USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=42 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: A 951 TYR OH : rot 54:sc= -0.327 USER MOD Set 1.2: A1018 LYS NZ :NH3+ 171:sc= -1.36! (180deg=-1.98!) USER MOD Set 2.1: A1006 GLN : amide:sc= -0.454 K(o=-1.5,f=-2.8!) USER MOD Set 2.2: A1007 GLN : amide:sc= -1 K(o=-1.5,f=-2.8) USER MOD Set 3.1: A 939 MET CE :methyl -174:sc= -0.205 (180deg=-0.131) USER MOD Set 3.2: A 954 MET CE :methyl 165:sc= -0.555 (180deg=-0.778) USER MOD Set 4.1: A 928 ASN : amide:sc= -2.43! X(o=-1.7!,f=-2) USER MOD Set 4.2: A 968 THR OG1 : rot 36:sc= 0.724 USER MOD Set 5.1: A 909 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 921 SER OG : rot 87:sc= 1.21 USER MOD Single : A 922 ASN : amide:sc=-0.00459 X(o=-0.0046,f=0) USER MOD Single : A 924 LYS NZ :NH3+ 164:sc= -0.0234 (180deg=-0.241) USER MOD Single : A 926 TYR OH : rot 54:sc= 0.213 USER MOD Single : A 930 THR OG1 : rot -160:sc= -0.745 USER MOD Single : A 934 LYS NZ :NH3+ 162:sc= -0.0845 (180deg=-0.452) USER MOD Single : A 940 SER OG : rot -100:sc= -0.699 USER MOD Single : A 941 SER OG : rot 180:sc= -0.353 USER MOD Single : A 942 LYS NZ :NH3+ 174:sc=-0.00191 (180deg=-0.0519) USER MOD Single : A 944 GLN : amide:sc= -1.35 K(o=-1.4,f=-4.1!) USER MOD Single : A 956 LYS NZ :NH3+ -169:sc=-0.00487 (180deg=-0.114) USER MOD Single : A 964 THR OG1 : rot 88:sc= 1.12 USER MOD Single : A 972 SER OG : rot 82:sc= 1.13 USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot 78:sc= 0.526 USER MOD Single : A 981 HIS : no HE2:sc= -3.21 X(o=-3.2,f=-3.5!) USER MOD Single : A 986 MET CE :methyl 158:sc= 0 (180deg=-0.854) USER MOD Single : A 988 GLN :FLIP amide:sc= -0.819 F(o=-5.4!,f=-0.82) USER MOD Single : A 989 LYS NZ :NH3+ 154:sc= -0.141 (180deg=-0.728) USER MOD Single : A 992 ASN : amide:sc= -0.657 K(o=-0.66,f=-3.8!) USER MOD Single : A 993 SER OG : rot 180:sc= 0.00494 USER MOD Single : A1000 ASN :FLIP amide:sc= 0 F(o=-0.8,f=0) USER MOD Single : A1001 LYS NZ :NH3+ -160:sc= 1.22 (180deg=1.01) USER MOD Single : A1002 MET CE :methyl -155:sc= -3.52 (180deg=-5.66!) USER MOD Single : A1003 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0738) 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 USER MOD Single : A1012 SER OG : rot 180:sc= 0.00377 USER MOD Single : A1014 GLN :FLIP amide:sc= -1.63 F(o=-3.5!,f=-1.6) USER MOD Single : A1015 GLN :FLIP amide:sc= -0.0117 F(o=-1.1!,f=-0.012) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1019 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0406) USER MOD Single : A1020 GLN : amide:sc= 0.937 K(o=0.94,f=0) USER MOD Single : A1021 MET CE :methyl -164:sc= -0.79 (180deg=-1.55) USER MOD Single : A1023 THR OG1 : rot 69:sc= 1.23 USER MOD Single : A1026 HIS : no HD1:sc= -0.0433 X(o=-0.043,f=0) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1034 ASN : amide:sc= 1.02 K(o=1,f=-0.41) USER MOD Single : A1041 GLN :FLIP amide:sc= 0 F(o=-0.55,f=0) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl -149:sc= -0.393 (180deg=-1.35!) USER MOD Single : A1048 SER OG : rot 180:sc= -2.7! USER MOD Single : A1049 GLN : amide:sc= -2.04! C(o=-2!,f=-7!) USER MOD Single : A1050 SER OG : rot 180:sc=0.000652 USER MOD Single : A1053 HIS : no HD1:sc= -1.63! C(o=-1.6!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 908 5.839 -35.041 -23.622 1.00 0.00 N ATOM 2 CA GLY A 908 5.787 -33.651 -23.111 1.00 0.00 C ATOM 3 C GLY A 908 4.370 -33.131 -23.029 1.00 0.00 C ATOM 4 O GLY A 908 3.463 -33.723 -23.610 1.00 0.00 O ATOM 0 HA2 GLY A 908 6.246 -33.610 -22.123 1.00 0.00 H new ATOM 0 HA3 GLY A 908 6.374 -33.003 -23.762 1.00 0.00 H new ATOM 9 N SER A 909 4.187 -32.025 -22.310 1.00 0.00 N ATOM 10 CA SER A 909 2.869 -31.422 -22.112 1.00 0.00 C ATOM 11 C SER A 909 1.896 -32.417 -21.470 1.00 0.00 C ATOM 12 O SER A 909 1.102 -33.061 -22.157 1.00 0.00 O ATOM 13 CB SER A 909 2.311 -30.895 -23.441 1.00 0.00 C ATOM 14 OG SER A 909 3.210 -29.971 -24.035 1.00 0.00 O ATOM 0 H SER A 909 4.946 -31.522 -21.849 1.00 0.00 H new ATOM 0 HA SER A 909 2.983 -30.580 -21.429 1.00 0.00 H new ATOM 0 HB2 SER A 909 2.135 -31.727 -24.122 1.00 0.00 H new ATOM 0 HB3 SER A 909 1.348 -30.414 -23.271 1.00 0.00 H new ATOM 0 HG SER A 909 2.836 -29.649 -24.882 1.00 0.00 H new ATOM 20 N PRO A 910 1.962 -32.563 -20.136 1.00 0.00 N ATOM 21 CA PRO A 910 1.140 -33.519 -19.387 1.00 0.00 C ATOM 22 C PRO A 910 -0.298 -33.037 -19.201 1.00 0.00 C ATOM 23 O PRO A 910 -0.800 -32.959 -18.079 1.00 0.00 O ATOM 24 CB PRO A 910 1.852 -33.624 -18.024 1.00 0.00 C ATOM 25 CG PRO A 910 3.104 -32.816 -18.151 1.00 0.00 C ATOM 26 CD PRO A 910 2.847 -31.819 -19.239 1.00 0.00 C ATOM 0 HA PRO A 910 1.054 -34.471 -19.911 1.00 0.00 H new ATOM 0 HB2 PRO A 910 1.220 -33.241 -17.223 1.00 0.00 H new ATOM 0 HB3 PRO A 910 2.080 -34.662 -17.782 1.00 0.00 H new ATOM 0 HG2 PRO A 910 3.342 -32.316 -17.212 1.00 0.00 H new ATOM 0 HG3 PRO A 910 3.955 -33.451 -18.398 1.00 0.00 H new ATOM 0 HD2 PRO A 910 2.374 -30.914 -18.858 1.00 0.00 H new ATOM 0 HD3 PRO A 910 3.767 -31.513 -19.736 1.00 0.00 H new ATOM 34 N GLY A 911 -0.961 -32.725 -20.305 1.00 0.00 N ATOM 35 CA GLY A 911 -2.340 -32.294 -20.241 1.00 0.00 C ATOM 36 C GLY A 911 -2.555 -30.944 -20.886 1.00 0.00 C ATOM 37 O GLY A 911 -3.067 -30.857 -22.002 1.00 0.00 O ATOM 0 H GLY A 911 -0.567 -32.763 -21.245 1.00 0.00 H new ATOM 0 HA2 GLY A 911 -2.972 -33.033 -20.734 1.00 0.00 H new ATOM 0 HA3 GLY A 911 -2.655 -32.249 -19.199 1.00 0.00 H new ATOM 40 N ILE A 912 -2.148 -29.889 -20.197 1.00 0.00 N ATOM 41 CA ILE A 912 -2.365 -28.535 -20.685 1.00 0.00 C ATOM 42 C ILE A 912 -1.037 -27.846 -20.985 1.00 0.00 C ATOM 43 O ILE A 912 -0.860 -27.268 -22.060 1.00 0.00 O ATOM 44 CB ILE A 912 -3.157 -27.692 -19.660 1.00 0.00 C ATOM 45 CG1 ILE A 912 -4.464 -28.398 -19.281 1.00 0.00 C ATOM 46 CG2 ILE A 912 -3.441 -26.303 -20.217 1.00 0.00 C ATOM 47 CD1 ILE A 912 -5.249 -27.686 -18.198 1.00 0.00 C ATOM 0 H ILE A 912 -1.666 -29.944 -19.300 1.00 0.00 H new ATOM 0 HA ILE A 912 -2.946 -28.612 -21.604 1.00 0.00 H new ATOM 0 HB ILE A 912 -2.551 -27.584 -18.760 1.00 0.00 H new ATOM 0 HG12 ILE A 912 -5.088 -28.489 -20.170 1.00 0.00 H new ATOM 0 HG13 ILE A 912 -4.236 -29.410 -18.947 1.00 0.00 H new ATOM 0 HG21 ILE A 912 -3.999 -25.723 -19.482 1.00 0.00 H new ATOM 0 HG22 ILE A 912 -2.500 -25.800 -20.437 1.00 0.00 H new ATOM 0 HG23 ILE A 912 -4.028 -26.391 -21.131 1.00 0.00 H new ATOM 0 HD11 ILE A 912 -6.160 -28.244 -17.983 1.00 0.00 H new ATOM 0 HD12 ILE A 912 -4.643 -27.618 -17.294 1.00 0.00 H new ATOM 0 HD13 ILE A 912 -5.509 -26.683 -18.537 1.00 0.00 H new ATOM 59 N SER A 913 -0.110 -27.923 -20.022 1.00 0.00 N ATOM 60 CA SER A 913 1.207 -27.291 -20.129 1.00 0.00 C ATOM 61 C SER A 913 1.088 -25.768 -19.993 1.00 0.00 C ATOM 62 O SER A 913 0.004 -25.199 -20.149 1.00 0.00 O ATOM 63 CB SER A 913 1.890 -27.678 -21.450 1.00 0.00 C ATOM 64 OG SER A 913 3.213 -27.176 -21.532 1.00 0.00 O ATOM 0 H SER A 913 -0.254 -28.426 -19.147 1.00 0.00 H new ATOM 0 HA SER A 913 1.830 -27.654 -19.312 1.00 0.00 H new ATOM 0 HB2 SER A 913 1.908 -28.764 -21.544 1.00 0.00 H new ATOM 0 HB3 SER A 913 1.305 -27.295 -22.286 1.00 0.00 H new ATOM 0 HG SER A 913 3.613 -27.445 -22.385 1.00 0.00 H new ATOM 70 N GLY A 914 2.195 -25.115 -19.667 1.00 0.00 N ATOM 71 CA GLY A 914 2.180 -23.674 -19.485 1.00 0.00 C ATOM 72 C GLY A 914 2.724 -23.262 -18.134 1.00 0.00 C ATOM 73 O GLY A 914 2.696 -22.083 -17.776 1.00 0.00 O ATOM 0 H GLY A 914 3.104 -25.556 -19.525 1.00 0.00 H new ATOM 0 HA2 GLY A 914 2.771 -23.204 -20.271 1.00 0.00 H new ATOM 0 HA3 GLY A 914 1.159 -23.307 -19.591 1.00 0.00 H new ATOM 75 N GLY A 915 3.219 -24.236 -17.380 1.00 0.00 N ATOM 76 CA GLY A 915 3.782 -23.957 -16.075 1.00 0.00 C ATOM 77 C GLY A 915 2.728 -23.934 -14.989 1.00 0.00 C ATOM 78 O GLY A 915 2.338 -24.981 -14.470 1.00 0.00 O ATOM 0 H GLY A 915 3.240 -25.219 -17.652 1.00 0.00 H new ATOM 0 HA2 GLY A 915 4.531 -24.712 -15.836 1.00 0.00 H new ATOM 0 HA3 GLY A 915 4.295 -22.996 -16.101 1.00 0.00 H new ATOM 81 N GLY A 916 2.247 -22.744 -14.667 1.00 0.00 N ATOM 82 CA GLY A 916 1.260 -22.595 -13.619 1.00 0.00 C ATOM 83 C GLY A 916 0.391 -21.373 -13.829 1.00 0.00 C ATOM 84 O GLY A 916 0.248 -20.898 -14.956 1.00 0.00 O ATOM 0 H GLY A 916 2.525 -21.872 -15.117 1.00 0.00 H new ATOM 0 HA2 GLY A 916 0.632 -23.485 -13.583 1.00 0.00 H new ATOM 0 HA3 GLY A 916 1.763 -22.521 -12.655 1.00 0.00 H new ATOM 87 N GLY A 917 -0.194 -20.873 -12.749 1.00 0.00 N ATOM 88 CA GLY A 917 -1.026 -19.687 -12.833 1.00 0.00 C ATOM 89 C GLY A 917 -0.265 -18.429 -12.467 1.00 0.00 C ATOM 90 O GLY A 917 -0.301 -17.439 -13.197 1.00 0.00 O ATOM 0 H GLY A 917 -0.107 -21.268 -11.813 1.00 0.00 H new ATOM 0 HA2 GLY A 917 -1.418 -19.591 -13.845 1.00 0.00 H new ATOM 0 HA3 GLY A 917 -1.883 -19.798 -12.168 1.00 0.00 H new ATOM 93 N GLY A 918 0.419 -18.470 -11.332 1.00 0.00 N ATOM 94 CA GLY A 918 1.229 -17.344 -10.908 1.00 0.00 C ATOM 95 C GLY A 918 0.415 -16.235 -10.277 1.00 0.00 C ATOM 96 O GLY A 918 -0.653 -16.480 -9.720 1.00 0.00 O ATOM 0 H GLY A 918 0.428 -19.266 -10.694 1.00 0.00 H new ATOM 0 HA2 GLY A 918 1.977 -17.690 -10.194 1.00 0.00 H new ATOM 0 HA3 GLY A 918 1.769 -16.947 -11.768 1.00 0.00 H new ATOM 99 N ILE A 919 0.936 -15.017 -10.355 1.00 0.00 N ATOM 100 CA ILE A 919 0.276 -13.850 -9.872 1.00 0.00 C ATOM 101 C ILE A 919 -0.868 -13.480 -10.817 1.00 0.00 C ATOM 102 O ILE A 919 -0.664 -13.312 -12.022 1.00 0.00 O ATOM 103 CB ILE A 919 1.325 -12.712 -9.733 1.00 0.00 C ATOM 104 CG1 ILE A 919 0.774 -11.382 -10.203 1.00 0.00 C ATOM 105 CG2 ILE A 919 2.605 -13.029 -10.494 1.00 0.00 C ATOM 106 CD1 ILE A 919 -0.122 -10.683 -9.204 1.00 0.00 C ATOM 0 H ILE A 919 1.849 -14.828 -10.768 1.00 0.00 H new ATOM 0 HA ILE A 919 -0.165 -14.026 -8.891 1.00 0.00 H new ATOM 0 HB ILE A 919 1.559 -12.638 -8.671 1.00 0.00 H new ATOM 0 HG12 ILE A 919 1.608 -10.724 -10.446 1.00 0.00 H new ATOM 0 HG13 ILE A 919 0.214 -11.541 -11.125 1.00 0.00 H new ATOM 0 HG21 ILE A 919 3.313 -12.209 -10.372 1.00 0.00 H new ATOM 0 HG22 ILE A 919 3.043 -13.948 -10.103 1.00 0.00 H new ATOM 0 HG23 ILE A 919 2.377 -13.157 -11.552 1.00 0.00 H new ATOM 0 HD11 ILE A 919 -0.470 -9.740 -9.625 1.00 0.00 H new ATOM 0 HD12 ILE A 919 -0.979 -11.317 -8.978 1.00 0.00 H new ATOM 0 HD13 ILE A 919 0.437 -10.488 -8.289 1.00 0.00 H new ATOM 118 N ARG A 920 -2.075 -13.400 -10.266 1.00 0.00 N ATOM 119 CA ARG A 920 -3.271 -13.150 -11.061 1.00 0.00 C ATOM 120 C ARG A 920 -4.460 -12.749 -10.182 1.00 0.00 C ATOM 121 O ARG A 920 -5.434 -12.177 -10.675 1.00 0.00 O ATOM 122 CB ARG A 920 -3.626 -14.403 -11.875 1.00 0.00 C ATOM 123 CG ARG A 920 -4.869 -14.252 -12.739 1.00 0.00 C ATOM 124 CD ARG A 920 -5.048 -15.441 -13.670 1.00 0.00 C ATOM 125 NE ARG A 920 -3.990 -15.511 -14.680 1.00 0.00 N ATOM 126 CZ ARG A 920 -3.739 -16.580 -15.435 1.00 0.00 C ATOM 127 NH1 ARG A 920 -4.450 -17.691 -15.288 1.00 0.00 N ATOM 128 NH2 ARG A 920 -2.771 -16.532 -16.340 1.00 0.00 N ATOM 0 H ARG A 920 -2.250 -13.505 -9.267 1.00 0.00 H new ATOM 0 HA ARG A 920 -3.057 -12.320 -11.735 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -2.781 -14.659 -12.515 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -3.772 -15.238 -11.190 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -5.747 -14.153 -12.101 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -4.796 -13.336 -13.326 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -5.053 -16.361 -13.086 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -6.017 -15.372 -14.164 1.00 0.00 H new ATOM 0 HE ARG A 920 -3.406 -14.686 -14.815 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -5.195 -17.731 -14.593 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -4.251 -18.505 -15.870 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -2.223 -15.680 -16.456 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -2.575 -17.347 -16.921 1.00 0.00 H new ATOM 142 N SER A 921 -4.366 -13.027 -8.884 1.00 0.00 N ATOM 143 CA SER A 921 -5.493 -12.861 -7.968 1.00 0.00 C ATOM 144 C SER A 921 -5.956 -11.406 -7.875 1.00 0.00 C ATOM 145 O SER A 921 -5.412 -10.612 -7.109 1.00 0.00 O ATOM 146 CB SER A 921 -5.107 -13.362 -6.578 1.00 0.00 C ATOM 147 OG SER A 921 -4.500 -14.642 -6.653 1.00 0.00 O ATOM 0 H SER A 921 -3.515 -13.371 -8.440 1.00 0.00 H new ATOM 0 HA SER A 921 -6.322 -13.447 -8.364 1.00 0.00 H new ATOM 0 HB2 SER A 921 -4.421 -12.656 -6.110 1.00 0.00 H new ATOM 0 HB3 SER A 921 -5.993 -13.412 -5.946 1.00 0.00 H new ATOM 0 HG SER A 921 -3.537 -14.539 -6.800 1.00 0.00 H new ATOM 153 N ASN A 922 -6.956 -11.056 -8.667 1.00 0.00 N ATOM 154 CA ASN A 922 -7.527 -9.722 -8.613 1.00 0.00 C ATOM 155 C ASN A 922 -8.604 -9.684 -7.538 1.00 0.00 C ATOM 156 O ASN A 922 -9.787 -9.864 -7.817 1.00 0.00 O ATOM 157 CB ASN A 922 -8.086 -9.324 -9.987 1.00 0.00 C ATOM 158 CG ASN A 922 -8.636 -7.910 -10.032 1.00 0.00 C ATOM 159 OD1 ASN A 922 -7.890 -6.948 -10.225 1.00 0.00 O ATOM 160 ND2 ASN A 922 -9.948 -7.776 -9.901 1.00 0.00 N ATOM 0 H ASN A 922 -7.388 -11.676 -9.353 1.00 0.00 H new ATOM 0 HA ASN A 922 -6.754 -8.998 -8.356 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -7.298 -9.422 -10.733 