.00 0.00 O ATOM 1598 CB LEU A1013 6.623 22.291 3.753 1.00 0.00 C ATOM 1599 CG LEU A1013 7.706 21.997 4.803 1.00 0.00 C ATOM 1600 CD1 LEU A1013 8.937 22.861 4.571 1.00 0.00 C ATOM 1601 CD2 LEU A1013 7.182 22.223 6.212 1.00 0.00 C ATOM 0 H LEU A1013 7.370 24.369 2.635 1.00 0.00 H new ATOM 0 HA LEU A1013 8.065 21.806 2.204 1.00 0.00 H new ATOM 0 HB2 LEU A1013 6.167 23.254 3.984 1.00 0.00 H new ATOM 0 HB3 LEU A1013 5.840 21.538 3.841 1.00 0.00 H new ATOM 0 HG LEU A1013 7.984 20.948 4.698 1.00 0.00 H new ATOM 0 HD11 LEU A1013 9.689 22.634 5.327 1.00 0.00 H new ATOM 0 HD12 LEU A1013 9.344 22.656 3.581 1.00 0.00 H new ATOM 0 HD13 LEU A1013 8.661 23.913 4.638 1.00 0.00 H new ATOM 0 HD21 LEU A1013 7.971 22.007 6.933 1.00 0.00 H new ATOM 0 HD22 LEU A1013 6.866 23.260 6.320 1.00 0.00 H new ATOM 0 HD23 LEU A1013 6.333 21.564 6.395 1.00 0.00 H new ATOM 1613 N GLN A1014 4.993 22.322 1.190 1.00 0.00 N ATOM 1614 CA GLN A1014 3.837 21.684 0.620 1.00 0.00 C ATOM 1615 C GLN A1014 4.220 20.925 -0.642 1.00 0.00 C ATOM 1616 O GLN A1014 3.879 19.763 -0.806 1.00 0.00 O ATOM 1617 CB GLN A1014 2.759 22.715 0.331 1.00 0.00 C ATOM 1618 CG GLN A1014 1.678 22.217 -0.605 1.00 0.00 C ATOM 1619 CD GLN A1014 1.475 23.139 -1.791 1.00 0.00 C ATOM 1620 OE1 GLN A1014 2.556 23.765 -2.238 1.00 0.00 O flip ATOM 1621 NE2 GLN A1014 0.373 23.270 -2.322 1.00 0.00 N flip ATOM 0 H GLN A1014 4.900 23.327 1.337 1.00 0.00 H new ATOM 0 HA GLN A1014 3.439 20.966 1.337 1.00 0.00 H new ATOM 0 HB2 GLN A1014 2.301 23.022 1.271 1.00 0.00 H new ATOM 0 HB3 GLN A1014 3.223 23.601 -0.102 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.940 21.221 -0.962 1.00 0.00 H new ATOM 0 HG3 GLN A1014 0.741 22.122 -0.057 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -0.435 22.772 -1.949 1.00 0.00 H new ATOM 0 HE22 GLN A1014 0.268 23.877 -3.135 1.00 0.00 H new ATOM 1630 N GLN A1015 4.972 21.592 -1.519 1.00 0.00 N ATOM 1631 CA GLN A1015 5.351 20.975 -2.792 1.00 0.00 C ATOM 1632 C GLN A1015 6.347 19.824 -2.601 1.00 0.00 C ATOM 1633 O GLN A1015 6.109 18.722 -3.083 1.00 0.00 O ATOM 1634 CB GLN A1015 5.921 22.007 -3.768 1.00 0.00 C ATOM 1635 CG GLN A1015 4.898 22.991 -4.305 1.00 0.00 C ATOM 1636 CD GLN A1015 5.534 24.086 -5.136 1.00 0.00 C ATOM 1637 OE1 GLN A1015 6.667 24.503 -4.881 1.00 0.00 O ATOM 1638 NE2 GLN A1015 4.822 24.549 -6.150 1.00 0.00 N ATOM 0 H GLN A1015 5.324 22.539 -1.377 1.00 0.00 H new ATOM 0 HA GLN A1015 4.437 20.561 -3.218 1.00 0.00 H new ATOM 0 HB2 GLN A1015 6.715 22.563 -3.268 1.00 0.00 H new ATOM 0 HB3 GLN A1015 6.378 21.482 -4.607 1.00 0.00 H new ATOM 0 HG2 GLN A1015 4.167 22.457 -4.911 1.00 0.00 H new ATOM 0 HG3 GLN A1015 4.356 23.439 -3.472 1.00 0.00 H new ATOM 0 HE21 GLN A1015 3.889 24.179 -6.329 1.00 0.00 H new ATOM 0 HE22 GLN A1015 5.206 25.276 -6.753 1.00 0.00 H new ATOM 1647 N GLU A1016 7.437 20.059 -1.882 1.00 0.00 N ATOM 1648 CA GLU A1016 8.475 19.035 -1.714 1.00 0.00 C ATOM 1649 C GLU A1016 7.941 17.830 -0.952 1.00 0.00 C ATOM 1650 O GLU A1016 8.110 16.683 -1.367 1.00 0.00 O ATOM 1651 CB GLU A1016 9.664 19.612 -0.954 1.00 0.00 C ATOM 1652 CG GLU A1016 10.751 18.585 -0.677 1.00 0.00 C ATOM 1653 CD GLU A1016 11.411 18.063 -1.938 1.00 0.00 C ATOM 1654 OE1 GLU A1016 12.170 18.824 -2.575 1.00 0.00 O ATOM 1655 OE2 GLU A1016 11.174 16.892 -2.302 1.00 0.00 O ATOM 0 H GLU A1016 7.630 20.941 -1.407 1.00 0.00 H new ATOM 0 HA GLU A1016 8.787 18.715 -2.708 1.00 0.00 H new ATOM 0 HB2 GLU A1016 10.089 20.436 -1.527 1.00 0.00 H new ATOM 0 HB3 GLU A1016 9.316 20.028 -0.008 1.00 0.00 H new ATOM 0 HG2 GLU A1016 11.510 19.032 -0.035 1.00 0.00 H new ATOM 0 HG3 GLU A1016 10.321 17.749 -0.126 1.00 0.00 H new ATOM 1662 N TYR A1017 7.277 18.111 0.149 1.00 0.00 N ATOM 1663 CA TYR A1017 6.819 17.099 1.070 1.00 0.00 C ATOM 1664 C TYR A1017 5.718 16.227 0.498 1.00 0.00 C ATOM 1665 O TYR A1017 5.659 15.040 0.764 1.00 0.00 O ATOM 1666 CB TYR A1017 6.322 17.803 2.312 1.00 0.00 C ATOM 1667 CG TYR A1017 7.445 17.917 3.317 1.00 0.00 C ATOM 1668 CD1 TYR A1017 7.824 16.815 4.074 1.00 0.00 C ATOM 1669 CD2 TYR A1017 8.159 19.094 3.473 1.00 0.00 C ATOM 1670 CE1 TYR A1017 8.874 16.887 4.963 1.00 0.00 C ATOM 1671 CE2 TYR A1017 9.220 19.170 4.356 1.00 0.00 C ATOM 1672 CZ TYR A1017 9.570 18.065 5.099 1.00 0.00 C ATOM 1673 OH TYR A1017 10.628 18.134 5.975 1.00 0.00 O ATOM 0 H TYR A1017 7.038 19.062 0.431 1.00 0.00 H new ATOM 0 HA TYR A1017 7.652 16.430 1.289 1.00 0.00 H new ATOM 0 HB2 TYR A1017 5.949 18.794 2.055 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.488 17.251 2.745 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.286 15.885 3.963 1.00 0.00 H new ATOM 0 HD2 TYR A1017 7.883 19.965 2.897 1.00 0.00 H new ATOM 0 HE1 TYR A1017 9.149 16.023 5.550 1.00 0.00 H new ATOM 0 HE2 TYR A1017 9.772 20.092 4.463 1.00 0.00 H new ATOM 0 HH TYR A1017 