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -8.876 -10.021 -10.265 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -10.375 -6.851 -9.959 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -10.531 -8.598 -9.742 1.00 0.00 H new ATOM 167 N ASP A 923 -8.169 -9.505 -6.297 1.00 0.00 N ATOM 168 CA ASP A 923 -9.072 -9.543 -5.154 1.00 0.00 C ATOM 169 C ASP A 923 -8.934 -8.284 -4.306 1.00 0.00 C ATOM 170 O ASP A 923 -8.254 -7.342 -4.689 1.00 0.00 O ATOM 171 CB ASP A 923 -8.804 -10.787 -4.297 1.00 0.00 C ATOM 172 CG ASP A 923 -9.196 -12.079 -4.992 1.00 0.00 C ATOM 173 OD1 ASP A 923 -10.397 -12.419 -4.993 1.00 0.00 O ATOM 174 OD2 ASP A 923 -8.305 -12.768 -5.536 1.00 0.00 O ATOM 0 H ASP A 923 -7.193 -9.332 -6.056 1.00 0.00 H new ATOM 0 HA ASP A 923 -10.092 -9.591 -5.535 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -7.745 -10.825 -4.041 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -9.355 -10.702 -3.360 1.00 0.00 H new ATOM 179 N LYS A 924 -9.528 -8.315 -3.124 1.00 0.00 N ATOM 180 CA LYS A 924 -9.696 -7.112 -2.299 1.00 0.00 C ATOM 181 C LYS A 924 -8.387 -6.373 -2.024 1.00 0.00 C ATOM 182 O LYS A 924 -8.394 -5.151 -1.880 1.00 0.00 O ATOM 183 CB LYS A 924 -10.351 -7.447 -0.968 1.00 0.00 C ATOM 184 CG LYS A 924 -11.819 -7.817 -1.063 1.00 0.00 C ATOM 185 CD LYS A 924 -12.616 -6.710 -1.737 1.00 0.00 C ATOM 186 CE LYS A 924 -14.115 -6.919 -1.601 1.00 0.00 C ATOM 187 NZ LYS A 924 -14.570 -6.761 -0.195 1.00 0.00 N ATOM 0 H LYS A 924 -9.907 -9.164 -2.705 1.00 0.00 H new ATOM 0 HA LYS A 924 -10.337 -6.453 -2.884 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -9.810 -8.275 -0.510 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -10.248 -6.591 -0.301 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -11.929 -8.744 -1.626 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -12.217 -8.001 -0.065 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -12.343 -5.750 -1.299 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -12.351 -6.665 -2.793 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -14.640 -6.205 -2.235 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -14.377 -7.915 -1.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -15.603 -6.640 -0.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -14.310 -7.607 0.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -14.116 -5.925 0.225 1.00 0.00 H new ATOM 201 N VAL A 925 -7.275 -7.088 -1.954 1.00 0.00 N ATOM 202 CA VAL A 925 -5.979 -6.441 -1.751 1.00 0.00 C ATOM 203 C VAL A 925 -5.714 -5.405 -2.850 1.00 0.00 C ATOM 204 O VAL A 925 -5.171 -4.339 -2.596 1.00 0.00 O ATOM 205 CB VAL A 925 -4.830 -7.470 -1.693 1.00 0.00 C ATOM 206 CG1 VAL A 925 -5.024 -8.417 -0.526 1.00 0.00 C ATOM 207 CG2 VAL A 925 -4.737 -8.261 -2.990 1.00 0.00 C ATOM 0 H VAL A 925 -7.238 -8.104 -2.033 1.00 0.00 H new ATOM 0 HA VAL A 925 -6.016 -5.931 -0.788 1.00 0.00 H new ATOM 0 HB VAL A 925 -3.898 -6.921 -1.556 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -4.205 -9.136 -0.500 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -5.038 -7.850 0.405 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -5.969 -8.948 -0.641 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -3.919 -8.978 -2.921 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -5.673 -8.793 -3.160 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -4.552 -7.579 -3.820 1.00 0.00 H new ATOM 217 N TYR A 926 -6.171 -5.702 -4.048 1.00 0.00 N ATOM 218 CA TYR A 926 -6.093 -4.772 -5.172 1.00 0.00 C ATOM 219 C TYR A 926 -7.108 -3.665 -5.011 1.00 0.00 C ATOM 220 O TYR A 926 -6.815 -2.521 -5.354 1.00 0.00 O ATOM 221 CB TYR A 926 -6.292 -5.493 -6.524 1.00 0.00 C ATOM 222 CG TYR A 926 -7.603 -5.151 -7.208 1.00 0.00 C ATOM 223 CD1 TYR A 926 -8.757 -5.863 -6.926 1.00 0.00 C ATOM 224 CD2 TYR A 926 -7.691 -4.090 -8.098 1.00 0.00 C ATOM 225 CE1 TYR A 926 -9.960 -5.538 -7.501 1.00 0.00 C ATOM 226 CE2 TYR A 926 -8.892 -3.756 -8.687 1.00 0.00 C ATOM 227 CZ TYR A 926 -10.028 -4.483 -8.382 1.00 0.00 C ATOM 228 OH TYR A 926 -11.236 -4.151 -8.952 1.00 0.00 O ATOM 0 H TYR A 926 -6.609 -6.594 -4.278 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.093 -4.338 -5.173 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -5.467 -5.235 -7.188 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -6.246 -6.570 -6.362 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -8.709 -6.694 -6.237 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -6.806 -3.518 -8.333 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -10.847 -6.106 -7.264 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -8.945 -2.931 -9.382 1.00 0.00 H new ATOM 0 HH TYR A 926 -11.905 -4.019 -8.248 1.00 0.00 H new ATOM 238 N GLU A 927 -8.280 -3.951 -4.505 1.00 0.00 N ATOM 239 CA GLU A 927 -9.261 -2.899 -4.410 1.00 0.00 C ATOM 240 C GLU A 927 -9.036 -1.956 -3.240 1.00 0.00 C ATOM 241 O GLU A 927 -9.474 -0.803 -3.290 1.00 0.00 O ATOM 242 CB GLU A 927 -10.684 -3.375 -4.533 1.00 0.00 C ATOM 243 CG GLU A 927 -11.302 -2.674 -5.702 1.00 0.00 C ATOM 244 CD GLU A 927 -12.805 -2.811 -5.789 1.00 0.00 C ATOM 245 OE1 GLU A 927 -13.518 -2.172 -4.987 1.00 0.00 O ATOM 246 OE2 GLU A 927 -13.282 -3.537 -6.681 1.00 0.00 O ATOM 0 H GLU A 927 -8.573 -4.867 -4.164 1.00 0.00 H new ATOM 0 HA GLU A 927 -9.094 -2.291 -5.299 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -10.714 -4.455 -4.676 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -11.239 -3.158 -3.620 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -11.048 -1.615 -5.651 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -10.860 -3.064 -6.619 1.00 0.00 H new ATOM 253 N ASN A 928 -8.354 -2.396 -2.209 1.00 0.00 N ATOM 254 CA ASN A 928 -7.916 -1.480 -1.172 1.00 0.00 C ATOM 255 C ASN A 928 -6.778 -0.602 -1.693 1.00 0.00 C ATOM 256 O ASN A 928 -6.597 0.530 -1.256 1.00 0.00 O ATOM 257 CB ASN A 928 -7.547 -2.245 0.078 1.00 0.00 C ATOM 258 CG ASN A 928 -8.792 -2.854 0.666 1.00 0.00 C ATOM 259 OD1 ASN A 928 -9.837 -2.205 0.745 1.00 0.00 O ATOM 260 ND2 ASN A 928 -8.711 -4.110 1.013 1.00 0.00 N ATOM 0 H ASN A 928 -8.091 -3.370 -2.062 1.00 0.00 H new ATOM 0 HA ASN A 928 -8.732 -0.811 -0.901 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -6.822 -3.024 -0.158 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -7.076 -1.579 0.801 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -9.535 -4.595 1.367 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -7.824 -4.606 0.930 1.00 0.00 H new ATOM 267 N VAL A 929 -6.033 -1.146 -2.653 1.00 0.00 N ATOM 268 CA VAL A 929 -5.012 -0.399 -3.397 1.00 0.00 C ATOM 269 C VAL A 929 -5.676 0.493 -4.438 1.00 0.00 C ATOM 270 O VAL A 929 -5.150 1.561 -4.748 1.00 0.00 O ATOM 271 CB VAL A 929 -3.980 -1.315 -4.096 1.00 0.00 C ATOM 272 CG1 VAL A 929 -3.001 -0.500 -4.922 1.00 0.00 C ATOM 273 CG2 VAL A 929 -3.233 -2.164 -3.087 1.00 0.00 C ATOM 0 H VAL A 929 -6.118 -2.121 -2.940 1.00 0.00 H new ATOM 0 HA VAL A 929 -4.471 0.201 -2.665 1.00 0.00 H new ATOM 0 HB VAL A 929 -4.529 -1.978 -4.765 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -2.286 -1.168 -5.403 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -3.545 0.059 -5.684 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -2.468 0.195 -4.273 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -2.514 -2.798 -3.606 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -2.706 -1.517 -2.386 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -3.941 -2.789 -2.542 1.00 0.00 H new ATOM 283 N THR A 930 -6.820 0.114 -4.954 1.00 0.00 N ATOM 284 CA THR A 930 -7.562 1.031 -5.796 1.00 0.00 C ATOM 285 C THR A 930 -7.933 2.270 -4.974 1.00 0.00 C ATOM 286 O THR A 930 -7.844 3.399 -5.448 1.00 0.00 O ATOM 287 CB THR A 930 -8.830 0.363 -6.367 1.00 0.00 C ATOM 288 OG1 THR A 930 -8.479 -0.886 -6.982 1.00 0.00 O ATOM 289 CG2 THR A 930 -9.514 1.260 -7.389 1.00 0.00 C ATOM 0 H THR A 930 -7.252 -0.799 -4.813 1.00 0.00 H new ATOM 0 HA THR A 930 -6.938 1.322 -6.641 1.00 0.00 H new ATOM 0 HB THR A 930 -9.525 0.191 -5.545 1.00 0.00 H new ATOM 0 HG1 THR A 930 -9.186 -1.154 -7.605 1.00 0.00 H new ATOM 0 HG21 THR A 930 -10.404 0.761 -7.773 1.00 0.00 H new ATOM 0 HG22 THR A 930 -9.800 2.199 -6.915 1.00 0.00 H new ATOM 0 HG23 THR A 930 -8.828 1.463 -8.212 1.00 0.00 H new ATOM 297 N GLY A 931 -8.316 2.026 -3.726 1.00 0.00 N ATOM 298 CA GLY A 931 -8.625 3.109 -2.805 1.00 0.00 C ATOM 299 C GLY A 931 -7.397 3.887 -2.339 1.00 0.00 C ATOM 300 O GLY A 931 -7.357 5.112 -2.470 1.00 0.00 O ATOM 0 H GLY A 931 -8.419 1.091 -3.331 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -9.319 3.797 -3.287 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -9.136 2.699 -1.934 1.00 0.00 H new ATOM 304 N LEU A 932 -6.387 3.185 -1.817 1.00 0.00 N ATOM 305 CA LEU A 932 -5.196 3.850 -1.264 1.00 0.00 C ATOM 306 C LEU A 932 -4.429 4.670 -2.310 1.00 0.00 C ATOM 307 O LEU A 932 -4.068 5.820 -2.056 1.00 0.00 O ATOM 308 CB LEU A 932 -4.268 2.824 -0.569 1.00 0.00 C ATOM 309 CG LEU A 932 -3.346 1.970 -1.449 1.00 0.00 C ATOM 310 CD1 LEU A 932 -1.997 2.653 -1.647 1.00 0.00 C ATOM 311 CD2 LEU A 932 -3.149 0.601 -0.820 1.00 0.00 C ATOM 0 H LEU A 932 -6.366 2.167 -1.764 1.00 0.00 H new ATOM 0 HA LEU A 932 -5.552 4.561 -0.518 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -3.643 3.367 0.140 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -4.895 2.147 0.012 1.00 0.00 H new ATOM 0 HG LEU A 932 -3.816 1.852 -2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -1.361 2.028 -2.274 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -2.146 3.619 -2.130 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -1.519 2.801 -0.679 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -2.493 0.001 -1.451 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -2.699 0.715 0.166 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -4.114 0.103 -0.723 1.00 0.00 H new ATOM 323 N VAL A 933 -4.191 4.087 -3.486 1.00 0.00 N ATOM 324 CA VAL A 933 -3.394 4.745 -4.526 1.00 0.00 C ATOM 325 C VAL A 933 -4.134 5.940 -5.101 1.00 0.00 C ATOM 326 O VAL A 933 -3.537 6.991 -5.380 1.00 0.00 O ATOM 327 CB VAL A 933 -3.040 3.771 -5.674 1.00 0.00 C ATOM 328 CG1 VAL A 933 -2.384 4.502 -6.839 1.00 0.00 C ATOM 329 CG2 VAL A 933 -2.128 2.670 -5.168 1.00 0.00 C ATOM 0 H VAL A 933 -4.537 3.163 -3.743 1.00 0.00 H new ATOM 0 HA VAL A 933 -2.471 5.081 -4.052 1.00 0.00 H new ATOM 0 HB VAL A 933 -3.968 3.328 -6.034 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -2.148 3.789 -7.629 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -3.067 5.258 -7.225 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -1.467 4.982 -6.497 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -1.887 1.992 -5.987 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -1.210 3.109 -4.778 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -2.631 2.117 -4.375 1.00 0.00 H new ATOM 339 N LYS A 934 -5.434 5.769 -5.268 1.00 0.00 N ATOM 340 CA LYS A 934 -6.276 6.811 -5.829 1.00 0.00 C ATOM 341 C LYS A 934 -6.140 8.105 -5.027 1.00 0.00 C ATOM 342 O LYS A 934 -6.000 9.183 -5.597 1.00 0.00 O ATOM 343 CB LYS A 934 -7.727 6.328 -5.868 1.00 0.00 C ATOM 344 CG LYS A 934 -8.744 7.398 -6.225 1.00 0.00 C ATOM 345 CD LYS A 934 -8.648 7.794 -7.684 1.00 0.00 C ATOM 346 CE LYS A 934 -9.095 6.668 -8.603 1.00 0.00 C ATOM 347 NZ LYS A 934 -10.492 6.237 -8.323 1.00 0.00 N ATOM 0 H LYS A 934 -5.931 4.913 -5.021 1.00 0.00 H new ATOM 0 HA LYS A 934 -5.954 7.026 -6.848 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -7.806 5.516 -6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -7.984 5.913 -4.893 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -9.748 7.032 -6.012 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -8.585 8.275 -5.598 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -9.263 8.676 -7.863 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -7.620 8.070 -7.919 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -9.018 6.995 -9.640 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -8.423 5.817 -8.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -10.861 5.705 -9.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -10.506 5.631 -7.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -11.087 7.074 -8.159 1.00 0.00 H new ATOM 361 N ALA A 935 -6.152 7.985 -3.711 1.00 0.00 N ATOM 362 CA ALA A 935 -5.981 9.140 -2.836 1.00 0.00 C ATOM 363 C ALA A 935 -4.633 9.828 -3.073 1.00 0.00 C ATOM 364 O ALA A 935 -4.570 11.049 -3.189 1.00 0.00 O ATOM 365 CB ALA A 935 -6.114 8.721 -1.382 1.00 0.00 C ATOM 0 H ALA A 935 -6.278 7.100 -3.221 1.00 0.00 H new ATOM 0 HA ALA A 935 -6.766 9.859 -3.072 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.984 9.592 -0.739 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -7.102 8.291 -1.216 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -5.351 7.979 -1.146 1.00 0.00 H new ATOM 371 N VAL A 936 -3.573 9.022 -3.171 1.00 0.00 N ATOM 372 CA VAL A 936 -2.191 9.508 -3.333 1.00 0.00 C ATOM 373 C VAL A 936 -2.070 10.620 -4.377 1.00 0.00 C ATOM 374 O VAL A 936 -1.906 11.791 -4.038 1.00 0.00 O ATOM 375 CB VAL A 936 -1.262 8.345 -3.744 1.00 0.00 C ATOM 376 CG1 VAL A 936 0.159 8.831 -3.975 1.00 0.00 C ATOM 377 CG2 VAL A 936 -1.300 7.237 -2.704 1.00 0.00 C ATOM 0 H VAL A 936 -3.645 8.005 -3.140 1.00 0.00 H new ATOM 0 HA VAL A 936 -1.895 9.918 -2.367 1.00 0.00 H new ATOM 0 HB VAL A 936 -1.627 7.938 -4.687 1.00 0.00 H new ATOM 0 HG11 VAL A 936 0.789 7.989 -4.263 1.00 0.00 H new ATOM 0 HG12 VAL A 936 0.164 9.577 -4.770 1.00 0.00 H new ATOM 0 HG13 VAL A 936 0.545 9.276 -3.058 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -0.639 6.427 -3.011 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -0.970 7.629 -1.742 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.318 6.859 -2.612 1.00 0.00 H new ATOM 387 N ILE A 937 -2.160 10.241 -5.635 1.00 0.00 N ATOM 388 CA ILE A 937 -1.941 11.161 -6.752 1.00 0.00 C ATOM 389 C ILE A 937 -3.137 12.077 -6.999 1.00 0.00 C ATOM 390 O ILE A 937 -2.966 13.294 -7.199 1.00 0.00 O ATOM 391 CB ILE A 937 -1.606 10.383 -8.044 1.00 0.00 C ATOM 392 CG1 ILE A 937 -2.639 9.273 -8.295 1.00 0.00 C ATOM 393 CG2 ILE A 937 -0.202 9.802 -7.951 1.00 0.00 C ATOM 394 CD1 ILE A 937 -2.373 8.456 -9.541 1.00 0.00 C ATOM 0 H ILE A 937 -2.387 9.288 -5.921 1.00 0.00 H new ATOM 0 HA ILE A 937 -1.095 11.790 -6.475 1.00 0.00 H new ATOM 0 HB ILE A 937 -1.644 11.073 -8.887 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -2.658 8.606 -7.433 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -3.629 9.723 -8.372 1.00 0.00 H new ATOM 0 HG21 ILE A 937 0.027 9.255 -8.866 1.00 0.00 H new ATOM 0 HG22 ILE A 937 0.518 10.610 -7.822 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -0.144 9.125 -7.099 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -3.145 7.694 -9.648 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -2.384 9.109 -10.414 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -1.398 7.976 -9.460 1.00 0.00 H new ATOM 406 N GLU A 938 -4.333 11.531 -6.940 1.00 0.00 N ATOM 407 CA GLU A 938 -5.515 12.297 -7.310 1.00 0.00 C ATOM 408 C GLU A 938 -5.759 13.434 -6.331 1.00 0.00 C ATOM 409 O GLU A 938 -6.057 14.551 -6.731 1.00 0.00 O ATOM 410 CB GLU A 938 -6.745 11.402 -7.420 1.00 0.00 C ATOM 411 CG GLU A 938 -6.643 10.388 -8.547 1.00 0.00 C ATOM 412 CD GLU A 938 -6.404 11.032 -9.895 1.00 0.00 C ATOM 413 OE1 GLU A 938 -7.360 11.589 -10.472 1.00 0.00 O ATOM 414 OE2 GLU A 938 -5.261 10.976 -10.395 1.00 0.00 O ATOM 0 H GLU A 938 -4.517 10.572 -6.644 1.00 0.00 H new ATOM 0 HA GLU A 938 -5.330 12.731 -8.293 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.890 10.875 -6.477 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.627 12.023 -7.577 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -5.831 9.693 -8.332 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -7.561 9.802 -8.587 1.00 0.00 H new ATOM 421 N MET A 939 -5.627 13.175 -5.048 1.00 0.00 N ATOM 422 CA MET A 939 -5.771 14.253 -4.090 1.00 0.00 C ATOM 423 C MET A 939 -4.531 15.138 -4.088 1.00 0.00 C ATOM 424 O MET A 939 -4.634 16.334 -3.845 1.00 0.00 O ATOM 425 CB MET A 939 -6.040 13.738 -2.677 1.00 0.00 C ATOM 426 CG MET A 939 -6.679 14.785 -1.778 1.00 0.00 C ATOM 427 SD MET A 939 -6.298 14.557 -0.035 1.00 0.00 S ATOM 428 CE MET A 939 -4.596 15.113 0.009 1.00 0.00 C ATOM 0 H MET A 939 -5.426 12.257 -4.651 1.00 0.00 H new ATOM 0 HA MET A 939 -6.636 14.839 -4.401 1.00 0.00 H new ATOM 0 HB2 MET A 939 -6.692 12.866 -2.731 1.00 0.00 H new ATOM 0 HB3 MET A 939 -5.102 13.407 -2.231 1.00 0.00 H new ATOM 0 HG2 MET A 939 -6.344 15.774 -2.089 1.00 0.00 H new ATOM 0 HG3 MET A 939 -7.760 14.758 -1.913 1.00 0.00 H new ATOM 0 HE1 MET A 939 -4.180 14.934 1.001 1.00 0.00 H new ATOM 0 HE2 MET A 939 -4.015 14.565 -0.733 1.00 0.00 H new ATOM 0 HE3 MET A 939 -4.556 16.179 -0.214 1.00 0.00 H new ATOM 438 N SER A 940 -3.388 14.549 -4.450 1.00 0.00 N ATOM 439 CA SER A 940 -2.077 15.189 -4.311 1.00 0.00 C ATOM 440 C SER A 940 -2.068 16.603 -4.872 1.00 0.00 C ATOM 441 O SER A 940 -1.707 17.567 -4.187 1.00 0.00 O ATOM 442 CB SER A 940 -1.039 14.379 -5.094 1.00 0.00 C ATOM 443 OG SER A 940 0.270 14.904 -4.914 1.00 0.00 O ATOM 0 H SER A 940 -3.346 13.611 -4.849 1.00 0.00 H new ATOM 0 HA SER A 940 -1.846 15.228 -3.246 1.00 0.00 H new ATOM 0 HB2 SER A 940 -1.064 13.339 -4.767 1.00 0.00 H new ATOM 0 HB3 SER A 940 -1.293 14.386 -6.154 1.00 0.00 H new ATOM 0 HG SER A 940 0.512 15.453 -5.689 1.00 0.00 H new ATOM 449 N SER A 941 -2.488 16.709 -6.122 1.00 0.00 N ATOM 450 CA SER A 941 -2.428 17.961 -6.863 1.00 0.00 C ATOM 451 C SER A 941 -3.799 18.383 -7.382 1.00 0.00 C ATOM 452 O SER A 941 -4.014 19.556 -7.686 1.00 0.00 O ATOM 453 CB SER A 941 -1.461 17.785 -8.034 1.00 0.00 C ATOM 454 OG SER A 941 -1.717 16.570 -8.722 1.00 0.00 O ATOM 0 H SER A 941 -2.880 15.931 -6.652 1.00 0.00 H new ATOM 0 HA SER A 941 -2.082 18.747 -6.191 1.00 0.00 H new ATOM 0 HB2 SER A 941 -1.559 18.625 -8.722 1.00 0.00 H new ATOM 0 HB3 SER A 941 -0.434 17.791 -7.668 1.00 0.00 H new ATOM 0 HG SER A 941 -1.089 16.478 -9.468 1.00 0.00 H new ATOM 460 N LYS A 942 -4.733 17.450 -7.467 1.00 0.00 N ATOM 461 CA LYS A 942 -6.021 17.776 -8.068 1.00 0.00 C ATOM 462 C LYS A 942 -6.931 18.454 -7.046 1.00 0.00 C ATOM 463 O LYS A 942 -7.685 19.364 -7.394 1.00 0.00 O ATOM 464 CB LYS A 942 -6.715 16.564 -8.698 1.00 0.00 C ATOM 465 CG LYS A 942 -5.925 15.872 -9.805 1.00 0.00 C ATOM 466 CD LYS A 942 -4.701 15.147 -9.269 1.00 0.00 C ATOM 467 CE LYS A 942 -4.043 14.283 -10.336 1.00 0.00 C ATOM 468 NZ LYS A 942 -3.628 15.075 -11.526 1.00 0.00 N ATOM 0 H LYS A 942 -4.633 16.489 -7.140 1.00 0.00 H new ATOM 0 HA LYS A 942 -5.820 18.470 -8.884 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -6.926 15.837 -7.914 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -7.675 16.884 -9.103 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -6.571 15.160 -10.319 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -5.613 16.611 -10.543 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -3.981 15.876 -8.897 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -4.990 14.523 -8.423 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -3.171 13.786 -9.911 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -4.736 13.501 -10.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -3.096 14.466 -12.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -4.472 15.446 -12.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -3.026 15.867 -11.223 1.00 0.00 H new ATOM 482 N ILE A 943 -6.888 17.949 -5.802 1.00 0.00 N ATOM 483 CA ILE A 943 -7.667 18.524 -4.689 1.00 0.00 C ATOM 484 C ILE A 943 -7.796 20.060 -4.782 1.00 0.00 C ATOM 485 O ILE A 943 -8.891 20.590 -4.577 1.00 0.00 O ATOM 486 CB ILE A 943 -7.089 18.098 -3.304 1.00 0.00 C ATOM 487 CG1 ILE A 943 -8.149 18.218 -2.190 1.00 0.00 C ATOM 488 CG2 ILE A 943 -5.847 18.906 -2.943 1.00 0.00 C ATOM 489 CD1 ILE A 943 -8.409 19.631 -1.701 1.00 0.00 C ATOM 0 H ILE A 943 -6.321 17.142 -5.540 1.00 0.00 H new ATOM 0 HA ILE A 943 -8.673 18.114 -4.779 1.00 0.00 H new ATOM 0 HB ILE A 943 -6.800 17.051 -3.389 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -9.086 17.798 -2.554 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -7.834 17.609 -1.343 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -5.472 18.582 -1.972 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -5.078 18.749 -3.700 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -6.102 19.965 -2.899 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -9.168 19.612 -0.919 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -7.487 20.053 -1.301 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -8.758 20.245 -2.531 1.00 0.00 H new ATOM 501 N GLN A 944 -6.717 20.765 -5.131 1.00 0.00 N ATOM 502 CA GLN A 944 -6.778 22.215 -5.302 1.00 0.00 C ATOM 503 C GLN A 944 -5.441 22.748 -5.821 1.00 0.00 C ATOM 504 O GLN A 944 -4.388 22.210 -5.477 1.00 0.00 O ATOM 505 CB GLN A 944 -7.153 22.888 -3.971 1.00 0.00 C ATOM 506 CG GLN A 944 -7.443 24.373 -4.090 1.00 0.00 C ATOM 507 CD GLN A 944 -8.117 24.939 -2.857 1.00 0.00 C ATOM 508 OE1 GLN A 944 -7.934 24.443 -1.749 1.00 0.00 O ATOM 509 NE2 GLN A 944 -8.902 25.986 -3.041 1.00 0.00 N ATOM 0 H GLN A 944 -5.797 20.357 -5.299 1.00 0.00 H new ATOM 0 HA GLN A 944 -7.547 22.451 -6.038 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -8.030 22.389 -3.558 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -6.339 22.743 -3.260 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -6.510 24.908 -4.267 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -8.079 24.546 -4.958 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -9.029 26.370 -3.977 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -9.381 26.410 -2.247 1.00 0.00 H new ATOM 518 N PRO A 945 -5.468 23.773 -6.699 1.00 0.00 N ATOM 519 CA PRO A 945 -4.250 24.453 -7.162 1.00 0.00 C ATOM 520 C PRO A 945 -3.384 24.911 -5.989 1.00 0.00 C ATOM 521 O PRO A 945 -2.172 24.681 -5.969 1.00 0.00 O ATOM 522 CB PRO A 945 -4.785 25.654 -7.944 1.00 0.00 C ATOM 523 CG PRO A 945 -6.136 25.229 -8.409 1.00 0.00 C ATOM 524 CD PRO A 945 -6.680 24.327 -7.335 1.00 0.00 C ATOM 0 HA PRO A 945 -3.611 23.803 -7.759 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -4.844 26.542 -7.315 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -4.136 25.901 -8.784 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -6.786 26.091 -8.560 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -6.073 24.706 -9.363 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -7.291 24.878 -6.620 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -7.309 23.541 -7.753 1.00 0.00 H new ATOM 532 N ALA A 946 -4.012 25.571 -5.022 1.00 0.00 N ATOM 533 CA ALA A 946 -3.372 25.857 -3.747 1.00 0.00 C ATOM 534 C ALA A 946 -3.987 24.958 -2.676 1.00 0.00 C ATOM 535 O ALA A 946 -4.933 25.346 -1.988 1.00 0.00 O ATOM 536 CB ALA A 946 -3.521 27.327 -3.377 1.00 0.00 C ATOM 0 H ALA A 946 -4.968 25.919 -5.099 1.00 0.00 H new ATOM 0 HA ALA A 946 -2.304 25.653 -3.824 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -3.034 27.513 -2.420 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -3.057 27.945 -4.146 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -4.579 27.577 -3.300 1.00 0.00 H new ATOM 542 N PRO A 947 -3.466 23.734 -2.541 1.00 0.00 N ATOM 543 CA PRO A 947 -4.097 22.684 -1.753 1.00 0.00 C ATOM 544 C PRO A 947 -3.708 22.705 -0.280 1.00 0.00 C ATOM 545 O PRO A 947 -2.534 22.562 0.071 1.00 0.00 O ATOM 546 CB PRO A 947 -3.585 21.414 -2.422 1.00 0.00 C ATOM 547 CG PRO A 947 -2.258 21.774 -3.009 1.00 0.00 C ATOM 548 CD PRO A 947 -2.203 23.278 -3.132 1.00 0.00 C ATOM 0 HA PRO A 947 -5.182 22.788 -1.739 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -3.487 20.603 -1.700 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -4.275 21.072 -3.194 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -1.449 21.412 -2.375 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -2.132 21.306 -3.985 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -1.344 23.690 -2.602 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -2.115 23.589 -4.173 1.00 0.00 H new ATOM 556 N PRO A 948 -4.704 22.870 0.599 1.00 0.00 N ATOM 557 CA PRO A 948 -4.507 22.846 2.047 1.00 0.00 C ATOM 558 C PRO A 948 -4.189 21.462 2.557 1.00 0.00 C ATOM 559 O PRO A 948 -3.982 20.532 1.784 1.00 0.00 O ATOM 560 CB PRO A 948 -5.862 23.242 2.615 1.00 0.00 C ATOM 561 CG PRO A 948 -6.629 23.803 1.468 1.00 0.00 C ATOM 562 CD PRO A 948 -6.109 23.102 0.251 1.00 0.00 C ATOM 0 HA PRO A 948 -3.680 23.497 2.331 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -6.374 22.381 3.045 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -5.753 23.978 3.411 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -7.698 23.632 1.591 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -6.485 24.881 1.390 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -6.640 22.169 0.061 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -6.210 23.714 -0.645 1.00 0.00 H new ATOM 570 N GLU A 949 -4.219 21.313 3.868 1.00 0.00 N ATOM 571 CA GLU A 949 -3.977 20.037 4.477 1.00 0.00 C ATOM 572 C GLU A 949 -5.215 19.207 4.496 1.00 0.00 C ATOM 573 O GLU A 949 -5.894 19.088 5.512 1.00 0.00 O ATOM 574 CB GLU A 949 -3.444 20.117 5.890 1.00 0.00 C ATOM 575 CG GLU A 949 -3.515 21.493 6.532 1.00 0.00 C ATOM 576 CD GLU A 949 -4.925 21.958 6.820 1.00 0.00 C ATOM 577 OE1 GLU A 949 -5.443 21.668 7.918 1.00 0.00 O ATOM 578 OE2 GLU A 949 -5.514 22.637 5.958 1.00 0.00 O ATOM 0 H GLU A 949 -4.410 22.068 4.526 1.00 0.00 H new ATOM 0 HA GLU A 949 -3.208 19.578 3.856 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -4.000 19.415 6.511 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -2.405 19.788 5.888 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -2.949 21.479 7.464 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -3.031 22.216 5.876 1.00 0.00 H new ATOM 585 N GLU A 950 -5.524 18.680 3.354 1.00 0.00 N ATOM 586 CA GLU A 950 -6.333 17.496 3.302 1.00 0.00 C ATOM 587 C GLU A 950 -5.410 16.302 3.487 1.00 0.00 C ATOM 588 O GLU A 950 -5.814 15.178 3.296 1.00 0.00 O ATOM 589 CB GLU A 950 -7.089 17.366 1.987 1.00 0.00 C ATOM 590 CG GLU A 950 -7.936 18.578 1.639 1.00 0.00 C ATOM 591 CD GLU A 950 -9.044 