11.013 19.035 5.952 1.00 0.00 H new ATOM 1683 N LYS A1018 4.833 16.867 -0.276 1.00 0.00 N ATOM 1684 CA LYS A1018 3.661 16.220 -0.864 1.00 0.00 C ATOM 1685 C LYS A1018 4.055 15.456 -2.126 1.00 0.00 C ATOM 1686 O LYS A1018 3.416 14.471 -2.489 1.00 0.00 O ATOM 1687 CB LYS A1018 2.578 17.262 -1.189 1.00 0.00 C ATOM 1688 CG LYS A1018 1.218 16.680 -1.572 1.00 0.00 C ATOM 1689 CD LYS A1018 0.437 16.182 -0.357 1.00 0.00 C ATOM 1690 CE LYS A1018 -0.886 15.553 -0.775 1.00 0.00 C ATOM 1691 NZ LYS A1018 -1.686 15.063 0.384 1.00 0.00 N ATOM 0 H LYS A1018 4.914 17.856 -0.512 1.00 0.00 H new ATOM 0 HA LYS A1018 3.256 15.514 -0.139 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.448 17.911 -0.323 1.00 0.00 H new ATOM 0 HB3 LYS A1018 2.932 17.889 -2.007 1.00 0.00 H new ATOM 0 HG2 LYS A1018 0.633 17.440 -2.090 1.00 0.00 H new ATOM 0 HG3 LYS A1018 1.362 15.856 -2.271 1.00 0.00 H new ATOM 0 HD2 LYS A1018 1.034 15.451 0.188 1.00 0.00 H new ATOM 0 HD3 LYS A1018 0.249 17.012 0.324 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -1.471 16.285 -1.331 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -0.690 14.722 -1.452 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -2.478 14.484 0.039 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -1.081 14.488 1.005 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -2.057 15.875 0.918 1.00 0.00 H new ATOM 1705 N LYS A1019 5.104 15.917 -2.805 1.00 0.00 N ATOM 1706 CA LYS A1019 5.634 15.184 -3.948 1.00 0.00 C ATOM 1707 C LYS A1019 6.366 13.960 -3.440 1.00 0.00 C ATOM 1708 O LYS A1019 6.087 12.845 -3.848 1.00 0.00 O ATOM 1709 CB LYS A1019 6.558 16.057 -4.799 1.00 0.00 C ATOM 1710 CG LYS A1019 5.846 16.796 -5.926 1.00 0.00 C ATOM 1711 CD LYS A1019 4.678 17.629 -5.421 1.00 0.00 C ATOM 1712 CE LYS A1019 4.006 18.395 -6.547 1.00 0.00 C ATOM 1713 NZ LYS A1019 3.392 17.484 -7.548 1.00 0.00 N ATOM 0 H LYS A1019 5.597 16.783 -2.586 1.00 0.00 H new ATOM 0 HA LYS A1019 4.808 14.881 -4.591 1.00 0.00 H new ATOM 0 HB2 LYS A1019 7.049 16.785 -4.154 1.00 0.00 H new ATOM 0 HB3 LYS A1019 7.341 15.431 -5.226 1.00 0.00 H new ATOM 0 HG2 LYS A1019 6.557 17.444 -6.439 1.00 0.00 H new ATOM 0 HG3 LYS A1019 5.485 16.075 -6.660 1.00 0.00 H new ATOM 0 HD2 LYS A1019 3.949 16.978 -4.938 1.00 0.00 H new ATOM 0 HD3 LYS A1019 5.031 18.330 -4.664 1.00 0.00 H new ATOM 0 HE2 LYS A1019 3.239 19.050 -6.133 1.00 0.00 H new ATOM 0 HE3 LYS A1019 4.739 19.034 -7.039 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 2.803 18.036 -8.204 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.141 16.998 -8.081 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 2.802 16.780 -7.061 1.00 0.00 H new ATOM 1727 N GLN A1020 7.292 14.191 -2.528 1.00 0.00 N ATOM 1728 CA GLN A1020 7.858 13.139 -1.697 1.00 0.00 C ATOM 1729 C GLN A1020 6.752 12.308 -1.044 1.00 0.00 C ATOM 1730 O GLN A1020 6.919 11.107 -0.847 1.00 0.00 O ATOM 1731 CB GLN A1020 8.754 13.790 -0.641 1.00 0.00 C ATOM 1732 CG GLN A1020 9.342 12.831 0.375 1.00 0.00 C ATOM 1733 CD GLN A1020 10.413 13.481 1.233 1.00 0.00 C ATOM 1734 OE1 GLN A1020 10.331 14.793 1.403 1.00 0.00 O flip ATOM 1735 NE2 GLN A1020 11.323 12.811 1.722 1.00 0.00 N flip ATOM 0 H GLN A1020 7.676 15.117 -2.340 1.00 0.00 H new ATOM 0 HA GLN A1020 8.449 12.459 -2.310 1.00 0.00 H new ATOM 0 HB2 GLN A1020 9.570 14.307 -1.146 1.00 0.00 H new ATOM 0 HB3 GLN A1020 8.176 14.548 -0.112 1.00 0.00 H new ATOM 0 HG2 GLN A1020 8.546 12.453 1.017 1.00 0.00 H new ATOM 0 HG3 GLN A1020 9.768 11.972 -0.144 1.00 0.00 H new ATOM 0 HE21 GLN A1020 11.353 11.803 1.569 1.00 0.00 H new ATOM 0 HE22 GLN A1020 12.047 13.264 2.280 1.00 0.00 H new ATOM 1744 N MET A1021 5.618 12.926 -0.740 1.00 0.00 N ATOM 1745 CA MET A1021 4.491 12.199 -0.179 1.00 0.00 C ATOM 1746 C MET A1021 3.896 11.261 -1.208 1.00 0.00 C ATOM 1747 O MET A1021 3.718 10.084 -0.933 1.00 0.00 O ATOM 1748 CB MET A1021 3.401 13.145 0.324 1.00 0.00 C ATOM 1749 CG MET A1021 2.286 12.443 1.074 1.00 0.00 C ATOM 1750 SD MET A1021 0.642 12.899 0.482 1.00 0.00 S ATOM 1751 CE MET A1021 0.560 12.029 -1.080 1.00 0.00 C ATOM 0 H MET A1021 5.456 13.924 -0.872 1.00 0.00 H new ATOM 0 HA MET A1021 4.871 11.625 0.666 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.853 13.892 0.977 1.00 0.00 H new ATOM 0 HB3 MET A1021 2.976 13.680 -0.525 1.00 0.00 H new ATOM 0 HG2 MET A1021 2.414 11.365 0.979 1.00 0.00 H new ATOM 0 HG3 MET A1021 2.363 12.681 2.135 1.00 0.00 H new ATOM 0 HE1 MET A1021 -0.483 11.873 -1.355 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.054 12.619 -1.852 1.00 0.00 H new ATOM 0 HE3 MET A1021 1.059 11.064 -0.986 1.00 0.00 H new ATOM 1761 N LEU A1022 3.598 11.767 -2.405 1.00 0.00 N ATOM 1762 CA LEU A1022 2.907 10.943 -3.381 1.00 0.00 C ATOM 1763 C LEU A1022 3.905 10.093 -4.157 1.00 0.00 C ATOM 1764 O LEU A1022 3.524 9.228 -4.926 1.00 0.00 O ATOM 1765 CB LEU A1022 2.021 11.783 -4.321 1.00 0.00 C ATOM 1766 CG LEU A1022 2.457 11.830 -5.790 1.00 0.00 C ATOM 1767 CD1 LEU A1022 1.284 12.221 -6.672 1.00 0.00 C ATOM 1768 CD2 LEU A1022 3.601 12.817 -5.984 1.00 0.00 C ATOM 0 H LEU A1022 3.818 12.715 -2.711 1.00 0.00 H new ATOM 0 HA LEU A1022 2.237 10.274 -2.841 1.00 0.00 H new ATOM 0 HB2 LEU A1022 1.005 11.391 -4.276 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.986 12.804 -3.940 1.00 0.00 H new ATOM 0 HG LEU A1022 2.804 10.837 -6.074 1.00 0.00 H new ATOM 0 HD11 LEU A1022 1.606 12.251 -7.713 1.00 0.00 H new ATOM 0 HD12 LEU A1022 0.485 11.488 -6.560 1.00 0.00 H new ATOM 0 HD13 LEU A1022 0.919 13.205 -6.377 1.00 0.00 H new ATOM 0 HD21 LEU A1022 3.893 12.833 -7.034 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.277 13.813 -5.682 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.452 12.512 -5.375 1.00 0.00 H new ATOM 1780 N THR A1023 5.188 10.373 -3.970 1.00 0.00 N ATOM 1781 CA THR A1023 6.241 9.526 -4.502 1.00 0.00 C ATOM 1782 C THR A1023 6.484 8.364 -3.549 1.00 0.00 C ATOM 1783 O THR A1023 6.766 7.250 -3.976 1.00 0.00 O ATOM 1784 CB THR A1023 7.549 10.313 -4.737 1.00 0.00 C ATOM 1785 OG1 THR A1023 7.341 11.302 -5.754 1.00 0.00 O ATOM 1786 CG2 THR A1023 8.691 9.394 -5.150 1.00 0.00 C ATOM 0 H THR A1023 5.523 11.185 -3.451 1.00 0.00 H new ATOM 0 HA THR A1023 5.916 9.146 -5.471 1.00 0.00 H new ATOM 0 HB THR A1023 7.824 10.793 -3.798 1.00 0.00 H new ATOM 0 HG1 THR A1023 6.880 12.076 -5.368 1.00 0.00 H new ATOM 0 HG21 THR A1023 9.594 9.984 -5.306 1.00 0.00 H new ATOM 0 HG22 THR A1023 8.869 8.659 -4.365 1.00 0.00 H new ATOM 0 HG23 THR A1023 8.428 8.880 -6.075 1.00 0.00 H new ATOM 1794 N ALA A1024 6.345 8.629 -2.254 1.00 0.00 N ATOM 1795 CA ALA A1024 6.359 7.569 -1.254 1.00 0.00 C ATOM 1796 C ALA A1024 5.010 6.875 -1.244 1.00 0.00 C ATOM 1797 O ALA A1024 4.875 5.752 -0.779 1.00 0.00 O ATOM 1798 CB ALA A1024 6.698 8.117 0.124 1.00 0.00 C ATOM 0 H ALA A1024 6.222 9.567 -1.874 1.00 0.00 H new ATOM 0 HA ALA A1024 7.133 6.847 -1.513 1.00 0.00 H new ATOM 0 HB1 ALA A1024 6.701 7.303 0.849 1.00 0.00 H new ATOM 0 HB2 ALA A1024 7.683 8.583 0.098 1.00 0.00 H new ATOM 0 HB3 ALA A1024 5.953 8.858 0.414 1.00 0.00 H new ATOM 1804 N ALA A1025 4.006 7.576 -1.735 1.00 0.00 N ATOM 1805 CA ALA A1025 2.700 6.995 -1.992 1.00 0.00 C ATOM 1806 C ALA A1025 2.674 6.350 -3.373 1.00 0.00 C ATOM 1807 O ALA A1025 1.853 5.481 -3.627 1.00 0.00 O ATOM 1808 CB ALA A1025 1.594 8.016 -1.824 1.00 0.00 C ATOM 0 H ALA A1025 4.072 8.567 -1.968 1.00 0.00 H new ATOM 0 HA ALA A1025 2.518 6.216 -1.252 1.00 0.00 H new ATOM 0 HB1 ALA A1025 0.631 7.546 -2.024 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.605 8.400 -0.804 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.749 8.838 -2.523 1.00 0.00 H new ATOM 1814 N HIS A1026 3.542 6.778 -4.276 1.00 0.00 N ATOM 1815 CA HIS A1026 3.788 6.005 -5.490 1.00 0.00 C ATOM 1816 C HIS A1026 4.656 4.809 -5.133 1.00 0.00 C ATOM 1817 O HIS A1026 4.624 3.796 -5.804 1.00 0.00 O ATOM 1818 CB HIS A1026 4.433 6.850 -6.593 1.00 0.00 C ATOM 1819 CG HIS A1026 4.630 6.108 -7.881 1.00 0.00 C ATOM 1820 ND1 HIS A1026 5.867 5.729 -8.351 1.00 0.00 N ATOM 1821 CD2 HIS A1026 3.733 5.661 -8.792 1.00 0.00 C ATOM 1822 CE1 HIS A1026 5.723 5.084 -9.492 1.00 0.00 C ATOM 1823 NE2 HIS A1026 4.438 5.027 -9.782 1.00 0.00 N ATOM 0 H HIS A1026 4.081 7.640 -4.198 1.00 0.00 H new ATOM 0 HA HIS A1026 2.834 5.664 -5.891 1.00 0.00 H new ATOM 0 HB2 HIS A1026 3.811 7.725 -6.779 1.00 0.00 H new ATOM 0 HB3 HIS A1026 5.399 7.214 -6.242 1.00 0.00 H new ATOM 0 HD2 HIS A1026 2.661 5.782 -8.747 1.00 0.00 H new ATOM 0 HE1 HIS A1026 6.523 4.672 -10.089 1.00 0.00 H new ATOM 0 HE2 HIS A1026 4.035 4.584 -10.607 1.00 0.00 H new ATOM 1832 N ALA A1027 5.406 4.942 -4.053 1.00 0.00 N ATOM 1833 CA ALA A1027 6.040 3.818 -3.367 1.00 0.00 C ATOM 1834 C ALA A1027 4.985 2.987 -2.669 1.00 0.00 C ATOM 1835 O ALA A1027 5.064 1.766 -2.674 1.00 0.00 O ATOM 1836 CB ALA A1027 7.055 4.333 -2.358 1.00 0.00 C ATOM 0 H ALA A1027 5.597 5.844 -3.618 1.00 0.00 H new ATOM 0 HA ALA A1027 6.557 3.195 -4.097 1.00 0.00 H new ATOM 0 HB1 ALA A1027 7.524 3.490 -1.850 1.00 0.00 H new ATOM 0 HB2 ALA A1027 7.818 4.915 -2.874 1.00 0.00 H new ATOM 0 HB3 ALA A1027 6.552 4.963 -1.625 1.00 0.00 H new ATOM 1842 N LEU A1028 3.993 3.626 -2.090 1.00 0.00 N ATOM 1843 CA LEU A1028 2.842 2.895 -1.602 1.00 0.00 C ATOM 1844 C LEU A1028 2.164 2.181 -2.763 1.00 0.00 C ATOM 1845 O LEU A1028 1.861 1.003 -2.668 1.00 0.00 O ATOM 1846 CB LEU A1028 1.862 3.820 -0.884 1.00 0.00 C ATOM 1847 CG LEU A1028 2.383 4.437 0.412 1.00 0.00 C ATOM 1848 CD1 LEU A1028 1.237 5.073 1.165 1.00 0.00 C ATOM 1849 CD2 LEU A1028 3.064 3.377 1.249 1.00 0.00 C ATOM 0 H LEU A1028 3.958 4.635 -1.946 1.00 0.00 H new ATOM 0 HA LEU