18.822 2.640 1.00 0.00 C ATOM 592 OE1 GLU A 950 -10.067 18.106 2.586 1.00 0.00 O ATOM 593 OE2 GLU A 950 -8.903 19.729 3.481 1.00 0.00 O ATOM 0 H GLU A 950 -5.232 19.045 2.447 1.00 0.00 H new ATOM 0 HA GLU A 950 -7.085 17.547 4.089 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -6.373 17.193 1.184 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -7.732 16.487 2.035 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -7.297 19.460 1.588 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -8.370 18.441 0.649 1.00 0.00 H new ATOM 600 N TYR A 951 -4.155 16.585 3.859 1.00 0.00 N ATOM 601 CA TYR A 951 -3.130 15.556 4.048 1.00 0.00 C ATOM 602 C TYR A 951 -3.435 14.758 5.306 1.00 0.00 C ATOM 603 O TYR A 951 -3.535 13.547 5.268 1.00 0.00 O ATOM 604 CB TYR A 951 -1.716 16.164 4.167 1.00 0.00 C ATOM 605 CG TYR A 951 -1.404 17.295 3.200 1.00 0.00 C ATOM 606 CD1 TYR A 951 -2.267 17.626 2.165 1.00 0.00 C ATOM 607 CD2 TYR A 951 -0.239 18.043 3.339 1.00 0.00 C ATOM 608 CE1 TYR A 951 -1.988 18.657 1.301 1.00 0.00 C ATOM 609 CE2 TYR A 951 0.047 19.083 2.472 1.00 0.00 C ATOM 610 CZ TYR A 951 -0.838 19.384 1.454 1.00 0.00 C ATOM 611 OH TYR A 951 -0.569 20.401 0.573 1.00 0.00 O ATOM 0 H TYR A 951 -3.824 17.533 4.037 1.00 0.00 H new ATOM 0 HA TYR A 951 -3.148 14.909 3.171 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -1.583 16.532 5.184 1.00 0.00 H new ATOM 0 HB3 TYR A 951 -0.985 15.370 4.017 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -3.178 17.061 2.036 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.452 17.809 4.135 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -2.675 18.894 0.502 1.00 0.00 H new ATOM 0 HE2 TYR A 951 0.955 19.655 2.590 1.00 0.00 H new ATOM 0 HH TYR A 951 -1.332 21.015 0.539 1.00 0.00 H new ATOM 621 N VAL A 952 -3.558 15.452 6.425 1.00 0.00 N ATOM 622 CA VAL A 952 -4.009 14.829 7.659 1.00 0.00 C ATOM 623 C VAL A 952 -5.418 14.222 7.501 1.00 0.00 C ATOM 624 O VAL A 952 -5.651 13.112 7.972 1.00 0.00 O ATOM 625 CB VAL A 952 -3.904 15.785 8.890 1.00 0.00 C ATOM 626 CG1 VAL A 952 -4.163 17.236 8.513 1.00 0.00 C ATOM 627 CG2 VAL A 952 -4.842 15.351 10.012 1.00 0.00 C ATOM 0 H VAL A 952 -3.352 16.448 6.505 1.00 0.00 H new ATOM 0 HA VAL A 952 -3.326 14.005 7.867 1.00 0.00 H new ATOM 0 HB VAL A 952 -2.878 15.716 9.251 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -4.079 17.863 9.401 1.00 0.00 H new ATOM 0 HG12 VAL A 952 -3.430 17.556 7.772 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -5.166 17.330 8.096 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -4.745 16.037 10.853 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -5.871 15.363 9.651 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -4.582 14.343 10.334 1.00 0.00 H new ATOM 637 N PRO A 953 -6.389 14.906 6.840 1.00 0.00 N ATOM 638 CA PRO A 953 -7.639 14.255 6.442 1.00 0.00 C ATOM 639 C PRO A 953 -7.383 13.006 5.596 1.00 0.00 C ATOM 640 O PRO A 953 -8.056 11.984 5.736 1.00 0.00 O ATOM 641 CB PRO A 953 -8.366 15.331 5.643 1.00 0.00 C ATOM 642 CG PRO A 953 -7.866 16.600 6.226 1.00 0.00 C ATOM 643 CD PRO A 953 -6.420 16.345 6.541 1.00 0.00 C ATOM 0 HA PRO A 953 -8.216 13.901 7.296 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -8.139 15.262 4.579 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -9.448 15.243 5.744 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -7.976 17.426 5.524 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -8.423 16.868 7.124 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -5.774 16.595 5.699 1.00 0.00 H new ATOM 0 HD3 PRO A 953 -6.082 16.940 7.390 1.00 0.00 H new ATOM 651 N MET A 954 -6.385 13.113 4.730 1.00 0.00 N ATOM 652 CA MET A 954 -5.930 12.014 3.894 1.00 0.00 C ATOM 653 C MET A 954 -5.313 10.908 4.740 1.00 0.00 C ATOM 654 O MET A 954 -5.386 9.742 4.374 1.00 0.00 O ATOM 655 CB MET A 954 -4.935 12.527 2.840 1.00 0.00 C ATOM 656 CG MET A 954 -3.777 11.587 2.552 1.00 0.00 C ATOM 657 SD MET A 954 -2.747 12.136 1.179 1.00 0.00 S ATOM 658 CE MET A 954 -3.811 11.757 -0.207 1.00 0.00 C ATOM 0 H MET A 954 -5.863 13.977 4.587 1.00 0.00 H new ATOM 0 HA MET A 954 -6.791 11.591 3.376 1.00 0.00 H new ATOM 0 HB2 MET A 954 -5.474 12.713 1.911 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.534 13.484 3.173 1.00 0.00 H new ATOM 0 HG2 MET A 954 -3.161 11.494 3.446 1.00 0.00 H new ATOM 0 HG3 MET A 954 -4.169 10.594 2.330 1.00 0.00 H new ATOM 0 HE1 MET A 954 -3.446 12.270 -1.097 1.00 0.00 H new ATOM 0 HE2 MET A 954 -3.811 10.681 -0.383 1.00 0.00 H new ATOM 0 HE3 MET A 954 -4.826 12.088 0.012 1.00 0.00 H new ATOM 668 N VAL A 955 -4.711 11.274 5.871 1.00 0.00 N ATOM 669 CA VAL A 955 -4.192 10.283 6.804 1.00 0.00 C ATOM 670 C VAL A 955 -5.297 9.295 7.159 1.00 0.00 C ATOM 671 O VAL A 955 -5.084 8.086 7.197 1.00 0.00 O ATOM 672 CB VAL A 955 -3.642 10.920 8.105 1.00 0.00 C ATOM 673 CG1 VAL A 955 -3.256 9.850 9.117 1.00 0.00 C ATOM 674 CG2 VAL A 955 -2.445 11.807 7.809 1.00 0.00 C ATOM 0 H VAL A 955 -4.573 12.243 6.159 1.00 0.00 H new ATOM 0 HA VAL A 955 -3.362 9.777 6.310 1.00 0.00 H new ATOM 0 HB VAL A 955 -4.436 11.533 8.533 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.873 10.325 10.020 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -4.132 9.251 9.365 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -2.486 9.207 8.691 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -2.077 12.243 8.738 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -1.656 11.212 7.349 1.00 0.00 H new ATOM 0 HG23 VAL A 955 -2.742 12.604 7.127 1.00 0.00 H new ATOM 684 N LYS A 956 -6.483 9.828 7.395 1.00 0.00 N ATOM 685 CA LYS A 956 -7.659 9.009 7.647 1.00 0.00 C ATOM 686 C LYS A 956 -8.074 8.222 6.396 1.00 0.00 C ATOM 687 O LYS A 956 -8.510 7.077 6.499 1.00 0.00 O ATOM 688 CB LYS A 956 -8.832 9.879 8.128 1.00 0.00 C ATOM 689 CG LYS A 956 -8.676 10.451 9.539 1.00 0.00 C ATOM 690 CD LYS A 956 -7.567 11.492 9.622 1.00 0.00 C ATOM 691 CE LYS A 956 -7.492 12.149 10.993 1.00 0.00 C ATOM 692 NZ LYS A 956 -8.682 12.993 11.273 1.00 0.00 N ATOM 0 H LYS A 956 -6.659 10.832 7.418 1.00 0.00 H new ATOM 0 HA LYS A 956 -7.398 8.296 8.429 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -8.962 10.705 7.429 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -9.745 9.284 8.092 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -9.618 10.901 9.852 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -8.463 9.640 10.236 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -6.611 11.020 9.395 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -7.733 12.257 8.864 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -7.406 11.379 11.760 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -6.592 12.761 11.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -8.510 13.564 12.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -8.860 13.622 10.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -9.511 12.384 11.427 1.00 0.00 H new ATOM 706 N GLU A 957 -7.918 8.824 5.216 1.00 0.00 N ATOM 707 CA GLU A 957 -8.401 8.203 3.979 1.00 0.00 C ATOM 708 C GLU A 957 -7.457 7.105 3.485 1.00 0.00 C ATOM 709 O GLU A 957 -7.898 6.008 3.136 1.00 0.00 O ATOM 710 CB GLU A 957 -8.594 9.252 2.880 1.00 0.00 C ATOM 711 CG GLU A 957 -9.698 10.254 3.177 1.00 0.00 C ATOM 712 CD GLU A 957 -10.056 11.100 1.970 1.00 0.00 C ATOM 713 OE1 GLU A 957 -10.876 10.647 1.145 1.00 0.00 O ATOM 714 OE2 GLU A 957 -9.520 12.220 1.836 1.00 0.00 O ATOM 0 H GLU A 957 -7.467 9.730 5.089 1.00 0.00 H new ATOM 0 HA GLU A 957 -9.363 7.745 4.210 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.657 9.790 2.735 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -8.819 8.745 1.942 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -10.585 9.721 3.519 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -9.383 10.905 3.992 1.00 0.00 H new ATOM 721 N VAL A 958 -6.159 7.391 3.478 1.00 0.00 N ATOM 722 CA VAL A 958 -5.164 6.419 3.033 1.00 0.00 C ATOM 723 C VAL A 958 -4.851 5.457 4.151 1.00 0.00 C ATOM 724 O VAL A 958 -4.641 4.271 3.912 1.00 0.00 O ATOM 725 CB VAL A 958 -3.852 7.080 2.544 1.00 0.00 C ATOM 726 CG1 VAL A 958 -4.147 8.088 1.456 1.00 0.00 C ATOM 727 CG2 VAL A 958 -3.086 7.739 3.684 1.00 0.00 C ATOM 0 H VAL A 958 -5.771 8.286 3.775 1.00 0.00 H new ATOM 0 HA VAL A 958 -5.598 5.891 2.184 1.00 0.00 H new ATOM 0 HB VAL A 958 -3.218 6.291 2.139 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -3.216 8.545 1.121 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -4.627 7.586 0.616 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -4.811 8.860 1.845 1.00 0.00 H new ATOM 0 HG21 VAL A 958 -2.173 8.190 3.296 1.00 0.00 H new ATOM 0 HG22 VAL A 958 -3.706 8.510 4.141 1.00 0.00 H new ATOM 0 HG23 VAL A 958 -2.831 6.989 4.432 1.00 0.00 H new ATOM 737 N GLY A 959 -4.870 5.961 5.374 1.00 0.00 N ATOM 738 CA GLY A 959 -4.608 5.127 6.515 1.00 0.00 C ATOM 739 C GLY A 959 -5.612 4.007 6.607 1.00 0.00 C ATOM 740 O GLY A 959 -5.271 2.891 6.978 1.00 0.00 O ATOM 0 H GLY A 959 -5.064 6.938 5.592 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -3.602 4.713 6.444 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -4.643 5.727 7.424 1.00 0.00 H new ATOM 744 N LEU A 960 -6.848 4.309 6.227 1.00 0.00 N ATOM 745 CA LEU A 960 -7.904 3.311 6.184 1.00 0.00 C ATOM 746 C LEU A 960 -7.752 2.416 4.952 1.00 0.00 C ATOM 747 O LEU A 960 -7.982 1.220 5.019 1.00 0.00 O ATOM 748 CB LEU A 960 -9.277 3.987 6.162 1.00 0.00 C ATOM 749 CG LEU A 960 -10.472 3.035 6.278 1.00 0.00 C ATOM 750 CD1 LEU A 960 -10.630 2.540 7.708 1.00 0.00 C ATOM 751 CD2 LEU A 960 -11.747 3.715 5.801 1.00 0.00 C ATOM 0 H LEU A 960 -7.142 5.243 5.943 1.00 0.00 H new ATOM 0 HA LEU A 960 -7.823 2.695 7.080 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -9.324 4.706 6.980 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -9.371 4.553 5.235 1.00 0.00 H new ATOM 0 HG LEU A 960 -10.284 2.172 5.639 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -11.484 1.866 7.767 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -9.727 2.010 8.011 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -10.792 3.390 8.371 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -12.584 3.023 5.891 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -11.939 4.598 6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -11.633 4.012 4.759 1.00 0.00 H new ATOM 763 N ALA A 961 -7.324 2.989 3.840 1.00 0.00 N ATOM 764 CA ALA A 961 -7.285 2.264 2.575 1.00 0.00 C ATOM 765 C ALA A 961 -6.171 1.217 2.551 1.00 0.00 C ATOM 766 O ALA A 961 -6.381 0.076 2.146 1.00 0.00 O ATOM 767 CB ALA A 961 -7.120 3.241 1.428 1.00 0.00 C ATOM 0 H ALA A 961 -6.998 3.954 3.784 1.00 0.00 H new ATOM 0 HA ALA A 961 -8.230 1.732 2.464 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -7.091 2.694 0.486 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -7.959 3.936 1.419 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -6.190 3.796 1.554 1.00 0.00 H new ATOM 773 N LEU A 962 -4.999 1.603 3.025 1.00 0.00 N ATOM 774 CA LEU A 962 -3.827 0.733 3.027 1.00 0.00 C ATOM 775 C LEU A 962 -3.791 -0.127 4.288 1.00 0.00 C ATOM 776 O LEU A 962 -3.105 -1.147 4.310 1.00 0.00 O ATOM 777 CB LEU A 962 -2.540 1.564 2.847 1.00 0.00 C ATOM 778 CG LEU A 962 -2.285 2.628 3.908 1.00 0.00 C ATOM 779 CD1 LEU A 962 -1.643 2.026 5.151 1.00 0.00 C ATOM 780 CD2 LEU A 962 -1.425 3.733 3.329 1.00 0.00 C ATOM 0 H LEU A 962 -4.829 2.528 3.420 1.00 0.00 H new ATOM 0 HA LEU A 962 -3.893 0.050 2.180 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -1.689 0.883 2.830 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -2.577 2.051 1.873 1.00 0.00 H new ATOM 0 HG LEU A 962 -3.242 3.052 4.213 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -1.474 2.810 5.889 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -2.304 1.268 5.571 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -0.691 1.568 4.883 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -1.245 4.491 4.091 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -0.473 3.318 2.999 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -1.937 4.186 2.480 1.00 0.00 H new ATOM 792 N ARG A 963 -4.526 0.238 5.330 1.00 0.00 N ATOM 793 CA ARG A 963 -4.746 -0.722 6.407 1.00 0.00 C ATOM 794 C ARG A 963 -5.717 -1.808 5.952 1.00 0.00 C ATOM 795 O ARG A 963 -5.542 -2.970 6.304 1.00 0.00 O ATOM 796 CB ARG A 963 -5.286 -0.078 7.676 1.00 0.00 C ATOM 797 CG ARG A 963 -6.730 0.363 7.530 1.00 0.00 C ATOM 798 CD ARG A 963 -7.371 0.695 8.857 1.00 0.00 C ATOM 799 NE ARG A 963 -7.474 -0.479 9.721 1.00 0.00 N ATOM 800 CZ ARG A 963 -8.182 -0.523 10.848 1.00 0.00 C ATOM 801 NH1 ARG A 963 -8.852 0.546 11.264 1.00 0.00 N ATOM 802 NH2 ARG A 963 -8.226 -1.647 11.554 1.00 0.00 N ATOM 0 H ARG A 963 -4.964 1.151 5.454 1.00 0.00 H new ATOM 0 HA ARG A 963 -3.772 -1.150 6.642 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -5.206 -0.785 8.502 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -4.670 0.783 7.934 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -6.776 1.236 6.880 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -7.300 -0.428 7.042 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -6.787 