A1028 3.179 2.155 -0.876 1.00 0.00 H new ATOM 0 HB2 LEU A1028 1.582 4.624 -1.564 1.00 0.00 H new ATOM 0 HB3 LEU A1028 0.954 3.259 -0.662 1.00 0.00 H new ATOM 0 HG LEU A1028 3.117 5.210 0.183 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.609 5.513 2.090 1.00 0.00 H new ATOM 0 HD12 LEU A1028 0.784 5.850 0.550 1.00 0.00 H new ATOM 0 HD13 LEU A1028 0.490 4.315 1.399 1.00 0.00 H new ATOM 0 HD21 LEU A1028 3.433 3.824 2.172 1.00 0.00 H new ATOM 0 HD22 LEU A1028 2.351 2.588 1.488 1.00 0.00 H new ATOM 0 HD23 LEU A1028 3.899 2.954 0.691 1.00 0.00 H new ATOM 1861 N ALA A1029 1.947 2.887 -3.858 1.00 0.00 N ATOM 1862 CA ALA A1029 1.426 2.272 -5.070 1.00 0.00 C ATOM 1863 C ALA A1029 2.329 1.138 -5.551 1.00 0.00 C ATOM 1864 O ALA A1029 1.838 0.091 -5.970 1.00 0.00 O ATOM 1865 CB ALA A1029 1.262 3.318 -6.163 1.00 0.00 C ATOM 0 H ALA A1029 2.123 3.889 -3.935 1.00 0.00 H new ATOM 0 HA ALA A1029 0.450 1.846 -4.837 1.00 0.00 H new ATOM 0 HB1 ALA A1029 0.872 2.845 -7.064 1.00 0.00 H new ATOM 0 HB2 ALA A1029 0.568 4.089 -5.828 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.229 3.771 -6.381 1.00 0.00 H new ATOM 1871 N VAL A1030 3.644 1.339 -5.481 1.00 0.00 N ATOM 1872 CA VAL A1030 4.584 0.346 -5.972 1.00 0.00 C ATOM 1873 C VAL A1030 4.588 -0.881 -5.074 1.00 0.00 C ATOM 1874 O VAL A1030 4.433 -2.007 -5.535 1.00 0.00 O ATOM 1875 CB VAL A1030 6.022 0.917 -6.051 1.00 0.00 C ATOM 1876 CG1 VAL A1030 7.057 -0.198 -6.128 1.00 0.00 C ATOM 1877 CG2 VAL A1030 6.171 1.829 -7.258 1.00 0.00 C ATOM 0 H VAL A1030 4.076 2.177 -5.091 1.00 0.00 H new ATOM 0 HA VAL A1030 4.260 0.066 -6.974 1.00 0.00 H new ATOM 0 HB VAL A1030 6.195 1.491 -5.141 1.00 0.00 H new ATOM 0 HG11 VAL A1030 8.056 0.236 -6.182 1.00 0.00 H new ATOM 0 HG12 VAL A1030 6.982 -0.826 -5.240 1.00 0.00 H new ATOM 0 HG13 VAL A1030 6.875 -0.803 -7.017 1.00 0.00 H new ATOM 0 HG21 VAL A1030 7.188 2.220 -7.295 1.00 0.00 H new ATOM 0 HG22 VAL A1030 5.965 1.265 -8.168 1.00 0.00 H new ATOM 0 HG23 VAL A1030 5.467 2.657 -7.177 1.00 0.00 H new ATOM 1887 N ASP A1031 4.766 -0.641 -3.783 1.00 0.00 N ATOM 1888 CA ASP A1031 4.906 -1.718 -2.822 1.00 0.00 C ATOM 1889 C ASP A1031 3.579 -2.369 -2.472 1.00 0.00 C ATOM 1890 O ASP A1031 3.547 -3.529 -2.115 1.00 0.00 O ATOM 1891 CB ASP A1031 5.657 -1.263 -1.580 1.00 0.00 C ATOM 1892 CG ASP A1031 7.154 -1.341 -1.795 1.00 0.00 C ATOM 1893 OD1 ASP A1031 7.685 -2.469 -1.898 1.00 0.00 O ATOM 1894 OD2 ASP A1031 7.808 -0.285 -1.889 1.00 0.00 O ATOM 0 H ASP A1031 4.817 0.294 -3.379 1.00 0.00 H new ATOM 0 HA ASP A1031 5.505 -2.489 -3.305 1.00 0.00 H new ATOM 0 HB2 ASP A1031 5.374 -0.240 -1.333 1.00 0.00 H new ATOM 0 HB3 ASP A1031 5.375 -1.885 -0.731 1.00 0.00 H new ATOM 1899 N ALA A1032 2.484 -1.628 -2.537 1.00 0.00 N ATOM 1900 CA ALA A1032 1.164 -2.242 -2.424 1.00 0.00 C ATOM 1901 C ALA A1032 0.919 -3.134 -3.633 1.00 0.00 C ATOM 1902 O ALA A1032 0.287 -4.182 -3.507 1.00 0.00 O ATOM 1903 CB ALA A1032 0.057 -1.217 -2.261 1.00 0.00 C ATOM 0 H ALA A1032 2.478 -0.616 -2.665 1.00 0.00 H new ATOM 0 HA ALA A1032 1.148 -2.847 -1.517 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -0.903 -1.728 -2.182 1.00 0.00 H new ATOM 0 HB2 ALA A1032 0.233 -0.632 -1.358 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.045 -0.554 -3.126 1.00 0.00 H new ATOM 1909 N LYS A1033 1.457 -2.763 -4.783 1.00 0.00 N ATOM 1910 CA LYS A1033 1.490 -3.678 -5.914 1.00 0.00 C ATOM 1911 C LYS A1033 2.382 -4.868 -5.568 1.00 0.00 C ATOM 1912 O LYS A1033 2.000 -6.032 -5.699 1.00 0.00 O ATOM 1913 CB LYS A1033 2.078 -3.002 -7.151 1.00 0.00 C ATOM 1914 CG LYS A1033 2.048 -3.914 -8.367 1.00 0.00 C ATOM 1915 CD LYS A1033 3.156 -3.597 -9.353 1.00 0.00 C ATOM 1916 CE LYS A1033 3.253 -4.678 -10.416 1.00 0.00 C ATOM 1917 NZ LYS A1033 3.381 -6.035 -9.813 1.00 0.00 N ATOM 0 H LYS A1033 1.872 -1.848 -4.958 1.00 0.00 H new ATOM 0 HA LYS A1033 0.468 -3.993 -6.123 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.519 -2.092 -7.367 1.00 0.00 H new ATOM 0 HB3 LYS A1033 3.106 -2.704 -6.947 1.00 0.00 H new ATOM 0 HG2 LYS A1033 2.139 -4.951 -8.043 1.00 0.00 H new ATOM 0 HG3 LYS A1033 1.083 -3.819 -8.865 1.00 0.00 H new ATOM 0 HD2 LYS A1033 2.966 -2.633 -9.824 1.00 0.00 H new ATOM 0 HD3 LYS A1033 4.106 -3.512 -8.825 1.00 0.00 H new ATOM 0 HE2 LYS A1033 2.368 -4.644 -11.051 1.00 0.00 H new ATOM 0 HE3 LYS A1033 4.113 -4.482 -11.057 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 3.808 -6.683 -10.505 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 3.985 -5.984 -8.968 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 2.439 -6.386 -9.545 1.00 0.00 H new ATOM 1931 N ASN A1034 3.583 -4.514 -5.111 1.00 0.00 N ATOM 1932 CA ASN A1034 4.670 -5.450 -4.840 1.00 0.00 C ATOM 1933 C ASN A1034 4.312 -6.466 -3.762 1.00 0.00 C ATOM 1934 O ASN A1034 4.465 -7.657 -3.963 1.00 0.00 O ATOM 1935 CB ASN A1034 5.917 -4.661 -4.417 1.00 0.00 C ATOM 1936 CG ASN A1034 7.088 -5.544 -4.030 1.00 0.00 C ATOM 1937 OD1 ASN A1034 7.274 -6.630 -4.577 1.00 0.00 O ATOM 1938 ND2 ASN A1034 7.884 -5.081 -3.077 1.00 0.00 N ATOM 0 H ASN A1034 3.831 -3.544 -4.915 1.00 0.00 H new ATOM 0 HA ASN A1034 4.862 -6.011 -5.755 1.00 0.00 H new ATOM 0 HB2 ASN A1034 6.219 -4.008 -5.236 1.00 0.00 H new ATOM 0 HB3 ASN A1034 5.662 -4.018 -3.574 1.00 0.00 H new ATOM 0 HD21 ASN A1034 8.687 -5.631 -2.771 1.00 0.00 H new ATOM 0 HD22 ASN A1034 7.694 -4.175 -2.649 1.00 0.00 H new ATOM 1945 N LEU A1035 3.849 -5.987 -2.619 1.00 0.00 N ATOM 1946 CA LEU A1035 3.552 -6.851 -1.492 1.00 0.00 C ATOM 1947 C LEU A1035 2.445 -7.833 -1.858 1.00 0.00 C ATOM 1948 O LEU A1035 2.505 -8.983 -1.430 1.00 0.00 O ATOM 1949 CB LEU A1035 3.203 -6.041 -0.236 1.00 0.00 C ATOM 1950 CG LEU A1035 1.764 -5.516 -0.147 1.00 0.00 C ATOM 1951 CD1 LEU A1035 0.874 -6.496 0.606 1.00 0.00 C ATOM 1952 CD2 LEU A1035 1.734 -4.161 0.526 1.00 0.00 C ATOM 0 H LEU A1035 3.670 -4.997 -2.448 1.00 0.00 H new ATOM 0 HA LEU A1035 4.448 -7.424 -1.254 1.00 0.00 H new ATOM 0 HB2 LEU A1035 3.395 -6.664 0.638 1.00 0.00 H new ATOM 0 HB3 LEU A1035 3.882 -5.191 -0.177 1.00 0.00 H new ATOM 0 HG LEU A1035 1.380 -5.412 -1.162 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -0.141 -6.101 0.656 1.00 0.00 H new ATOM 0 HD12 LEU A1035 0.866 -7.454 0.086 1.00 0.00 H new ATOM 0 HD13 LEU A1035 1.259 -6.635 1.616 1.00 0.00 H new ATOM 0 HD21 LEU A1035 0.705 -3.804 0.580 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.142 -4.246 1.533 1.00 0.00 H new ATOM 0 HD23 LEU A1035 2.333 -3.455 -0.050 1.00 0.00 H new ATOM 1964 N LEU A1036 1.428 -7.423 -2.630 1.00 0.00 N ATOM 1965 CA LEU A1036 0.441 -8.426 -3.003 1.00 0.00 C ATOM 1966 C LEU A1036 1.102 -9.447 -3.924 1.00 0.00 C ATOM 1967 O LEU A1036 0.969 -10.649 -3.737 1.00 0.00 O ATOM 1968 CB LEU A1036 -0.792 -7.809 -3.661 1.00 0.00 C ATOM 1969 CG LEU A1036 -1.345 -6.576 -2.963 1.00 0.00 C ATOM 1970 CD1 LEU A1036 -2.477 -5.969 -3.772 1.00 0.00 C ATOM 1971 CD2 LEU A1036 -1.808 -6.933 -1.564 1.00 0.00 C ATOM 0 H LEU A1036 1.277 -6.478 -2.982 1.00 0.00 H new ATOM 0 HA LEU A1036 0.087 -8.919 -2.098 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -0.543 -7.545 -4.689 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -1.577 -8.564 -3.707 1.00 0.00 H new ATOM 0 HG LEU A1036 -0.553 -5.831 -2.883 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -2.860 -5.088 -3.257 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -2.107 -5.682 -4.756 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -3.277 -6.701 -3.884 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -2.202 -6.043 -1.073 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -2.589 -7.692 -1.622 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -0.966 -7.321 -0.990 1.00 0.00 H new ATOM 1983 N ASP A1037 1.849 -8.913 -4.898 1.00 0.00 N ATOM 1984 CA ASP A1037 2.655 -9.699 -5.836 1.00 0.00 C ATOM 1985 C ASP A1037 3.533 -10.705 -5.095 1.00 0.00 C ATOM 1986 O ASP A1037 3.728 -11.839 -5.526 1.00 0.00 O ATOM 1987 CB ASP A1037 3.541 -8.741 -6.636 1.00 0.00 C ATOM 1988 CG ASP A1037 4.379 -9.444 -7.681 1.00 0.00 C ATOM 1989 OD1 ASP A1037 3.825 -10.252 -8.454 1.00 0.00 O ATOM 1990 OD2 ASP A1037 5.592 -9.161 -7.761 1.00 0.00 O ATOM 0 H ASP A1037 1.910 -7.907 -5.058 1.00 0.00 H new ATOM 0 HA ASP A1037 1.991 -10.253 -6.499 1.00 0.00 H new ATOM 0 HB2 ASP A1037 2.913 -7.995 -7.123 1.00 0.00 H new ATOM 0 HB3 ASP A1037 4.198 -8.205 -5.951 1.00 0.00 H new ATOM 1995 N VAL A1038 4.086 -10.233 -3.987 1.00 0.00 N ATOM 1996 CA VAL A1038 4.837 -11.051 -3.049 1.00 0.00 C ATOM 1997 C VAL A1038 4.038 -12.270 -2.600 1.00 0.00 C ATOM 1998 O VAL A1038 4.547 -13.370 -2.696 1.00 0.00 O ATOM 1999 CB VAL A1038 5.301 -10.210 -1.833 1.00 0.00 C ATOM 2000 CG1 VAL A1038 5.725 -11.091 -0.671 1.00 0.00 C ATOM 2001 CG2 VAL A1038 6.449 -9.299 -2.233 1.00 0.00 C ATOM 0 H VAL A1038 4.024 -9.253 -3.711 1.00 0.00 H new ATOM 0 HA VAL A1038 5.723 -11.417 -3.568 1.00 0.00 H new ATOM 0 HB VAL A1038 4.453 -9.607 -1.507 1.00 0.00 H new ATOM 0 HG11 VAL A1038 6.044 -10.465 0.163 1.00 0.00 H new ATOM 0 HG12 VAL A1038 4.885 -11.711 -0.359 1.00 0.00 H new ATOM 0 HG13 VAL A1038 6.552 -11.730 -0.982 1.00 0.00 H new ATOM 0 HG21 VAL A1038 6.766 -8.713 -1.370 1.00 0.00 H new ATOM 0 HG22 VAL A1038 7.284 -9.902 -2.590 1.00 0.00 H new ATOM 0 HG23 VAL A1038 6.121 -8.628 -3.027 1.00 0.00 H new ATOM 2011 N ILE A1039 2.804 -12.096 -2.144 1.00 0.00 N ATOM 2012 CA ILE A1039 1.967 -13.236 -1.765 1.00 0.00 C ATOM 2013 C ILE A1039 1.502 -13.991 -2.992 1.00 0.00 C ATOM 2014 O ILE A1039 1.369 -15.219 -2.956 1.00 0.00 O ATOM 2015 CB ILE A1039 0.754 -12.827 -0.900 1.00 0.00 C ATOM 2016 CG1 ILE A1039 1.223 -12.486 0.502 1.00 0.00 