1.466 9.360 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -8.365 1.109 8.687 1.00 0.00 H new ATOM 0 HE ARG A 963 -6.970 -1.321 9.442 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -8.826 1.408 10.719 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -9.392 0.505 12.128 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -7.719 -2.471 11.232 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -8.767 -1.686 12.418 1.00 0.00 H new ATOM 816 N THR A 964 -6.740 -1.438 5.173 1.00 0.00 N ATOM 817 CA THR A 964 -7.675 -2.424 4.674 1.00 0.00 C ATOM 818 C THR A 964 -6.938 -3.351 3.726 1.00 0.00 C ATOM 819 O THR A 964 -7.227 -4.543 3.647 1.00 0.00 O ATOM 820 CB THR A 964 -8.899 -1.781 3.982 1.00 0.00 C ATOM 821 OG1 THR A 964 -9.468 -0.787 4.841 1.00 0.00 O ATOM 822 CG2 THR A 964 -9.963 -2.829 3.710 1.00 0.00 C ATOM 0 H THR A 964 -6.931 -0.478 4.885 1.00 0.00 H new ATOM 0 HA THR A 964 -8.070 -2.988 5.519 1.00 0.00 H new ATOM 0 HB THR A 964 -8.568 -1.336 3.044 1.00 0.00 H new ATOM 0 HG1 THR A 964 -9.022 0.072 4.687 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.818 -2.361 3.223 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.554 -3.603 3.061 1.00 0.00 H new ATOM 0 HG23 THR A 964 -10.282 -3.277 4.651 1.00 0.00 H new ATOM 830 N LEU A 965 -5.938 -2.790 3.055 1.00 0.00 N ATOM 831 CA LEU A 965 -5.027 -3.580 2.243 1.00 0.00 C ATOM 832 C LEU A 965 -4.269 -4.562 3.116 1.00 0.00 C ATOM 833 O LEU A 965 -4.215 -5.762 2.838 1.00 0.00 O ATOM 834 CB LEU A 965 -4.005 -2.694 1.538 1.00 0.00 C ATOM 835 CG LEU A 965 -2.807 -3.460 0.965 1.00 0.00 C ATOM 836 CD1 LEU A 965 -3.218 -4.272 -0.249 1.00 0.00 C ATOM 837 CD2 LEU A 965 -1.678 -2.508 0.621 1.00 0.00 C ATOM 0 H LEU A 965 -5.740 -1.789 3.059 1.00 0.00 H new ATOM 0 HA LEU A 965 -5.627 -4.107 1.501 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -4.501 -2.157 0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -3.642 -1.945 2.242 1.00 0.00 H new ATOM 0 HG LEU A 965 -2.448 -4.151 1.727 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -2.352 -4.807 -0.639 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -3.989 -4.988 0.036 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -3.609 -3.605 -1.018 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.838 -3.072 0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -2.023 -1.787 -0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.361 -1.980 1.520 1.00 0.00 H new ATOM 849 N LEU A 966 -3.698 -4.034 4.192 1.00 0.00 N ATOM 850 CA LEU A 966 -2.848 -4.817 5.060 1.00 0.00 C ATOM 851 C LEU A 966 -3.686 -5.911 5.695 1.00 0.00 C ATOM 852 O LEU A 966 -3.228 -7.026 5.887 1.00 0.00 O ATOM 853 CB LEU A 966 -2.210 -3.903 6.124 1.00 0.00 C ATOM 854 CG LEU A 966 -1.248 -4.569 7.119 1.00 0.00 C ATOM 855 CD1 LEU A 966 -0.246 -3.551 7.642 1.00 0.00 C ATOM 856 CD2 LEU A 966 -2.009 -5.182 8.288 1.00 0.00 C ATOM 0 H LEU A 966 -3.813 -3.062 4.479 1.00 0.00 H new ATOM 0 HA LEU A 966 -2.039 -5.278 4.494 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -1.671 -3.108 5.610 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -3.012 -3.430 6.691 1.00 0.00 H new ATOM 0 HG LEU A 966 -0.718 -5.364 6.594 1.00 0.00 H new ATOM 0 HD11 LEU A 966 0.430 -4.035 8.346 1.00 0.00 H new ATOM 0 HD12 LEU A 966 0.328 -3.144 6.809 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -0.777 -2.743 8.146 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -1.304 -5.647 8.977 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -2.565 -4.403 8.809 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -2.703 -5.936 7.915 1.00 0.00 H new ATOM 868 N ALA A 967 -4.935 -5.563 5.998 1.00 0.00 N ATOM 869 CA ALA A 967 -5.890 -6.489 6.582 1.00 0.00 C ATOM 870 C ALA A 967 -6.359 -7.532 5.576 1.00 0.00 C ATOM 871 O ALA A 967 -6.511 -8.685 5.939 1.00 0.00 O ATOM 872 CB ALA A 967 -7.073 -5.742 7.176 1.00 0.00 C ATOM 0 H ALA A 967 -5.310 -4.627 5.843 1.00 0.00 H new ATOM 0 HA ALA A 967 -5.378 -7.020 7.385 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -7.775 -6.456 7.607 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -6.722 -5.064 7.953 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -7.572 -5.170 6.394 1.00 0.00 H new ATOM 878 N THR A 968 -6.582 -7.159 4.318 1.00 0.00 N ATOM 879 CA THR A 968 -6.906 -8.162 3.305 1.00 0.00 C ATOM 880 C THR A 968 -5.752 -9.153 3.155 1.00 0.00 C ATOM 881 O THR A 968 -5.967 -10.345 2.963 1.00 0.00 O ATOM 882 CB THR A 968 -7.265 -7.539 1.941 1.00 0.00 C ATOM 883 OG1 THR A 968 -6.438 -6.405 1.655 1.00 0.00 O ATOM 884 CG2 THR A 968 -8.721 -7.129 1.916 1.00 0.00 C ATOM 0 H THR A 968 -6.546 -6.197 3.981 1.00 0.00 H new ATOM 0 HA THR A 968 -7.795 -8.690 3.651 1.00 0.00 H new ATOM 0 HB THR A 968 -7.090 -8.294 1.175 1.00 0.00 H new ATOM 0 HG1 THR A 968 -5.535 -6.562 2.003 1.00 0.00 H new ATOM 0 HG21 THR A 968 -8.959 -6.691 0.947 1.00 0.00 H new ATOM 0 HG22 THR A 968 -9.348 -8.005 2.082 1.00 0.00 H new ATOM 0 HG23 THR A 968 -8.906 -6.396 2.701 1.00 0.00 H new ATOM 892 N VAL A 969 -4.530 -8.649 3.285 1.00 0.00 N ATOM 893 CA VAL A 969 -3.331 -9.491 3.292 1.00 0.00 C ATOM 894 C VAL A 969 -3.190 -10.249 4.626 1.00 0.00 C ATOM 895 O VAL A 969 -2.816 -11.424 4.648 1.00 0.00 O ATOM 896 CB VAL A 969 -2.055 -8.662 3.024 1.00 0.00 C ATOM 897 CG1 VAL A 969 -0.829 -9.558 2.973 1.00 0.00 C ATOM 898 CG2 VAL A 969 -2.191 -7.878 1.731 1.00 0.00 C ATOM 0 H VAL A 969 -4.339 -7.652 3.388 1.00 0.00 H new ATOM 0 HA VAL A 969 -3.447 -10.216 2.487 1.00 0.00 H new ATOM 0 HB VAL A 969 -1.930 -7.957 3.846 1.00 0.00 H new ATOM 0 HG11 VAL A 969 0.057 -8.952 2.783 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -0.717 -10.076 3.925 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -0.946 -10.290 2.174 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -1.283 -7.300 1.559 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -2.345 -8.568 0.901 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -3.043 -7.202 1.803 1.00 0.00 H new ATOM 908 N ASP A 970 -3.560 -9.603 5.718 1.00 0.00 N ATOM 909 CA ASP A 970 -3.446 -10.206 7.049 1.00 0.00 C ATOM 910 C ASP A 970 -4.469 -11.324 7.181 1.00 0.00 C ATOM 911 O ASP A 970 -4.188 -12.413 7.695 1.00 0.00 O ATOM 912 CB ASP A 970 -3.680 -9.147 8.133 1.00 0.00 C ATOM 913 CG ASP A 970 -3.652 -9.717 9.535 1.00 0.00 C ATOM 914 OD1 ASP A 970 -2.554 -9.816 10.124 1.00 0.00 O ATOM 915 OD2 ASP A 970 -4.729 -10.056 10.059 1.00 0.00 O ATOM 0 H ASP A 970 -3.944 -8.658 5.716 1.00 0.00 H new ATOM 0 HA ASP A 970 -2.443 -10.614 7.176 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -2.918 -8.373 8.047 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -4.643 -8.667 7.962 1.00 0.00 H new ATOM 920 N GLU A 971 -5.652 -11.036 6.682 1.00 0.00 N ATOM 921 CA GLU A 971 -6.741 -11.985 6.649 1.00 0.00 C ATOM 922 C GLU A 971 -6.408 -13.125 5.690 1.00 0.00 C ATOM 923 O GLU A 971 -6.822 -14.267 5.893 1.00 0.00 O ATOM 924 CB GLU A 971 -7.996 -11.250 6.203 1.00 0.00 C ATOM 925 CG GLU A 971 -9.290 -11.945 6.571 1.00 0.00 C ATOM 926 CD GLU A 971 -9.500 -12.023 8.069 1.00 0.00 C ATOM 927 OE1 GLU A 971 -9.777 -10.975 8.690 1.00 0.00 O ATOM 928 OE2 GLU A 971 -9.389 -13.132 8.635 1.00 0.00 O ATOM 0 H GLU A 971 -5.886 -10.126 6.284 1.00 0.00 H new ATOM 0 HA GLU A 971 -6.902 -12.417 7.637 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -7.995 -10.253 6.644 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -7.962 -11.120 5.121 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -10.126 -11.413 6.117 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -9.289 -12.952 6.154 1.00 0.00 H new ATOM 935 N SER A 972 -5.640 -12.801 4.653 1.00 0.00 N ATOM 936 CA SER A 972 -5.139 -13.795 3.711 1.00 0.00 C ATOM 937 C SER A 972 -4.117 -14.709 4.376 1.00 0.00 C ATOM 938 O SER A 972 -3.841 -15.801 3.880 1.00 0.00 O ATOM 939 CB SER A 972 -4.519 -13.124 2.483 1.00 0.00 C ATOM 940 OG SER A 972 -5.516 -12.526 1.671 1.00 0.00 O ATOM 0 H SER A 972 -5.349 -11.846 4.443 1.00 0.00 H new ATOM 0 HA SER A 972 -5.987 -14.398 3.387 1.00 0.00 H new ATOM 0 HB2 SER A 972 -3.802 -12.367 2.801 1.00 0.00 H new ATOM 0 HB3 SER A 972 -3.966 -13.862 1.902 1.00 0.00 H new ATOM 0 HG SER A 972 -5.750 -11.647 2.035 1.00 0.00 H new ATOM 946 N LEU A 973 -3.570 -14.272 5.511 1.00 0.00 N ATOM 947 CA LEU A 973 -2.549 -15.042 6.208 1.00 0.00 C ATOM 948 C LEU A 973 -3.148 -16.341 6.751 1.00 0.00 C ATOM 949 O LEU A 973 -2.601 -17.413 6.506 1.00 0.00 O ATOM 950 CB LEU A 973 -1.906 -14.194 7.323 1.00 0.00 C ATOM 951 CG LEU A 973 -0.765 -14.845 8.112 1.00 0.00 C ATOM 952 CD1 LEU A 973 0.166 -13.776 8.657 1.00 0.00 C ATOM 953 CD2 LEU A 973 -1.301 -15.690 9.259 1.00 0.00 C ATOM 0 H LEU A 973 -3.818 -13.392 5.963 1.00 0.00 H new ATOM 0 HA LEU A 973 -1.759 -15.311 5.507 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -1.529 -13.274 6.876 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -2.688 -13.909 8.027 1.00 0.00 H new ATOM 0 HG LEU A 973 -0.215 -15.497 7.433 1.00 0.00 H new ATOM 0 HD11 LEU A 973 0.974 -14.248 9.216 1.00 0.00 H new ATOM 0 HD12 LEU A 973 0.584 -13.202 7.830 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -0.391 -13.110 9.316 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -0.468 -16.139 9.800 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -1.877 -15.060 9.937 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -1.942 -16.477 8.862 1.00 0.00 H new ATOM 965 N PRO A 974 -4.275 -16.293 7.500 1.00 0.00 N ATOM 966 CA PRO A 974 -4.976 -17.513 7.901 1.00 0.00 C ATOM 967 C PRO A 974 -5.854 -18.092 6.788 1.00 0.00 C ATOM 968 O PRO A 974 -6.427 -19.169 6.952 1.00 0.00 O ATOM 969 CB PRO A 974 -5.831 -17.088 9.103 1.00 0.00 C ATOM 970 CG PRO A 974 -5.482 -15.659 9.368 1.00 0.00 C ATOM 971 CD PRO A 974 -4.916 -15.118 8.088 1.00 0.00 C ATOM 0 HA PRO A 974 -4.269 -18.308 8.138 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -6.893 -17.197 8.885 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -5.619 -17.710 9.973 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -6.363 -15.094 9.673 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -4.757 -15.580 10.178 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -5.694 -14.714 7.440 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.202 -14.314 8.268 1.00 0.00 H new ATOM 979 N VAL A 975 -5.959 -17.398 5.659 1.00 0.00 N ATOM 980 CA VAL A 975 -6.628 -17.973 4.491 1.00 0.00 C ATOM 981 C VAL A 975 -5.718 -18.996 3.815 1.00 0.00 C ATOM 982 O VAL A 975 -6.096 -20.153 3.631 1.00 0.00 O ATOM 983 CB VAL A 975 -7.057 -16.900 3.458 1.00 0.00 C ATOM 984 CG1 VAL A 975 -7.440 -17.539 2.128 1.00 0.00 C ATOM 985 CG2 VAL A 975 -8.224 -16.085 3.991 1.00 0.00 C ATOM 0 H VAL A 975 -5.598 -16.454 5.526 1.00 0.00 H new ATOM 0 HA VAL A 975 -7.534 -18.458 4.854 1.00 0.00 H new ATOM 0 HB VAL A 975 -6.205 -16.240 3.292 1.00 0.00 H new ATOM 0 HG11 VAL A 975 -7.736 -16.762 1.423 1.00 0.00 H new ATOM 0 HG12 VAL A 975 -6.586 -18.086 1.728 1.00 0.00 H new ATOM 0 HG13 VAL A 975 -8.272 -18.227 2.281 1.00 0.00 H new ATOM 0 HG21 VAL A 975 -8.512 -15.336 3.253 1.00 0.00 H new ATOM 0 HG22 VAL A 975 -9.069 -16.745 4.188 1.00 0.00 H new ATOM 0 HG23 VAL A 975 -7.929 -15.588 4.915 1.00 0.00 H new ATOM 995 N LEU A 976 -4.509 -18.568 3.474 1.00 0.00 N ATOM 996 CA LEU A 976 -3.557 -19.432 2.797 1.00 0.00 C ATOM 997 C LEU A 976 -2.619 -20.088 3.808 1.00 0.00 C ATOM 998 O LEU A 976 -1.929 -19.403 4.565 1.00 0.00 O ATOM 999 CB LEU A 976 -2.775 -18.634 1.751 1.00 0.00 C ATOM 1000 CG LEU A 976 -3.634 -18.035 0.631 1.00 0.00 C ATOM 1001 CD1 LEU A 976 -2.786 -17.208 -0.320 1.00 0.00 C ATOM 1002 CD2 LEU A 976 -4.357 -19.136 -0.130 1.00 0.00 C ATOM 0 H LEU A 976 -4.166 -17.625 3.657 1.00 0.00 H new ATOM 0 HA LEU A 976 -4.100 -20.225 2.283 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.242 -17.827 2.253 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.022 -19.284 1.305 1.00 0.00 H new ATOM 0 HG LEU A 976 -4.375 -17.378 1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 976 -3.419 -16.794 -1.105 1.00 0.00 H new ATOM 0 HD12 LEU A 976 -2.311 -16.395 0.229 1.00 0.00 H new ATOM 0 HD13 LEU A 976 -2.019 -17.840 -0.767 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -4.962 -18.694 -0.921 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -3.626 -19.815 -0.569 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -5.001 -19.688 0.554 1.00 0.00 H new ATOM 1014 N PRO A 977 -2.589 -21.428 3.821 1.00 0.00 N ATOM 1015 CA PRO A 977 -1.911 -22.214 4.860 1.00 0.00 C ATOM 1016 C PRO A 977 -0.389 -22.058 4.884 1.00 0.00 C ATOM 1017 O PRO A 977 0.311 -22.463 3.951 1.00 0.00 O ATOM 1018 CB PRO A 977 -2.278 -23.666 4.521 1.00 0.00 C ATOM 1019 CG PRO A 977 -3.419 -23.574 3.567 1.00 0.00 C ATOM 1020 CD PRO A 977 -3.217 -22.293 2.815 1.00 0.00 C ATOM 0 HA PRO A 977 -2.229 -21.880 5.848 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -1.434 -24.190 4.074 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -2.559 -24.220 5.417 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -3.433 -24.428 2.889 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -4.372 -23.571 4.096 