C ATOM 2017 CG2 ILE A1039 -0.300 -13.926 -0.848 1.00 0.00 C ATOM 2018 CD1 ILE A1039 1.749 -11.081 0.649 1.00 0.00 C ATOM 0 H ILE A1039 2.360 -11.185 -2.027 1.00 0.00 H new ATOM 0 HA ILE A1039 2.591 -13.889 -1.154 1.00 0.00 H new ATOM 0 HB ILE A1039 0.292 -11.952 -1.358 1.00 0.00 H new ATOM 0 HG12 ILE A1039 0.394 -12.627 1.195 1.00 0.00 H new ATOM 0 HG13 ILE A1039 2.005 -13.188 0.793 1.00 0.00 H new ATOM 0 HG21 ILE A1039 -1.136 -13.599 -0.230 1.00 0.00 H new ATOM 0 HG22 ILE A1039 -0.655 -14.138 -1.857 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.136 -14.829 -0.420 1.00 0.00 H new ATOM 0 HD11 ILE A1039 2.064 -10.916 1.679 1.00 0.00 H new ATOM 0 HD12 ILE A1039 2.600 -10.939 -0.017 1.00 0.00 H new ATOM 0 HD13 ILE A1039 0.964 -10.370 0.391 1.00 0.00 H new ATOM 2030 N ASP A1040 1.288 -13.277 -4.073 1.00 0.00 N ATOM 2031 CA ASP A1040 0.976 -13.907 -5.339 1.00 0.00 C ATOM 2032 C ASP A1040 2.034 -14.951 -5.656 1.00 0.00 C ATOM 2033 O ASP A1040 1.749 -16.144 -5.869 1.00 0.00 O ATOM 2034 CB ASP A1040 0.956 -12.864 -6.454 1.00 0.00 C ATOM 2035 CG ASP A1040 -0.146 -11.838 -6.329 1.00 0.00 C ATOM 2036 OD1 ASP A1040 -1.130 -12.092 -5.611 1.00 0.00 O ATOM 2037 OD2 ASP A1040 -0.044 -10.780 -6.989 1.00 0.00 O ATOM 0 H ASP A1040 1.324 -12.258 -4.103 1.00 0.00 H new ATOM 0 HA ASP A1040 -0.005 -14.378 -5.269 1.00 0.00 H new ATOM 0 HB2 ASP A1040 1.916 -12.348 -6.470 1.00 0.00 H new ATOM 0 HB3 ASP A1040 0.853 -13.375 -7.411 1.00 0.00 H new ATOM 2042 N GLN A1041 3.263 -14.518 -5.606 1.00 0.00 N ATOM 2043 CA GLN A1041 4.363 -15.390 -5.880 1.00 0.00 C ATOM 2044 C GLN A1041 4.612 -16.319 -4.704 1.00 0.00 C ATOM 2045 O GLN A1041 4.937 -17.476 -4.894 1.00 0.00 O ATOM 2046 CB GLN A1041 5.603 -14.570 -6.180 1.00 0.00 C ATOM 2047 CG GLN A1041 5.556 -13.870 -7.522 1.00 0.00 C ATOM 2048 CD GLN A1041 6.781 -13.019 -7.767 1.00 0.00 C ATOM 2049 OE1 GLN A1041 7.788 -13.497 -8.285 1.00 0.00 O ATOM 2050 NE2 GLN A1041 6.700 -11.754 -7.403 1.00 0.00 N ATOM 0 H GLN A1041 3.526 -13.560 -5.376 1.00 0.00 H new ATOM 0 HA GLN A1041 4.122 -16.001 -6.750 1.00 0.00 H new ATOM 0 HB2 GLN A1041 5.735 -13.825 -5.395 1.00 0.00 H new ATOM 0 HB3 GLN A1041 6.476 -15.222 -6.150 1.00 0.00 H new ATOM 0 HG2 GLN A1041 5.468 -14.613 -8.314 1.00 0.00 H new ATOM 0 HG3 GLN A1041 4.665 -13.244 -7.572 1.00 0.00 H new ATOM 0 HE21 GLN A1041 5.844 -11.400 -6.976 1.00 0.00 H new ATOM 0 HE22 GLN A1041 7.493 -11.130 -7.548 1.00 0.00 H new ATOM 2059 N ALA A1042 4.410 -15.801 -3.503 1.00 0.00 N ATOM 2060 CA ALA A1042 4.624 -16.538 -2.263 1.00 0.00 C ATOM 2061 C ALA A1042 3.869 -17.833 -2.242 1.00 0.00 C ATOM 2062 O ALA A1042 4.432 -18.883 -1.951 1.00 0.00 O ATOM 2063 CB ALA A1042 4.146 -15.712 -1.095 1.00 0.00 C ATOM 0 H ALA A1042 4.088 -14.844 -3.358 1.00 0.00 H new ATOM 0 HA ALA A1042 5.692 -16.747 -2.195 1.00 0.00 H new ATOM 0 HB1 ALA A1042 4.307 -16.264 -0.169 1.00 0.00 H new ATOM 0 HB2 ALA A1042 4.702 -14.775 -1.060 1.00 0.00 H new ATOM 0 HB3 ALA A1042 3.083 -15.499 -1.211 1.00 0.00 H new ATOM 2069 N ARG A1043 2.590 -17.760 -2.554 1.00 0.00 N ATOM 2070 CA ARG A1043 1.756 -18.932 -2.512 1.00 0.00 C ATOM 2071 C ARG A1043 2.268 -19.952 -3.512 1.00 0.00 C ATOM 2072 O ARG A1043 2.349 -21.134 -3.211 1.00 0.00 O ATOM 2073 CB ARG A1043 0.291 -18.573 -2.781 1.00 0.00 C ATOM 2074 CG ARG A1043 0.078 -17.786 -4.060 1.00 0.00 C ATOM 2075 CD ARG A1043 -0.072 -18.687 -5.280 1.00 0.00 C ATOM 2076 NE ARG A1043 -1.327 -19.440 -5.271 1.00 0.00 N ATOM 2077 CZ ARG A1043 -1.471 -20.665 -5.777 1.00 0.00 C ATOM 2078 NH1 ARG A1043 -0.423 -21.329 -6.247 1.00 0.00 N ATOM 2079 NH2 ARG A1043 -2.669 -21.237 -5.803 1.00 0.00 N ATOM 0 H ARG A1043 2.113 -16.904 -2.837 1.00 0.00 H new ATOM 0 HA ARG A1043 1.801 -19.367 -1.514 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -0.295 -19.491 -2.828 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -0.091 -17.993 -1.941 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -0.813 -17.167 -3.958 1.00 0.00 H new ATOM 0 HG3 ARG A1043 0.920 -17.111 -4.212 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -0.023 -18.080 -6.184 1.00 0.00 H new ATOM 0 HD3 ARG A1043 0.765 -19.384 -5.318 1.00 0.00 H new ATOM 0 HE ARG A1043 -2.145 -18.999 -4.850 1.00 0.00 H new ATOM 0 HH11 ARG A1043 0.503 -20.903 -6.223 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -0.544 -22.266 -6.632 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -3.480 -20.739 -5.436 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -2.778 -22.174 -6.190 1.00 0.00 H new ATOM 2093 N LEU A1044 2.666 -19.476 -4.695 1.00 0.00 N ATOM 2094 CA LEU A1044 3.123 -20.379 -5.739 1.00 0.00 C ATOM 2095 C LEU A1044 4.526 -20.906 -5.411 1.00 0.00 C ATOM 2096 O LEU A1044 4.839 -22.076 -5.623 1.00 0.00 O ATOM 2097 CB LEU A1044 3.120 -19.675 -7.100 1.00 0.00 C ATOM 2098 CG LEU