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.578 -22.431 1.943 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -4.160 -21.880 2.457 1.00 0.00 H new ATOM 1028 N ALA A 978 0.093 -21.443 5.961 1.00 0.00 N ATOM 1029 CA ALA A 978 1.508 -21.454 6.341 1.00 0.00 C ATOM 1030 C ALA A 978 2.420 -20.694 5.377 1.00 0.00 C ATOM 1031 O ALA A 978 2.761 -19.542 5.608 1.00 0.00 O ATOM 1032 CB ALA A 978 2.001 -22.886 6.518 1.00 0.00 C ATOM 0 H ALA A 978 -0.495 -20.914 6.605 1.00 0.00 H new ATOM 0 HA ALA A 978 1.565 -20.921 7.290 1.00 0.00 H new ATOM 0 HB1 ALA A 978 3.054 -22.876 6.800 1.00 0.00 H new ATOM 0 HB2 ALA A 978 1.421 -23.377 7.299 1.00 0.00 H new ATOM 0 HB3 ALA A 978 1.882 -23.430 5.581 1.00 0.00 H new ATOM 1038 N SER A 979 2.803 -21.338 4.298 1.00 0.00 N ATOM 1039 CA SER A 979 3.888 -20.853 3.457 1.00 0.00 C ATOM 1040 C SER A 979 3.639 -19.457 2.872 1.00 0.00 C ATOM 1041 O SER A 979 4.573 -18.664 2.771 1.00 0.00 O ATOM 1042 CB SER A 979 4.141 -21.857 2.353 1.00 0.00 C ATOM 1043 OG SER A 979 4.362 -23.146 2.892 1.00 0.00 O ATOM 0 H SER A 979 2.378 -22.207 3.975 1.00 0.00 H new ATOM 0 HA SER A 979 4.769 -20.750 4.091 1.00 0.00 H new ATOM 0 HB2 SER A 979 3.288 -21.882 1.675 1.00 0.00 H new ATOM 0 HB3 SER A 979 5.006 -21.549 1.766 1.00 0.00 H new ATOM 0 HG SER A 979 4.522 -23.782 2.164 1.00 0.00 H new ATOM 1049 N THR A 980 2.405 -19.141 2.499 1.00 0.00 N ATOM 1050 CA THR A 980 2.116 -17.816 1.953 1.00 0.00 C ATOM 1051 C THR A 980 2.238 -16.733 3.034 1.00 0.00 C ATOM 1052 O THR A 980 2.534 -15.575 2.733 1.00 0.00 O ATOM 1053 CB THR A 980 0.717 -17.756 1.287 1.00 0.00 C ATOM 1054 OG1 THR A 980 0.676 -18.625 0.154 1.00 0.00 O ATOM 1055 CG2 THR A 980 0.368 -16.343 0.845 1.00 0.00 C ATOM 0 H THR A 980 1.602 -19.767 2.561 1.00 0.00 H new ATOM 0 HA THR A 980 2.861 -17.623 1.181 1.00 0.00 H new ATOM 0 HB THR A 980 -0.014 -18.076 2.030 1.00 0.00 H new ATOM 0 HG1 THR A 980 0.564 -19.551 0.456 1.00 0.00 H new ATOM 0 HG21 THR A 980 -0.619 -16.340 0.383 1.00 0.00 H new ATOM 0 HG22 THR A 980 0.365 -15.681 1.711 1.00 0.00 H new ATOM 0 HG23 THR A 980 1.107 -15.994 0.124 1.00 0.00 H new ATOM 1063 N HIS A 981 2.074 -17.112 4.301 1.00 0.00 N ATOM 1064 CA HIS A 981 2.059 -16.126 5.377 1.00 0.00 C ATOM 1065 C HIS A 981 3.426 -15.492 5.595 1.00 0.00 C ATOM 1066 O HIS A 981 3.510 -14.427 6.181 1.00 0.00 O ATOM 1067 CB HIS A 981 1.467 -16.677 6.698 1.00 0.00 C ATOM 1068 CG HIS A 981 2.343 -17.551 7.561 1.00 0.00 C ATOM 1069 ND1 HIS A 981 1.866 -18.691 8.175 1.00 0.00 N ATOM 1070 CD2 HIS A 981 3.634 -17.431 7.962 1.00 0.00 C ATOM 1071 CE1 HIS A 981 2.818 -19.229 8.909 1.00 0.00 C ATOM 1072 NE2 HIS A 981 3.901 -18.488 8.798 1.00 0.00 N ATOM 0 H HIS A 981 1.952 -18.079 4.603 1.00 0.00 H new ATOM 0 HA HIS A 981 1.384 -15.337 5.045 1.00 0.00 H new ATOM 0 HB2 HIS A 981 1.148 -15.826 7.301 1.00 0.00 H new ATOM 0 HB3 HIS A 981 0.571 -17.245 6.450 1.00 0.00 H new ATOM 0 HD1 HIS A 981 0.921 -19.061 8.076 1.00 0.00 H new ATOM 0 HD2 HIS A 981 4.323 -16.650 7.677 1.00 0.00 H new ATOM 0 HE1 HIS A 981 2.726 -20.127 9.502 1.00 0.00 H new ATOM 1081 N ARG A 982 4.496 -16.115 5.110 1.00 0.00 N ATOM 1082 CA ARG A 982 5.820 -15.508 5.254 1.00 0.00 C ATOM 1083 C ARG A 982 6.071 -14.484 4.152 1.00 0.00 C ATOM 1084 O ARG A 982 6.890 -13.578 4.324 1.00 0.00 O ATOM 1085 CB ARG A 982 6.942 -16.542 5.320 1.00 0.00 C ATOM 1086 CG ARG A 982 7.087 -17.365 4.041 1.00 0.00 C ATOM 1087 CD ARG A 982 8.376 -18.171 4.047 1.00 0.00 C ATOM 1088 NE ARG A 982 9.553 -17.310 4.161 1.00 0.00 N ATOM 1089 CZ ARG A 982 10.703 -17.684 4.718 1.00 0.00 C ATOM 1090 NH1 ARG A 982 10.850 -18.918 5.189 1.00 0.00 N ATOM 1091 NH2 ARG A 982 11.712 -16.823 4.793 1.00 0.00 N ATOM 0 H ARG A 982 4.479 -17.013 4.627 1.00 0.00 H new ATOM 0 HA ARG A 982 5.827 -14.990 6.213 1.00 0.00 H new ATOM 0 HB2 ARG A 982 7.884 -16.032 5.524 1.00 0.00 H new ATOM 0 HB3 ARG A 982 6.756 -17.215 6.157 1.00 0.00 H new ATOM 0 HG2 ARG A 982 6.235 -18.038 3.940 1.00 0.00 H new ATOM 0 HG3 ARG A 982 7.074 -16.702 3.176 1.00 0.00 H new ATOM 0 HD2 ARG A 982 8.360 -18.877 4.878 1.00 0.00 H new ATOM 0 HD3 ARG A 982 8.442 -18.758 3.131 1.00 0.00 H new ATOM 0 HE ARG A 982 9.489 -16.362 3.790 1.00 0.00 H new ATOM 0 HH11 ARG A 982 10.080 -19.584 5.125 1.00 0.00 H new ATOM 0 HH12 ARG A 982 11.733 -19.200 5.615 1.00 0.00 H new ATOM 0 HH21 ARG A 982 11.605 -15.878 4.424 1.00 0.00 H new ATOM 0 HH22 ARG A 982 12.594 -17.107 5.219 1.00 0.00 H new ATOM 1105 N GLU A 983 5.360 -14.585 3.051 1.00 0.00 N ATOM 1106 CA GLU A 983 5.304 -13.484 2.107 1.00 0.00 C ATOM 1107 C GLU A 983 4.387 -12.399 2.643 1.00 0.00 C ATOM 1108 O GLU A 983 4.633 -11.214 2.452 1.00 0.00 O ATOM 1109 CB GLU A 983 4.818 -13.949 0.745 1.00 0.00 C ATOM 1110 CG GLU A 983 5.936 -14.309 -0.210 1.00 0.00 C ATOM 1111 CD GLU A 983 6.620 -15.603 0.167 1.00 0.00 C ATOM 1112 OE1 GLU A 983 5.959 -16.660 0.103 1.00 0.00 O ATOM 1113 OE2 GLU A 983 7.814 -15.573 0.530 1.00 0.00 O ATOM 0 H GLU A 983 4.817 -15.407 2.786 1.00 0.00 H new ATOM 0 HA GLU A 983 6.311 -13.086 1.985 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.171 -14.816 0.877 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.210 -13.163 0.298 1.00 0.00 H new ATOM 0 HG2 GLU A 983 5.535 -14.394 -1.220 1.00 0.00 H new ATOM 0 HG3 GLU A 983 6.671 -13.504 -0.226 1.00 0.00 H new ATOM 1120 N ILE A 984 3.354 -12.819 3.357 1.00 0.00 N ATOM 1121 CA ILE A 984 2.403 -11.902 3.970 1.00 0.00 C ATOM 1122 C ILE A 984 3.084 -11.136 5.087 1.00 0.00 C ATOM 1123 O ILE A 984 2.781 -9.969 5.328 1.00 0.00 O ATOM 1124 CB ILE A 984 1.175 -12.673 4.503 1.00 0.00 C ATOM 1125 CG1 ILE A 984 0.367 -13.212 3.326 1.00 0.00 C ATOM 1126 CG2 ILE A 984 0.309 -11.799 5.397 1.00 0.00 C ATOM 1127 CD1 ILE A 984 -0.598 -14.311 3.684 1.00 0.00 C ATOM 0 H ILE A 984 3.151 -13.804 3.528 1.00 0.00 H new ATOM 0 HA ILE A 984 2.054 -11.193 3.219 1.00 0.00 H new ATOM 0 HB ILE A 984 1.526 -13.505 5.113 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -0.189 -12.390 2.876 1.00 0.00 H new ATOM 0 HG13 ILE A 984 1.056 -13.583 2.568 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -0.545 -12.376 5.753 1.00 0.00 H new ATOM 0 HG22 ILE A 984 0.896 -11.456 6.249 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -0.045 -10.938 4.831 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -1.130 -14.634 2.789 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -0.050 -15.154 4.105 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -1.314 -13.941 4.418 1.00 0.00 H new ATOM 1139 N GLU A 985 4.053 -11.774 5.709 1.00 0.00 N ATOM 1140 CA GLU A 985 4.845 -11.134 6.738 1.00 0.00 C ATOM 1141 C GLU A 985 5.603 -9.959 6.161 1.00 0.00 C ATOM 1142 O GLU A 985 5.501 -8.832 6.644 1.00 0.00 O ATOM 1143 CB GLU A 985 5.848 -12.125 7.326 1.00 0.00 C ATOM 1144 CG GLU A 985 5.216 -13.142 8.250 1.00 0.00 C ATOM 1145 CD GLU A 985 4.571 -12.491 9.456 1.00 0.00 C ATOM 1146 OE1 GLU A 985 5.248 -11.684 10.132 1.00 0.00 O ATOM 1147 OE2 GLU A 985 3.390 -12.783 9.732 1.00 0.00 O ATOM 0 H GLU A 985 4.312 -12.742 5.518 1.00 0.00 H new ATOM 0 HA GLU A 985 4.170 -10.787 7.520 1.00 0.00 H new ATOM 0 HB2 GLU A 985 6.351 -12.647 6.512 1.00 0.00 H new ATOM 0 HB3 GLU A 985 6.614 -11.575 7.873 1.00 0.00 H new ATOM 0 HG2 GLU A 985 4.466 -13.713 7.702 1.00 0.00 H new ATOM 0 HG3 GLU A 985 5.975 -13.850 8.583 1.00 0.00 H new ATOM 1154 N MET A 986 6.335 -10.240 5.091 1.00 0.00 N ATOM 1155 CA MET A 986 7.242 -9.271 4.510 1.00 0.00 C ATOM 1156 C MET A 986 6.470 -8.135 3.847 1.00 0.00 C ATOM 1157 O MET A 986 6.818 -6.961 3.954 1.00 0.00 O ATOM 1158 CB MET A 986 8.131 -9.977 3.478 1.00 0.00 C ATOM 1159 CG MET A 986 8.973 -9.030 2.640 1.00 0.00 C ATOM 1160 SD MET A 986 9.896 -9.887 1.349 1.00 0.00 S ATOM 1161 CE MET A 986 10.658 -8.501 0.511 1.00 0.00 C ATOM 0 H MET A 986 6.315 -11.138 4.608 1.00 0.00 H new ATOM 0 HA MET A 986 7.859 -8.842 5.299 1.00 0.00 H new ATOM 0 HB2 MET A 986 8.791 -10.672 3.997 1.00 0.00 H new ATOM 0 HB3 MET A 986 7.501 -10.570 2.815 1.00 0.00 H new ATOM 0 HG2 MET A 986 8.326 -8.281 2.184 1.00 0.00 H new ATOM 0 HG3 MET A 986 9.669 -8.498 3.288 1.00 0.00 H new ATOM 0 HE1 MET A 986 11.537 -8.844 -0.035 1.00 0.00 H new ATOM 0 HE2 MET A 986 9.946 -8.062 -0.187 1.00 0.00 H new ATOM 0 HE3 MET A 986 10.956 -7.752 1.244 1.00 0.00 H new ATOM 1171 N ALA A 987 5.392 -8.527 3.188 1.00 0.00 N ATOM 1172 CA ALA A 987 4.662 -7.663 2.275 1.00 0.00 C ATOM 1173 C ALA A 987 3.795 -6.645 3.000 1.00 0.00 C ATOM 1174 O ALA A 987 3.897 -5.446 2.742 1.00 0.00 O ATOM 1175 CB ALA A 987 3.811 -8.516 1.354 1.00 0.00 C ATOM 0 H ALA A 987 4.995 -9.463 3.273 1.00 0.00 H new ATOM 0 HA ALA A 987 5.392 -7.097 1.697 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.261 -7.873 0.667 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.453 -9.189 0.786 1.00 0.00 H new ATOM 0 HB3 ALA A 987 3.107 -9.100 1.946 1.00 0.00 H new ATOM 1181 N GLN A 988 2.940 -7.115 3.908 1.00 0.00 N ATOM 1182 CA GLN A 988 2.100 -6.196 4.667 1.00 0.00 C ATOM 1183 C GLN A 988 2.974 -5.318 5.552 1.00 0.00 C ATOM 1184 O GLN A 988 2.576 -4.232 5.958 1.00 0.00 O ATOM 1185 CB GLN A 988 1.024 -6.937 5.476 1.00 0.00 C ATOM 1186 CG GLN A 988 1.528 -7.662 6.716 1.00 0.00 C ATOM 1187 CD GLN A 988 0.454 -8.535 7.346 1.00 0.00 C ATOM 1188 OE1 GLN A 988 -0.804 -8.150 7.173 1.00 0.00 O flip ATOM 1189 NE2 GLN A 988 0.750 -9.543 7.987 1.00 0.00 N flip ATOM 0 H GLN A 988 2.813 -8.102 4.131 1.00 0.00 H new ATOM 0 HA GLN A 988 1.563 -5.557 3.966 1.00 0.00 H new ATOM 0 HB2 GLN A 988 0.262 -6.219 5.779 1.00 0.00 H new ATOM 0 HB3 GLN A 988 0.537 -7.662 4.824 1.00 0.00 H new ATOM 0 HG2 GLN A 988 2.386 -8.279 6.450 1.00 0.00 H new ATOM 0 HG3 GLN A 988 1.875 -6.931 7.447 1.00 0.00 H new ATOM 0 HE21 GLN A 988 1.729 -9.807 8.099 1.00 0.00 H new ATOM 0 HE22 GLN A 988 0.016 -10.114 8.407 1.00 0.00 H new ATOM 1198 N LYS A 989 4.176 -5.810 5.822 1.00 0.00 N ATOM 1199 CA LYS A 989 5.195 -5.059 6.539 1.00 0.00 C ATOM 1200 C LYS A 989 5.812 -3.950 5.676 1.00 0.00 C ATOM 1201 O LYS A 989 6.066 -2.851 6.164 1.00 0.00 O ATOM 1202 CB LYS A 989 6.268 -6.028 6.992 1.00 0.00 C ATOM 1203 CG LYS A 989 7.530 -5.377 7.495 1.00 0.00 C ATOM 1204 CD LYS A 989 8.546 -6.425 7.900 1.00 0.00 C ATOM 1205 CE LYS A 989 9.628 -5.850 8.797 1.00 0.00 C ATOM 1206 NZ LYS A 989 9.060 -5.304 10.057 1.00 0.00 N ATOM 0 H LYS A 989 4.472 -6.747 5.548 1.00 0.00 H new ATOM 0 HA LYS A 989 4.731 -4.569 7.395 1.00 0.00 H new ATOM 0 HB2 LYS A 989 5.860 -6.658 7.783 1.00 0.00 H new ATOM 0 HB3 LYS A 989 6.521 -6.685 6.160 1.00 0.00 H new ATOM 0 HG2 LYS A 989 7.950 -4.737 6.719 1.00 0.00 H new ATOM 0 HG3 LYS A 989 7.301 -4.737 8.347 1.00 0.00 H new ATOM 0 HD2 LYS A 989 8.040 -7.240 8.418 1.00 0.00 H new ATOM 0 HD3 LYS A 989 9.004 -6.851 7.007 1.00 0.00 H new ATOM 0 HE2 LYS A 989 10.357 -6.625 9.032 1.00 0.00 H new ATOM 0 HE3 LYS A 989 10.161 -5.062 8.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 9.784 -5.329 10.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 8.755 -4.322 9.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 8.243 -5.879 10.347 1.00 0.00 H new ATOM 1220 N LEU A 990 6.112 -4.258 4.414 1.00 0.00 N ATOM 1221 CA LEU A 990 6.588 -3.233 3.485 1.00 0.00 C ATOM 1222 C LEU A 990 5.652 -2.044 3.454 1.00 0.00 C ATOM 1223 O LEU A 990 6.075 -0.915 3.682 1.00 0.00 O ATOM 1224 CB LEU A 990 6.769 -3.813 2.093 1.00 0.00 C ATOM 1225 CG LEU A 990 8.005 -4.676 1.982 1.00 0.00 C ATOM 1226 CD1 LEU A 990 7.856 -5.706 0.873 1.00 0.00 C ATOM 1227 CD2 LEU A 990 9.237 -3.814 1.743 1.00 0.00 C ATOM 0 H LEU A 990 6.036 -5.194 4.016 1.00 0.00 H new ATOM 0 HA LEU A 990 7.558 -2.884 3.840 1.00 0.00 H new ATOM 0 HB2 LEU A 990 5.892 -4.405 1.833 1.00 0.00 H new ATOM 0 HB3 LEU A 990 6.831 -3.000 1.369 1.00 0.00 H new ATOM 0 HG LEU A 990 8.128 -5.209 2.925 1.00 0.00 H new ATOM 0 HD11 LEU A 990 8.760 -6.313 0.816 1.00 0.00 H new ATOM 0 HD12 LEU A 990 7.001 -6.348 1.085 1.00 0.00 H new ATOM 0 HD13 LEU A 990 7.700 -5.197 -0.078 1.00 0.00 H new ATOM 0 HD21 LEU A 990 10.118 -4.452 1.666 1.00 0.00 H new ATOM 0 HD22 LEU A 990 9.114 -3.252 0.817 1.00 0.00 H new ATOM 0 HD23 LEU A 990 9.363 -3.121 2.575 1.00 0.00 H new ATOM 1239 N LEU A 991 4.382 -2.308 3.208 1.00 0.00 N ATOM 1240 CA LEU A 991 3.373 -1.265 3.238 1.00 0.00 C ATOM 1241 C LEU A 991 3.338 -0.630 4.625 1.00 0.00 C ATOM 1242 O LEU A 991 3.217 0.583 4.764 1.00 0.00 O ATOM 1243 CB LEU A 991 2.012 -1.866 2.904 1.00 0.00 C ATOM 1244 CG LEU A 991 1.035 -0.938 2.173 1.00 0.00 C ATOM 1245 CD1 LEU A 991 0.602 0.210 3.064 1.00 0.00 C ATOM 1246 CD2 LEU A 991 1.662 -0.409 0.894 1.00 0.00 C ATOM 0 H LEU A 991 4.024 -3.237 2.985 1.00 0.00 H new ATOM 0 HA LEU A 991 3.615 -0.499 2.502 1.00 0.00 H new ATOM 0 HB2 LEU A 991 2.168 -2.754 2.291 1.00 0.00 H new ATOM 0 HB3 LEU A 991 1.544 -2.197 3.831 1.00 0.00 H new ATOM 0 HG LEU A 991 0.149 -1.518 1.915 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -0.091 0.852 2.520 1.00 0.00 H new ATOM 0 HD12 LEU A 991 0.109 -0.185 3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 991 1.476 0.789 3.362 1.00 0.00 H new ATOM 0 HD21 LEU A 991 0.955 0.248 0.387 1.00 0.00 H new ATOM 0 HD22 LEU A 991 2.567 0.149 1.136 1.00 0.00 H new ATOM 0 HD23 LEU A 991 1.914 -1.244 0.240 1.00 0.00 H new ATOM 1258 N ASN A 992 3.478 -1.480 5.635 1.00 0.00 N ATOM 1259 CA ASN A 992 3.464 -1.067 7.035 1.00 0.00 C ATOM 1260 C ASN A 992 4.472 0.058 7.301 1.00 0.00 C ATOM 1261 O ASN A 992 4.101 1.144 7.748 1.00 0.00 O ATOM 1262 CB ASN A 992 3.780 -2.295 7.905 1.00 0.00 C ATOM 1263 CG ASN A 992 3.731 -2.040 9.405 1.00 0.00 C ATOM 1264 OD1 ASN A 992 4.076 -0.967 9.893 1.00 0.00 O ATOM 1265 ND2 ASN A 992 3.288 -3.042 10.154 1.00 0.00 N ATOM 0 H ASN A 992 3.606 -2.484 5.506 1.00 0.00 H new ATOM 0 HA ASN A 992 2.478 -0.674 7.284 1.00 0.00 H new ATOM 0 HB2 ASN A 992 3.073 -3.088 7.661 1.00 0.00 H new ATOM 0 HB3 ASN A 992 4.773 -2.662 7.645 1.00 0.00 H new ATOM 0 HD21 ASN A 992 3.226 -2.933 11.166 1.00 0.00 H new ATOM 0 HD22 ASN A 992 3.009 -3.921 9.717 1.00 0.00 H new ATOM 1272 N SER A 993 5.735 -0.190 6.996 1.00 0.00 N ATOM 1273 CA SER A 993 6.779 0.797 7.242 1.00 0.00 C ATOM 1274 C SER A 993 6.823 1.873 6.159 1.00 0.00 C ATOM 1275 O SER A 993 7.194 3.017 6.431 1.00 0.00 O ATOM 1276 CB SER A 993 8.135 0.105 7.380 1.00 0.00 C ATOM 1277 OG SER A 993 8.375 -0.760 6.281 1.00 0.00 O ATOM 0 H SER A 993 6.063 -1.061 6.580 1.00 0.00 H new ATOM 0 HA SER A 993 6.542 1.303 8.178 1.00 0.00 H new ATOM 0 HB2 SER A 993 8.926 0.853 7.439 1.00 0.00 H new ATOM 0 HB3 SER A 993 8.165 -0.464 8.309 1.00 0.00 H new ATOM 0 HG SER A 993 9.248 -1.191 6.389 1.00 0.00 H new ATOM 1283 N ASP A 994 6.470 1.519 4.936 1.00 0.00 N ATOM 1284 CA ASP A 994 6.462 2.503 3.859 1.00 0.00 C ATOM 1285 C ASP A 994 5.387 3.580 4.107 1.00 0.00 C ATOM 1286 O ASP A 994 5.624 4.767 3.897 1.00 0.00 O ATOM 1287 CB ASP A 994 6.295 1.823 2.499 1.00 0.00 C ATOM 1288 CG ASP A 994 7.443 2.153 1.567 1.00 0.00 C ATOM 1289 OD1 ASP A 994 8.455 1.413 1.579 1.00 0.00 O ATOM 1290 OD2 ASP A 994 7.358 3.163 0.844 1.00 0.00 O ATOM 0 H ASP A 994 6.190 0.577 4.663 1.00 0.00 H new ATOM 0 HA ASP A 994 7.427 3.010 3.847 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.235 0.743 2.636 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.355 2.139 2.046 1.00 0.00 H new ATOM 1295 N LEU A 995 4.208 3.147 4.558 1.00 0.00 N ATOM 1296 CA LEU A 995 3.163 4.039 5.085 1.00 0.00 C ATOM 1297 C LEU A 995 3.682 4.828 6.286 1.00 0.00 C ATOM 1298 O LEU A 995 3.309 5.993 6.450 1.00 0.00 O ATOM 1299 CB LEU A 995 1.886 3.239 5.428 1.00 0.00 C ATOM 1300 CG LEU A 995 0.739 3.984 6.144 1.00 0.00 C ATOM 1301 CD1 LEU A 995 0.992 4.104 7.641 1.00 0.00 C ATOM 1302 CD2 LEU A 995 0.508 5.355 5.531 1.00 0.00 C ATOM 0 H LEU A 995 3.946 2.161 4.570 1.00 0.00 H new ATOM 0 HA LEU A 995 2.897 4.761 4.313 1.00 0.00 H new ATOM 0 HB2 LEU A 995 1.490 2.827 4.500 1.00 0.00 H new ATOM 0 HB3 LEU A 995 2.178 2.395 6.052 1.00 0.00 H new ATOM 0 HG LEU A 995 -0.164 3.389 6.006 1.00 0.00 H new ATOM 0 HD11 LEU A 995 0.162 4.634 8.109 1.00 0.00 H new ATOM 0 HD12 LEU A 995 1.078 3.108 8.076 1.00 0.00 H new ATOM 0 HD13 LEU A 995 1.917 4.655 7.811 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -0.305 5.856 6.056 1.00 0.00 H new ATOM 0 HD22 LEU A 995 1.417 5.950 5.618 1.00 0.00 H new ATOM 0 HD23 LEU A 995 0.247 5.244 4.479 1.00 0.00 H new ATOM 1314 N ALA A 996 4.562 4.277 7.094 1.00 0.00 N ATOM 1315 CA ALA A 996 5.140 5.089 8.167 1.00 0.00 C ATOM 1316 C ALA A 996 6.037 6.187 7.579 1.00 0.00 C ATOM 1317 O ALA A 996 6.145 7.282 8.142 1.00 0.00 O ATOM 1318 CB ALA A 996 5.888 4.239 9.183 1.00 0.00 C ATOM 0 H ALA A 996 4.889 3.312 7.043 1.00 0.00 H new ATOM 0 HA ALA A 996 4.321 5.567 8.705 1.00 0.00 H new ATOM 0 HB1 ALA A 996 6.301 4.881 9.961 1.00 0.00 H new ATOM 0 HB2 ALA A 996 5.202 3.520 9.631 1.00 0.00 H new ATOM 0 HB3 ALA A 996 6.698 3.706 8.685 1.00 0.00 H new ATOM 1324 N GLU A 997 6.614 5.927 6.414 1.00 0.00 N ATOM 1325 CA GLU A 997 7.409 6.932 5.715 1.00 0.00 C ATOM 1326 C GLU A 997 6.501 7.971 5.071 1.00 0.00 C ATOM 1327 O GLU A 997 6.766 9.177 5.152 1.00 0.00 O ATOM 1328 CB GLU A 997 8.280 6.294 4.632 1.00 0.00 C ATOM 1329 CG GLU A 997 9.301 7.256 4.059 1.00 0.00 C ATOM 1330 CD GLU A 997 10.327 7.669 5.090 1.00 0.00 C ATOM 1331 OE1 GLU A 997 10.059 8.614 5.856 1.00 0.00 O ATOM 1332 OE2 GLU A 997 11.404 7.042 5.139 1.00 0.00 O ATOM 0 H GLU A 997 6.548 5.031 5.932 1.00 0.00 H new ATOM 0 HA GLU A 997 8.054 7.410 6.452 1.00 0.00 H new ATOM 0 HB2 GLU A 997 8.796 5.429 5.049 1.00 0.00 H new ATOM 0 HB3 GLU A 997 7.642 5.927 3.828 1.00 0.00 H new ATOM 0 HG2 GLU A 997 9.805 6.789 3.212 1.00 0.00 H new ATOM 0 HG3 GLU A 997 8.792 8.141 3.678 1.00 0.00 H new ATOM 1339 N LEU A 998 5.422 7.505 4.451 1.00 0.00 N ATOM 1340 CA LEU A 998 4.488 8.394 3.780 1.00 0.00 C ATOM 1341 C LEU A 998 3.969 9.455 4.731 1.00 0.00 C ATOM 1342 O LEU A 998 3.983 10.649 4.424 1.00 0.00 O ATOM 1343 CB LEU A 998 3.291 7.619 3.233 1.00 0.00 C ATOM 1344 CG LEU A 998 2.035 8.470 3.027 1.00 0.00 C ATOM 1345 CD1 LEU A 998 2.214 9.375 1.833 1.00 0.00 C ATOM 1346 CD2 LEU A 998 0.794 7.614 2.860 1.00 0.00 C ATOM 0 H LEU A 998 5.175 6.517 4.401 1.00 0.00 H new ATOM 0 HA LEU A 998 5.031 8.865 2.960 1.00 0.00 H new ATOM 0 HB2 LEU A 998 3.570 7.166 2.282 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.056 6.804 3.918 1.00 0.00 H new ATOM 0 HG LEU A 998 1.894 9.077 3.921 1.00 0.00 H new ATOM 0 HD11 LEU A 998 1.316 9.976 1.694 1.00 0.00 H new ATOM 0 HD12 LEU A 998 3.068 10.032 1.999 1.00 0.00 H new ATOM 0 HD13 LEU A 998 2.388 8.772 0.942 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.075 8.257 2.716 1.00 0.00 H new ATOM 0 HD22 LEU A 998 0.913 6.966 1.992 1.00 0.00 H new ATOM 0 HD23 LEU A 998 0.650 7.004 3.752 1.00 0.00 H new ATOM 1358 N ILE A 999 3.558 9.009 5.904 1.00 0.00 N ATOM 1359 CA ILE A 999 2.880 9.873 6.856 1.00 0.00 C ATOM 1360 C ILE A 999 3.819 10.942 7.420 1.00 0.00 C ATOM 1361 O ILE A 999 3.390 12.066 7.666 1.00 0.00 O ATOM 1362 CB ILE A 999 2.246 9.042 7.997 1.00 0.00 C ATOM 1363 CG1 ILE A 999 1.140 8.141 7.429 1.00 0.00 C ATOM 1364 CG2 ILE A 999 1.691 9.940 9.096 1.00 0.00 C ATOM 1365 CD1 ILE A 999 -0.010 8.903 6.804 1.00 0.00 C ATOM 0 H ILE A 999 3.682 8.048 6.222 1.00 0.00 H new ATOM 0 HA ILE A 999 2.083 10.388 6.320 1.00 0.00 H new ATOM 0 HB ILE A 999 3.023 8.421 8.442 1.00 0.00 H new ATOM 0 HG12 ILE A 999 1.573 7.478 6.680 1.00 0.00 H new ATOM 0 HG13 ILE A 999 0.753 7.509 8.228 1.00 0.00 H new ATOM 0 HG21 ILE A 999 1.253 9.325 9.882 1.00 0.00 H new ATOM 0 HG22 ILE A 999 2.497 10.544 9.514 1.00 0.00 H new ATOM 0 HG23 ILE A 999 0.926 10.595 8.679 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -0.751 8.198 6.426 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -0.471 9.546 7.554 1.00 0.00 H new ATOM 0 HD13 ILE A 999 0.363 9.514 5.982 1.00 0.00 H new ATOM 1377 N ASN A1000 5.100 10.616 7.596 1.00 0.00 N ATOM 1378 CA ASN A1000 6.059 11.601 8.115 1.00 0.00 C ATOM 1379 C ASN A1000 6.214 12.791 7.166 1.00 0.00 C ATOM 1380 O ASN A1000 6.315 13.943 7.597 1.00 0.00 O ATOM 1381 CB ASN A1000 7.437 10.974 8.359 1.00 0.00 C ATOM 1382 CG ASN A1000 7.529 10.239 9.680 1.00 0.00 C ATOM 1383 OD1 ASN A1000 6.536 9.421 9.978 1.00 0.00 O flip ATOM 1384 ND2 ASN A1000 8.509 10.379 10.411 1.00 0.00 N flip ATOM 0 H ASN A1000 5.495 9.698 7.393 1.00 0.00 H new ATOM 0 HA ASN A1000 5.654 11.952 9.064 1.00 0.00 H new ATOM 0 HB2 ASN A1000 7.663 10.282 7.548 1.00 0.00 H new ATOM 0 HB3 ASN A1000 8.196 11.756 8.331 1.00 0.00 H new ATOM 0 HD21 ASN A1000 9.256 11.021 10.145 1.00 0.00 H new ATOM 0 HD22 ASN A1000 8.575 9.853 11.282 1.00 0.00 H new ATOM 1391 N LYS A1001 6.209 12.506 5.874 1.00 0.00 N ATOM 1392 CA LYS A1001 6.431 13.529 4.853 1.00 0.00 C ATOM 1393 C LYS A1001 5.124 14.245 4.564 1.00 0.00 C ATOM 1394 O LYS A1001 5.079 15.458 4.366 1.00 0.00 O ATOM 1395 CB LYS A1001 7.000 12.909 3.569 1.00 0.00 C ATOM 1396 CG LYS A1001 8.521 12.766 3.561 1.00 0.00 C ATOM 1397 CD LYS A1001 9.031 11.903 4.706 1.00 0.00 C ATOM 1398 CE LYS A1001 10.543 11.749 4.649 1.00 0.00 C ATOM 1399 NZ LYS A1001 11.070 11.009 5.824 1.00 0.00 N ATOM 0 H LYS A1001 6.053 11.570 5.501 1.00 0.00 H new ATOM 0 HA LYS A1001 7.161 14.247 5.226 1.00 0.00 H new ATOM 0 HB2 LYS A1001 6.553 11.925 3.426 1.00 0.00 H new ATOM 0 HB3 LYS A1001 6.700 13.522 2.719 1.00 0.00 H new ATOM 0 HG2 LYS A1001 8.837 12.330 2.613 1.00 0.00 H new ATOM 0 HG3 LYS A1001 8.976 13.754 3.625 1.00 0.00 H new ATOM 0 HD2 LYS A1001 8.744 12.351 5.658 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.561 10.921 4.661 1.00 0.00 H new ATOM 0 HE2 LYS A1001 10.820 11.223 3.735 1.00 0.00 H new ATOM 0 HE3 LYS A1001 11.007 12.734 4.603 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 12.085 11.209 5.934 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 10.563 11.311 6.680 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 10.932 9.988 5.682 1.00 0.00 H new ATOM 1413 N MET A1002 4.062 13.469 4.595 1.00 0.00 N ATOM 1414 CA MET A1002 2.707 13.987 4.469 1.00 0.00 C ATOM 1415 C MET A1002 2.428 14.972 5.595 1.00 0.00 C ATOM 1416 O MET A1002 1.687 15.946 5.439 1.00 0.00 O ATOM 1417 CB MET A1002 1.703 12.835 4.555 1.00 0.00 C ATOM 1418 CG MET A1002 0.253 13.279 4.507 1.00 0.00 C ATOM 1419 SD MET A1002 -0.894 11.927 4.818 1.00 0.00 S ATOM 1420 CE MET A1002 -0.527 10.845 3.442 1.00 0.00 C ATOM 0 H MET A1002 4.109 12.456 4.709 1.00 0.00 H new ATOM 0 HA MET A1002 2.608 14.490 3.507 1.00 0.00 H new ATOM 0 HB2 MET A1002 1.888 12.142 3.734 1.00 0.00 H new ATOM 0 HB3 MET A1002 1.874 12.285 5.480 1.00 0.00 H new ATOM 0 HG2 MET A1002 0.092 14.064 5.246 1.00 0.00 H new ATOM 0 HG3 MET A1002 0.042 13.713 3.530 1.00 0.00 H new ATOM 0 HE1 MET A1002 -1.396 10.223 3.226 1.00 0.00 H new ATOM 0 HE2 MET A1002 -0.282 11.443 2.564 1.00 0.00 H new ATOM 0 HE3 MET A1002 0.321 10.209 3.696 1.00 0.00 H new ATOM 1430 N LYS A1003 3.071 14.718 6.724 1.00 0.00 N ATOM 1431 CA LYS A1003 2.777 15.424 7.948 1.00 0.00 C ATOM 1432 C LYS A1003 3.324 16.843 7.924 1.00 0.00 C ATOM 1433 O LYS A1003 2.590 17.799 8.149 1.00 0.00 O ATOM 1434 CB LYS A1003 3.356 14.678 9.145 1.00 0.00 C ATOM 1435 CG LYS A1003 2.369 14.513 10.285 1.00 0.00 C ATOM 1436 CD LYS A1003 1.197 13.632 9.883 1.00 0.00 C ATOM 1437 CE LYS A1003 0.389 13.170 11.093 1.00 0.00 C ATOM 1438 NZ LYS A1003 -0.014 14.299 11.974 1.00 0.00 N ATOM 0 H LYS A1003 3.808 14.018 6.811 1.00 0.00 H new ATOM 0 HA LYS A1003 1.692 15.476 8.039 1.00 0.00 H new ATOM 0 HB2 LYS A1003 3.694 13.694 8.822 1.00 0.00 H new ATOM 0 HB3 LYS A1003 4.233 15.213 9.508 1.00 0.00 H new ATOM 0 HG2 LYS A1003 2.875 14.077 11.146 1.00 0.00 H new ATOM 0 HG3 LYS A1003 2.001 15.491 10.594 1.00 0.00 H new ATOM 0 HD2 LYS A1003 0.548 14.181 9.201 1.00 0.00 H new ATOM 0 HD3 LYS A1003 1.567 12.762 9.340 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -0.502 12.644 10.751 1.00 0.00 H new ATOM 0 HE3 LYS A1003 0.979 12.457 11.669 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -0.709 13.964 12.671 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 0.822 14.668 12.469 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -0.437 15.055 11.398 1.00 0.00 H new ATOM 1452 N LEU A1004 4.613 16.982 7.643 1.00 0.00 N ATOM 1453 CA LEU A1004 5.236 18.301 7.607 1.00 0.00 C ATOM 1454 C LEU A1004 4.803 19.087 6.381 1.00 0.00 C ATOM 1455 O LEU A1004 4.975 20.301 6.332 1.00 0.00 O ATOM 1456 CB LEU A1004 6.760 18.196 7.673 1.00 0.00 C ATOM 1457 CG LEU A1004 7.311 17.738 9.030 1.00 0.00 C ATOM 1458 CD1 LEU A1004 8.810 17.516 8.965 1.00 0.00 C ATOM 1459 CD2 LEU A1004 6.984 18.757 10.109 1.00 0.00 C ATOM 0 H LEU A1004 5.243 16.207 7.438 1.00 0.00 H new ATOM 0 HA LEU A1004 4.896 18.844 8.489 1.00 0.00 H new ATOM 0 HB2 LEU A1004 7.097 17.499 6.905 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.189 19.168 7.431 1.00 0.00 H new ATOM 0 HG LEU A1004 6.834 16.790 9.280 1.00 0.00 H new ATOM 0 HD11 LEU A1004 9.172 17.192 9.941 1.00 0.00 H new ATOM 0 HD12 LEU A1004 9.032 16.750 8.223 1.00 0.00 H new ATOM 0 HD13 LEU A1004 9.304 18.447 8.685 1.00 0.00 H new ATOM 0 HD21 LEU A1004 7.382 18.416 11.064 1.00 0.00 H new ATOM 0 HD22 LEU A1004 7.432 19.717 9.851 1.00 0.00 H new ATOM 0 HD23 LEU A1004 5.903 18.871 10.186 1.00 0.00 H new ATOM 1471 N ALA A1005 4.192 18.418 5.416 1.00 0.00 N ATOM 1472 CA ALA A1005 3.716 19.121 4.240 1.00 0.00 C ATOM 1473 C ALA A1005 2.533 19.981 4.639 1.00 0.00 C ATOM 1474 O ALA A1005 2.430 21.121 4.229 1.00 0.00 O ATOM 1475 CB ALA A1005 3.359 18.175 3.105 1.00 0.00 C ATOM 0 H ALA A1005 4.018 17.413 5.423 1.00 0.00 H new ATOM 0 HA ALA A1005 4.519 19.752 3.858 1.00 0.00 H new ATOM 0 HB1 ALA A1005 3.008 18.751 2.248 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.240 17.600 2.820 1.00 0.00 H new ATOM 0 HB3 ALA A1005 2.572 17.495 3.432 1.00 0.00 H new ATOM 1481 N GLN A1006 1.653 19.435 5.452 1.00 0.00 N ATOM 1482 CA GLN A1006 0.567 20.219 6.022 1.00 0.00 C ATOM 1483 C GLN A1006 1.050 21.126 7.152 1.00 0.00 C ATOM 1484 O GLN A1006 0.508 22.226 7.312 1.00 0.00 O ATOM 1485 CB GLN A1006 -0.584 19.323 6.473 1.00 0.00 C ATOM 1486 CG GLN A1006 -0.272 18.375 7.618 1.00 0.00 C ATOM 1487 CD GLN A1006 -0.484 19.006 8.980 1.00 0.00 C ATOM 1488 OE1 GLN A1006 -1.344 19.869 9.155 1.00 0.00 O ATOM 1489 NE2 GLN A1006 0.309 18.586 9.947 1.00 0.00 N