A1044 3.500 -20.559 -8.292 1.00 0.00 C ATOM 2099 CD1 LEU A1044 2.523 -21.717 -8.435 1.00 0.00 C ATOM 2100 CD2 LEU A1044 3.548 -19.739 -9.572 1.00 0.00 C ATOM 0 H LEU A1044 2.679 -18.487 -4.945 1.00 0.00 H new ATOM 0 HA LEU A1044 2.437 -21.224 -5.789 1.00 0.00 H new ATOM 0 HB2 LEU A1044 2.126 -19.263 -7.276 1.00 0.00 H new ATOM 0 HB3 LEU A1044 3.811 -18.833 -7.057 1.00 0.00 H new ATOM 0 HG LEU A1044 4.493 -20.970 -8.110 1.00 0.00 H new ATOM 0 HD11 LEU A1044 2.811 -22.333 -9.287 1.00 0.00 H new ATOM 0 HD12 LEU A1044 2.540 -22.322 -7.528 1.00 0.00 H new ATOM 0 HD13 LEU A1044 1.517 -21.327 -8.592 1.00 0.00 H new ATOM 0 HD21 LEU A1044 3.820 -20.384 -10.407 1.00 0.00 H new ATOM 0 HD22 LEU A1044 2.569 -19.297 -9.758 1.00 0.00 H new ATOM 0 HD23 LEU A1044 4.290 -18.947 -9.469 1.00 0.00 H new ATOM 2112 N LYS A1045 5.346 -20.013 -4.877 1.00 0.00 N ATOM 2113 CA LYS A1045 6.716 -20.304 -4.475 1.00 0.00 C ATOM 2114 C LYS A1045 6.742 -21.310 -3.340 1.00 0.00 C ATOM 2115 O LYS A1045 7.518 -22.249 -3.357 1.00 0.00 O ATOM 2116 CB LYS A1045 7.379 -18.989 -4.052 1.00 0.00 C ATOM 2117 CG LYS A1045 8.482 -19.118 -3.018 1.00 0.00 C ATOM 2118 CD LYS A1045 8.670 -17.801 -2.290 1.00 0.00 C ATOM 2119 CE LYS A1045 9.712 -17.893 -1.189 1.00 0.00 C ATOM 2120 NZ LYS A1045 9.816 -16.620 -0.430 1.00 0.00 N ATOM 0 H LYS A1045 5.073 -19.045 -4.707 1.00 0.00 H new ATOM 0 HA LYS A1045 7.263 -20.744 -5.309 1.00 0.00 H new ATOM 0 HB2 LYS A1045 7.791 -18.508 -4.939 1.00 0.00 H new ATOM 0 HB3 LYS A1045 6.610 -18.325 -3.657 1.00 0.00 H new ATOM 0 HG2 LYS A1045 8.233 -19.904 -2.305 1.00 0.00 H new ATOM 0 HG3 LYS A1045 9.413 -19.411 -3.503 1.00 0.00 H new ATOM 0 HD2 LYS A1045 8.967 -17.033 -3.004 1.00 0.00 H new ATOM 0 HD3 LYS A1045 7.719 -17.487 -1.861 1.00 0.00 H new ATOM 0 HE2 LYS A1045 9.453 -18.704 -0.508 1.00 0.00 H new ATOM 0 HE3 LYS A1045 10.681 -18.139 -1.623 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 10.777 -16.523 -0.045 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 9.614 -15.820 -1.064 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 9.129 -16.624 0.351 1.00 0.00 H new ATOM 2134 N MET A1046 5.888 -21.108 -2.365 1.00 0.00 N ATOM 2135 CA MET A1046 5.799 -22.008 -1.232 1.00 0.00 C ATOM 2136 C MET A1046 5.276 -23.388 -1.643 1.00 0.00 C ATOM 2137 O MET A1046 5.695 -24.407 -1.089 1.00 0.00 O ATOM 2138 CB MET A1046 4.904 -21.365 -0.205 1.00 0.00 C ATOM 2139 CG MET A1046 5.624 -20.340 0.657 1.00 0.00 C ATOM 2140 SD MET A1046 7.025 -21.049 1.542 1.00 0.00 S ATOM 2141 CE MET A1046 7.712 -19.585 2.309 1.00 0.00 C ATOM 0 H MET A1046 5.238 -20.322 -2.331 1.00 0.00 H new ATOM 0 HA MET A1046 6.792 -22.175 -0.814 1.00 0.00 H new ATOM 0 HB2 MET A1046 4.069 -20.882 -0.712 1.00 0.00 H new ATOM 0 HB3 MET A1046 4.483 -22.139 0.437 1.00 0.00 H new ATOM 0 HG2 MET A1046 5.972 -19.521 0.028 1.00 0.00 H new ATOM 0 HG3 MET A1046 4.922 -19.915 1.374 1.00 0.00 H new ATOM 0 HE1 MET A1046 8.674 -19.828 2.761 1.00 0.00 H new ATOM 0 HE2 MET A1046 7.851 -18.810 1.555 1.00 0.00 H new ATOM 0 HE3 MET A1046 7.031 -19.224 3.079 1.00 0.00 H new ATOM 2151 N ILE A1047 4.355 -23.409 -2.606 1.00 0.00 N ATOM 2152 CA ILE A1047 3.879 -24.659 -3.205 1.00 0.00 C ATOM 2153 C ILE A1047 5.042 -25.531 -3.670 1.00 0.00 C ATOM 2154 O ILE A1047 5.094 -26.726 -3.368 1.00 0.00 O ATOM 2155 CB ILE A1047 2.946 -24.389 -4.414 1.00 0.00 C ATOM 2156 CG1 ILE A1047 1.596 -23.847 -3.939 1.00 0.00 C ATOM 2157 CG2 ILE A1047 2.739 -25.652 -5.245 1.00 0.00 C ATOM 2158 CD1 ILE A1047 0.848 -24.790 -3.019 1.00 0.00 C ATOM 0 H ILE A1047 3.921 -22.570 -2.991 1.00 0.00 H new ATOM 0 HA ILE A1047 3.321 -25.183 -2.429 1.00 0.00 H new ATOM 0 HB ILE A1047 3.427 -23.641 -5.044 1.00 0.00 H new ATOM 0 HG12 ILE A1047 1.756 -22.901 -3.422 1.00 0.00 H new ATOM 0 HG13 ILE A1047 0.974 -23.634 -4.809 1.00 0.00 H new ATOM 0 HG21 ILE A1047 2.081 -25.431 -6.085 1.00 0.00 H new ATOM 0 HG22 ILE A1047 3.701 -26.002 -5.620 1.00 0.00 H new ATOM 0 HG23 ILE A1047 2.288 -26.426 -4.624 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -0.099 -24.337 -2.725 1.00 0.00 H new ATOM 0 HD12 ILE A1047 0.655 -25.728 -3.539 1.00 0.00 H new ATOM 0 HD13 ILE A1047 1.449 -24.984 -2.131 1.00 0.00 H new ATOM 2170 N SER A1048 5.978 -24.940 -4.395 1.00 0.00 N ATOM 2171 CA SER A1048 7.095 -25.692 -4.938 1.00 0.00 C ATOM 2172 C SER A1048 8.374 -24.865 -4.951 1.00 0.00 C ATOM 2173 O SER A1048 8.893 -24.545 -6.013 1.00 0.00 O ATOM 2174 CB SER A1048 6.763 -26.163 -6.356 1.00 0.00 C ATOM 2175 OG SER A1048 5.662 -27.060 -6.351 1.00 0.00 O ATOM 0 H SER A1048 5.986 -23.945 -4.620 1.00 0.00 H new ATOM 0 HA SER A1048 7.263 -26.556 -4.295 1.00 0.00 H new ATOM 0 HB2 SER A1048 6.532 -25.302 -6.984 1.00 0.00 H new ATOM 0 HB3 SER A1048 7.633 -26.653 -6.793 1.00 0.00 H new ATOM 0 HG SER A1048 5.468 -27.345 -7.268 1.00 0.00 H new ATOM 2181 N GLN A1049 8.882 -24.510 -3.773 1.00 0.00 N ATOM 2182 CA GLN A1049 10.130 -23.751 -3.694 1.00 0.00 C ATOM 2183 C GLN A1049 11.312 -24.610 -4.139 1.00 0.00 C ATOM 2184 O GLN A1049 12.356 -24.090 -4.543 1.00 0.00 O ATOM 2185 CB GLN A1049 10.370 -23.218 -2.278 1.00 0.00 C ATOM 2186 CG GLN A1049 11.495 -22.193 -2.205 1.00 0.00 C ATOM 2187 CD GLN A1049 11.799 -21.748 -0.789 1.00 0.00 C ATOM 2188 OE1 GLN A1049 11.639 -22.515 0.159 1.00 0.00 O ATOM 2189 NE2 GLN A1049 12.238 -20.510 -0.631 1.00 0.00 N ATOM 0 H GLN A1049 8.457 -24.731 -2.872 1.00 0.00 H new ATOM 0 HA GLN A1049 10.040 -22.898 -4.367 1.00 0.00 H new ATOM 0 HB2 GLN A1049 9.451 -22.766 -1.906 1.00 0.00 H new ATOM 0 HB3 GLN A1049 10.604 -24.053 -1.617 1.00 0.00 H new ATOM 0 HG2 GLN A1049 12.396 -22.618 -2.648 1.00 0.00 H new ATOM 0 HG3 GLN A1049 11.226 -21.323 -2.804 1.00 0.00 H new ATOM 0 HE21 GLN A1049 12.358 -19.904 -1.443 1.00 0.00 H new ATOM 0 HE22 GLN A1049 12.457 -20.162 0.302 1.00 0.00 H new ATOM 2198 N SER A1050 11.133 -25.925 -4.085 1.00 0.00 N ATOM 2199 CA SER A1050 12.162 -26.860 -4.526 1.00 0.00 C ATOM 2200 C SER A1050 12.194 -26.941 -6.055 1.00 0.00 C ATOM 2201 O SER A1050 12.947 -27.720 -6.638 1.00 0.00 O ATOM 2202 CB SER A1050 11.905 -28.242 -3.922 1.00 0.00 C ATOM 2203 OG SER A1050 11.594 -28.146 -2.538 1.00 0.00 O ATOM 0 H SER A1050 10.282 -26.369 -3.739 1.00 0.00 H new ATOM 0 HA SER A1050 13.132 -26.501 -4.183 1.00 0.00 H new ATOM 0 HB2 SER A1050 11.083 -28.726 -4.450 1.00 0.00 H new ATOM 0 HB3 SER A1050 12.785 -28.871 -4.057 1.00 0.00 H new ATOM 0 HG SER A1050 11.432 -29.042 -2.176 1.00 0.00 H new ATOM 2209 N ARG A1051 11.376 -26.119 -6.691 1.00 0.00 N ATOM 2210 CA ARG A1051 11.358 -25.998 -8.136 1.00 0.00 C ATOM 2211 C ARG A1051 11.310 -24.514 -8.482 1.00 0.00 C ATOM 2212 O ARG A1051 10.756 -23.732 -7.713 1.00 0.00 O ATOM 2213 CB ARG A1051 10.133 -26.728 -8.708 1.00 0.00 C ATOM 2214 CG ARG A1051 10.229 -27.036 -10.195 1.00 0.00 C ATOM 2215 CD ARG A1051 11.357 -28.014 -10.483 1.00 0.00 C ATOM 2216 NE ARG A1051 11.525 -28.257 -11.913 1.00 0.00 N ATOM 2217 CZ ARG A1051 12.231 -29.266 -12.422 1.00 0.00 C ATOM 2218 NH1 ARG A1051 12.896 -30.086 -11.620 1.00 0.00 N ATOM 2219 NH2 ARG A1051 12.286 -29.444 -13.734 1.00 0.00 N ATOM 0 H ARG A1051 10.704 -25.516 -6.217 1.00 0.00 H new ATOM 0 HA ARG A1051 12.249 -26.451 -8.570 1.00 0.00 H new ATOM 0 HB2 ARG A1051 9.993 -27.662 -8.163 1.00 0.00 H new ATOM 0 HB3 ARG A1051 9.246 -26.120 -8.531 1.00 0.00 H new ATOM 0 HG2 ARG A1051 9.285 -27.453 -10.544 1.00 0.00 H new ATOM 0 HG3 ARG A1051 10.394 -26.113 -10.750 1.00 0.00 H new ATOM 0 HD2 ARG A1051 12.288 -27.624 -10.071 1.00 0.00 H new ATOM 0 HD3 ARG A1051 11.155 -28.958 -9.977 1.00 0.00 H new ATOM 0 HE ARG A1051 11.073 -27.614 -12.563 1.00 0.00 H new ATOM 0 HH11 ARG A1051 12.868 -29.945 -10.610 1.00 0.00 H new ATOM 0 HH12 ARG A1051 13.435 -30.857 -12.013 1.00 0.00 H new ATOM 0 HH21 ARG A1051 11.787 -28.808 -14.356 1.00 0.00 H new ATOM 0 HH22 ARG A1051 12.827 -30.217 -14.122 1.00 0.00 H new ATOM 2233 N PRO A1052 11.934 -24.080 -9.585 1.00 0.00 N ATOM 2234 CA PRO A1052 11.877 -22.677 -10.008 1.00 0.00 C ATOM 2235 C PRO A1052 10.445 -22.141 -10.033 1.00 0.00 C ATOM 2236 O PRO A1052 9.605 -22.626 -10.797 1.00 0.00 O ATOM 2237 CB PRO A1052 12.473 -22.708 -11.413 1.00 0.00 C ATOM 2238 CG PRO A1052 13.397 -23.875 -11.398 1.00 0.00 C ATOM 2239 CD PRO A1052 12.768 -24.894 -10.488 1.00 0.00 C ATOM 0 HA PRO A1052 12.411 -22.017 -9.325 1.00 0.00 H new ATOM 0 HB2 PRO A1052 11.698 -22.824 -12.171 1.00 0.00 H new ATOM 0 HB3 PRO A1052 13.004 -21.784 -11.640 1.00 0.00 H new ATOM 0 HG2 PRO A1052 13.531 -24.279 -12.402 1.00 0.00 H new ATOM 0 HG3 PRO A1052 14.384 -23.586 -11.036 1.00 0.00 H new ATOM 0 HD2 PRO A1052 12.170 -25.615 -11.045 1.00 0.00 H new ATOM 0 HD3 PRO A1052 13.520 -25.460 -9.939 1.00 0.00 H new ATOM 2247 N HIS A1053 10.180 -21.157 -9.173 1.00 0.00 N ATOM 2248 CA HIS A1053 8.855 -20.553 -9.056 1.00 0.00 C ATOM 2249 C HIS A1053 8.368 -20.051 -10.412 1.00 0.00 C ATOM 2250 CB HIS A1053 8.879 -19.405 -8.025 1.00 0.00 C ATOM 2251 CG HIS A1053 7.681 -18.498 -8.085 1.00 0.00 C ATOM 2252 ND1 HIS A1053 7.560 -17.507 -9.036 1.00 0.00 N ATOM 2253 CD2 HIS A1053 6.541 -18.440 -7.338 1.00 0.00 C ATOM 2254 CE1 HIS A1053 6.414 -16.882 -8.883 1.00 0.00 C ATOM 2255 NE2 HIS A1053 5.775 -17.427 -7.864 1.00 0.00 N ATOM 0 H HIS A1053 10.875 -20.759 -8.541 1.00 0.00 H new ATOM 0 HA HIS A1053 8.158 -21.315 -8.708 1.00 0.00 H new ATOM 0 HB2 HIS A1053 8.948 -19.832 -7.024 1.00 0.00 H new ATOM 0 HB3 HIS A1053 9.779 -18.810 -8.181 1.00 0.00 H new ATOM 0 HD1 HIS A1053 8.255 -17.291 -9.751 1.00 0.00 H new ATOM 0 HD2 HIS A1053 6.289 -19.068 -6.496 1.00 0.00 H new ATOM 0 HE1 HIS A1053 6.056 -16.062 -9.488 1.00 0.00 H new TER 2264 HIS A1053