ATOM 0 H GLN A1006 1.664 18.455 5.735 1.00 0.00 H new ATOM 0 HA GLN A1006 0.189 20.870 5.234 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -1.420 19.958 6.769 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -0.918 18.734 5.619 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -0.901 17.489 7.532 1.00 0.00 H new ATOM 0 HG3 GLN A1006 0.762 18.041 7.535 1.00 0.00 H new ATOM 0 HE21 GLN A1006 1.009 17.868 9.757 1.00 0.00 H new ATOM 0 HE22 GLN A1006 0.223 18.979 10.884 1.00 0.00 H new ATOM 1498 N GLN A1007 2.072 20.706 7.903 1.00 0.00 N ATOM 1499 CA GLN A1007 2.649 21.568 8.940 1.00 0.00 C ATOM 1500 C GLN A1007 2.919 22.954 8.375 1.00 0.00 C ATOM 1501 O GLN A1007 2.489 23.965 8.930 1.00 0.00 O ATOM 1502 CB GLN A1007 3.944 20.983 9.502 1.00 0.00 C ATOM 1503 CG GLN A1007 3.731 19.770 10.396 1.00 0.00 C ATOM 1504 CD GLN A1007 2.823 20.046 11.583 1.00 0.00 C ATOM 1505 OE1 GLN A1007 2.119 19.154 12.053 1.00 0.00 O ATOM 1506 NE2 GLN A1007 2.839 21.268 12.092 1.00 0.00 N ATOM 0 H GLN A1007 2.512 19.790 7.816 1.00 0.00 H new ATOM 0 HA GLN A1007 1.926 21.636 9.753 1.00 0.00 H new ATOM 0 HB2 GLN A1007 4.595 20.703 8.674 1.00 0.00 H new ATOM 0 HB3 GLN A1007 4.464 21.755 10.070 1.00 0.00 H new ATOM 0 HG2 GLN A1007 3.305 18.961 9.803 1.00 0.00 H new ATOM 0 HG3 GLN A1007 4.698 19.423 10.761 1.00 0.00 H new ATOM 0 HE21 GLN A1007 3.435 21.985 11.678 1.00 0.00 H new ATOM 0 HE22 GLN A1007 2.256 21.492 12.898 1.00 0.00 H new ATOM 1515 N TYR A1008 3.613 22.995 7.250 1.00 0.00 N ATOM 1516 CA TYR A1008 3.800 24.246 6.550 1.00 0.00 C ATOM 1517 C TYR A1008 3.232 24.155 5.143 1.00 0.00 C ATOM 1518 O TYR A1008 3.870 24.561 4.168 1.00 0.00 O ATOM 1519 CB TYR A1008 5.270 24.668 6.551 1.00 0.00 C ATOM 1520 CG TYR A1008 5.723 25.187 7.898 1.00 0.00 C ATOM 1521 CD1 TYR A1008 5.541 26.520 8.242 1.00 0.00 C ATOM 1522 CD2 TYR A1008 6.314 24.344 8.830 1.00 0.00 C ATOM 1523 CE1 TYR A1008 5.934 26.996 9.477 1.00 0.00 C ATOM 1524 CE2 TYR A1008 6.711 24.815 10.065 1.00 0.00 C ATOM 1525 CZ TYR A1008 6.518 26.140 10.384 1.00 0.00 C ATOM 1526 OH TYR A1008 6.908 26.614 11.616 1.00 0.00 O ATOM 0 H TYR A1008 4.050 22.185 6.809 1.00 0.00 H new ATOM 0 HA TYR A1008 3.250 25.025 7.079 1.00 0.00 H new ATOM 0 HB2 TYR A1008 5.889 23.817 6.266 1.00 0.00 H new ATOM 0 HB3 TYR A1008 5.423 25.440 5.797 1.00 0.00 H new ATOM 0 HD1 TYR A1008 5.085 27.195 7.533 1.00 0.00 H new ATOM 0 HD2 TYR A1008 6.465 23.303 8.584 1.00 0.00 H new ATOM 0 HE1 TYR A1008 5.784 28.035 9.731 1.00 0.00 H new ATOM 0 HE2 TYR A1008 7.171 24.147 10.778 1.00 0.00 H new ATOM 0 HH TYR A1008 7.301 25.884 12.138 1.00 0.00 H new ATOM 1536 N VAL A1009 2.016 23.601 5.062 1.00 0.00 N ATOM 1537 CA VAL A1009 1.209 23.609 3.840 1.00 0.00 C ATOM 1538 C VAL A1009 1.088 25.022 3.302 1.00 0.00 C ATOM 1539 O VAL A1009 0.776 25.244 2.130 1.00 0.00 O ATOM 1540 CB VAL A1009 -0.204 23.049 4.111 1.00 0.00 C ATOM 1541 CG1 VAL A1009 -0.985 23.984 5.021 1.00 0.00 C ATOM 1542 CG2 VAL A1009 -0.952 22.813 2.812 1.00 0.00 C ATOM 0 H VAL A1009 1.564 23.133 5.847 1.00 0.00 H new ATOM 0 HA VAL A1009 1.707 22.977 3.105 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.097 22.089 4.617 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -1.978 23.572 5.200 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -0.460 24.091 5.970 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -1.078 24.961 4.546 1.00 0.00 H new ATOM 0 HG21 VAL A1009 -1.944 22.418 3.030 1.00 0.00 H new ATOM 0 HG22 VAL A1009 -1.047 23.754 2.270 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -0.403 22.096 2.201 1.00 0.00 H new ATOM 1552 N MET A1010 1.327 25.961 4.205 1.00 0.00 N ATOM 1553 CA MET A1010 1.420 27.378 3.881 1.00 0.00 C ATOM 1554 C MET A1010 2.134 27.597 2.546 1.00 0.00 C ATOM 1555 O MET A1010 1.677 28.398 1.736 1.00 0.00 O ATOM 1556 CB MET A1010 2.152 28.111 5.001 1.00 0.00 C ATOM 1557 CG MET A1010 1.501 27.941 6.364 1.00 0.00 C ATOM 1558 SD MET A1010 -0.206 28.519 6.403 1.00 0.00 S ATOM 1559 CE MET A1010 -0.651 28.141 8.098 1.00 0.00 C ATOM 0 H MET A1010 1.464 25.759 5.195 1.00 0.00 H new ATOM 0 HA MET A1010 0.410 27.777 3.785 1.00 0.00 H new ATOM 0 HB2 MET A1010 3.179 27.750 5.050 1.00 0.00 H new ATOM 0 HB3 MET A1010 2.199 29.173 4.759 1.00 0.00 H new ATOM 0 HG2 MET A1010 1.529 26.888 6.646 1.00 0.00 H new ATOM 0 HG3 MET A1010 2.081 28.486 7.109 1.00 0.00 H new ATOM 0 HE1 MET A1010 -1.683 28.441 8.279 1.00 0.00 H new ATOM 0 HE2 MET A1010 -0.549 27.070 8.271 1.00 0.00 H new ATOM 0 HE3 MET A1010 0.008 28.682 8.777 1.00 0.00 H new ATOM 1569 N THR A1011 3.248 26.883 2.313 1.00 0.00 N ATOM 1570 CA THR A1011 3.890 26.895 0.993 1.00 0.00 C ATOM 1571 C THR A1011 5.139 25.989 0.917 1.00 0.00 C ATOM 1572 O THR A1011 5.128 24.975 0.206 1.00 0.00 O ATOM 1573 CB THR A1011 4.234 28.340 0.518 1.00 0.00 C ATOM 1574 OG1 THR A1011 4.871 28.314 -0.766 1.00 0.00 O ATOM 1575 CG2 THR A1011 5.117 29.086 1.512 1.00 0.00 C ATOM 0 H THR A1011 3.714 26.301 3.009 1.00 0.00 H new ATOM 0 HA THR A1011 3.149 26.479 0.310 1.00 0.00 H new ATOM 0 HB THR A1011 3.288 28.877 0.446 1.00 0.00 H new ATOM 0 HG1 THR A1011 5.077 29.230 -1.047 1.00 0.00 H new ATOM 0 HG21 THR A1011 5.327 30.086 1.133 1.00 0.00 H new ATOM 0 HG22 THR A1011 4.603 29.161 2.470 1.00 0.00 H new ATOM 0 HG23 THR A1011 6.054 28.544 1.644 1.00 0.00 H new ATOM 1583 N SER A1012 6.186 26.329 1.673 1.00 0.00 N ATOM 1584 CA SER A1012 7.507 25.724 1.510 1.00 0.00 C ATOM 1585 C SER A1012 7.472 24.207 1.669 1.00 0.00 C ATOM 1586 O SER A1012 7.594 23.458 0.686 1.00 0.00 O ATOM 1587 CB SER A1012 8.471 26.328 2.529 1.00 0.00 C ATOM 1588 OG SER A1012 8.367 27.740 2.552 1.00 0.00 O ATOM 0 H SER A1012 6.141 27.030 2.413 1.00 0.00 H new ATOM 0 HA SER A1012 7.846 25.936 0.496 1.00 0.00 H new ATOM 0 HB2 SER A1012 8.256 25.928 3.520 1.00 0.00 H new ATOM 0 HB3 SER A1012 9.493 26.039 2.284 1.00 0.00 H new ATOM 0 HG SER A1012 8.993 28.103 3.213 1.00 0.00 H new ATOM 1594 N LEU A1013 7.322 23.754 2.910 1.00 0.00 N ATOM 1595 CA LEU A1013 7.243 22.337 3.209 1.00 0.00 C ATOM 1596 C LEU A1013 6.243 21.627 2.339 1.00 0.00 C ATOM 1597 O LEU A1013 6.479 20.502 1.925 1.00 0.00 O ATOM 1598 CB LEU A1013 6.840 22.130 4.660 1.00 0.00 C ATOM 1599 CG LEU A1013 8.012 21.926 5.629 1.00 0.00 C ATOM 1600 CD1 LEU A1013 8.953 23.119 5.599 1.00 0.00 C ATOM 1601 CD2 LEU A1013 7.520 21.685 7.046 1.00 0.00 C ATOM 0 H LEU A1013 7.253 24.358 3.729 1.00 0.00 H new ATOM 0 HA LEU A1013 8.232 21.921 3.017 1.00 0.00 H new ATOM 0 HB2 LEU A1013 6.261 22.993 4.989 1.00 0.00 H new ATOM 0 HB3 LEU A1013 6.182 21.263 4.720 1.00 0.00 H new ATOM 0 HG LEU A1013 8.558 21.041 5.301 1.00 0.00 H new ATOM 0 HD11 LEU A1013 9.776 22.951 6.294 1.00 0.00 H new ATOM 0 HD12 LEU A1013 9.349 23.245 4.591 1.00 0.00 H new ATOM 0 HD13 LEU A1013 8.410 24.018 5.890 1.00 0.00 H new ATOM 0 HD21 LEU A1013 8.374 21.544 7.709 1.00 0.00 H new ATOM 0 HD22 LEU A1013 6.939 22.544 7.381 1.00 0.00 H new ATOM 0 HD23 LEU A1013 6.894 20.793 7.067 1.00 0.00 H new ATOM 1613 N GLN A1014 5.144 22.296 2.050 1.00 0.00 N ATOM 1614 CA GLN A1014 4.004 21.633 1.465 1.00 0.00 C ATOM 1615 C GLN A1014 4.385 20.890 0.185 1.00 0.00 C ATOM 1616 O GLN A1014 4.072 19.719 0.022 1.00 0.00 O ATOM 1617 CB GLN A1014 2.891 22.643 1.208 1.00 0.00 C ATOM 1618 CG GLN A1014 1.780 22.097 0.340 1.00 0.00 C ATOM 1619 CD GLN A1014 1.708 22.777 -1.014 1.00 0.00 C ATOM 1620 OE1 GLN A1014 2.851 23.238 -1.499 1.00 0.00 O flip ATOM 1621 NE2 GLN A1014 0.643 22.881 -1.618 1.00 0.00 N flip ATOM 0 H GLN A1014 5.020 23.295 2.212 1.00 0.00 H new ATOM 0 HA GLN A1014 3.640 20.886 2.171 1.00 0.00 H new ATOM 0 HB2 GLN A1014 2.473 22.964 2.162 1.00 0.00 H new ATOM 0 HB3 GLN A1014 3.314 23.527 0.732 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.929 21.027 0.197 1.00 0.00 H new ATOM 0 HG3 GLN A1014 0.828 22.221 0.855 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -0.214 22.511 -1.207 1.00 0.00 H new ATOM 0 HE22 GLN A1014 0.616 23.337 -2.530 1.00 0.00 H new ATOM 1630 N GLN A1015 5.096 21.579 -0.703 1.00 0.00 N ATOM 1631 CA GLN A1015 5.453 21.018 -1.999 1.00 0.00 C ATOM 1632 C GLN A1015 6.591 20.016 -1.864 1.00 0.00 C ATOM 1633 O GLN A1015 6.607 18.989 -2.534 1.00 0.00 O ATOM 1634 CB GLN A1015 5.832 22.137 -2.976 1.00 0.00 C ATOM 1635 CG GLN A1015 7.002 22.986 -2.510 1.00 0.00 C ATOM 1636 CD GLN A1015 7.288 24.159 -3.426 1.00 0.00 C ATOM 1637 OE1 GLN A1015 6.251 24.708 -4.036 1.00 0.00 O flip ATOM 1638 NE2 GLN A1015 8.435 24.576 -3.574 1.00 0.00 N flip ATOM 0 H GLN A1015 5.436 22.528 -0.547 1.00 0.00 H new ATOM 0 HA GLN A1015 4.585 20.489 -2.394 1.00 0.00 H new ATOM 0 HB2 GLN A1015 6.077 21.696 -3.942 1.00 0.00 H new ATOM 0 HB3 GLN A1015 4.966 22.781 -3.130 1.00 0.00 H new ATOM 0 HG2 GLN A1015 6.796 23.358 -1.506 1.00 0.00 H new ATOM 0 HG3 GLN A1015 7.892 22.361 -2.442 1.00 0.00 H new ATOM 0 HE21 GLN A1015 9.209 24.125 -3.086 1.00 0.00 H new ATOM 0 HE22 GLN A1015 8.613 25.373 -4.185 1.00 0.00 H new ATOM 1647 N GLU A1016 7.525 20.305 -0.971 1.00 0.00 N ATOM 1648 CA GLU A1016 8.699 19.462 -0.794 1.00 0.00 C ATOM 1649 C GLU A1016 8.336 18.173 -0.068 1.00 0.00 C ATOM 1650 O GLU A1016 8.819 17.091 -0.391 1.00 0.00 O ATOM 1651 CB GLU A1016 9.741 20.213 0.022 1.00 0.00 C ATOM 1652 CG GLU A1016 11.075 19.504 0.102 1.00 0.00 C ATOM 1653 CD GLU A1016 11.922 19.750 -1.123 1.00 0.00 C ATOM 1654 OE1 GLU A1016 12.622 20.780 -1.162 1.00 0.00 O ATOM 1655 OE2 GLU A1016 11.888 18.927 -2.054 1.00 0.00 O ATOM 0 H GLU A1016 7.493 21.118 -0.356 1.00 0.00 H new ATOM 0 HA GLU A1016 9.096 19.212 -1.778 1.00 0.00 H new ATOM 0 HB2 GLU A1016 9.890 21.200 -0.415 1.00 0.00 H new ATOM 0 HB3 GLU A1016 9.359 20.365 1.031 1.00 0.00 H new ATOM 0 HG2 GLU A1016 11.612 19.842 0.988 1.00 0.00 H new ATOM 0 HG3 GLU A1016 10.910 18.433 0.219 1.00 0.00 H new ATOM 1662 N TYR A1017 7.489 18.304 0.920 1.00 0.00 N ATOM 1663 CA TYR A1017 7.093 17.200 1.754 1.00 0.00 C ATOM 1664 C TYR A1017 6.069 16.311 1.095 1.00 0.00 C ATOM 1665 O TYR A1017 6.094 15.097 1.240 1.00 0.00 O ATOM 1666 CB TYR A1017 6.556 17.766 3.053 1.00 0.00 C ATOM 1667 CG TYR A1017 7.683 17.790 4.056 1.00 0.00 C ATOM 1668 CD1 TYR A1017 8.034 16.632 4.736 1.00 0.00 C ATOM 1669 CD2 TYR A1017 8.457 18.926 4.251 1.00 0.00 C ATOM 1670 CE1 TYR A1017 9.108 16.608 5.598 1.00 0.00 C ATOM 1671 CE2 TYR A1017 9.546 18.906 5.102 1.00 0.00 C ATOM 1672 CZ TYR A1017 9.865 17.745 5.773 1.00 0.00 C ATOM 1673 OH TYR A1017 10.955 17.711 6.610 1.00 0.00 O ATOM 0 H TYR A1017 7.050 19.190 1.170 1.00 0.00 H new ATOM 0 HA TYR A1017 7.962 16.568 1.937 1.00 0.00 H new ATOM 0 HB2 TYR A1017 6.164 18.771 2.897 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.731 17.156 3.422 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.454 15.733 4.586 1.00 0.00 H new ATOM 0 HD2 TYR A1017 8.205 19.838 3.730 1.00 0.00 H new ATOM 0 HE1 TYR A1017 9.355 15.703 6.133 1.00 0.00 H new ATOM 0 HE2 TYR A1017 10.144 19.795 5.240 1.00 0.00 H new ATOM 0 HH TYR A1017 11.384 18.592 6.625 1.00 0.00 H new ATOM 1683 N LYS A1018 5.154 16.947 0.364 1.00 0.00 N ATOM 1684 CA LYS A1018 4.045 16.253 -0.255 1.00 0.00 C ATOM 1685 C LYS A1018 4.475 15.612 -1.566 1.00 0.00 C ATOM 1686 O LYS A1018 3.881 14.632 -2.012 1.00 0.00 O ATOM 1687 CB LYS A1018 2.860 17.191 -0.480 1.00 0.00 C ATOM 1688 CG LYS A1018 1.588 16.478 -0.906 1.00 0.00 C ATOM 1689 CD LYS A1018 0.439 17.450 -1.108 1.00 0.00 C ATOM 1690 CE LYS A1018 0.803 18.518 -2.127 1.00 0.00 C ATOM 1691 NZ LYS A1018 -0.287 19.504 -2.307 1.00 0.00 N ATOM 0 H LYS A1018 5.167 17.952 0.190 1.00 0.00 H new ATOM 0 HA LYS A1018 3.724 15.465 0.427 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.666 17.743 0.439 1.00 0.00 H new ATOM 0 HB3 LYS A1018 3.128 17.924 -1.241 1.00 0.00 H new ATOM 0 HG2 LYS A1018 1.770 15.932 -1.832 1.00 0.00 H new ATOM 0 HG3 LYS A1018 1.313 15.742 -0.151 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -0.446 16.909 -1.443 1.00 0.00 H new ATOM 0 HD3 LYS A1018 0.184 17.920 -0.158 1.00 0.00 H new ATOM 0 HE2 LYS A1018 1.709 19.033 -1.806 1.00 0.00 H new ATOM 0 HE3 LYS A1018 1.027 18.046 -3.084 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 0.053 20.295 -2.890 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -1.093 19.048 -2.780 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -0.588 19.862 -1.378 1.00 0.00 H new ATOM 1705 N LYS A1019 5.508 16.161 -2.196 1.00 0.00 N ATOM 1706 CA LYS A1019 6.037 15.531 -3.392 1.00 0.00 C ATOM 1707 C LYS A1019 6.799 14.275 -2.978 1.00 0.00 C ATOM 1708 O LYS A1019 6.802 13.266 -3.673 1.00 0.00 O ATOM 1709 CB LYS A1019 6.857 16.534 -4.234 1.00 0.00 C ATOM 1710 CG LYS A1019 8.319 16.199 -4.445 1.00 0.00 C ATOM 1711 CD LYS A1019 9.120 16.552 -3.216 1.00 0.00 C ATOM 1712 CE LYS A1019 10.605 16.687 -3.518 1.00 0.00 C ATOM 1713 NZ LYS A1019 11.180 15.470 -4.142 1.00 0.00 N ATOM 0 H LYS A1019 5.982 17.017 -1.907 1.00 0.00 H new ATOM 0 HA LYS A1019 5.233 15.216 -4.057 1.00 0.00 H new ATOM 0 HB2 LYS A1019 6.383 16.627 -5.211 1.00 0.00 H new ATOM 0 HB3 LYS A1019 6.796 17.512 -3.756 1.00 0.00 H new ATOM 0 HG2 LYS A1019 8.428 15.137 -4.665 1.00 0.00 H new ATOM 0 HG3 LYS A1019 8.703 16.744 -5.307 1.00 0.00 H new ATOM 0 HD2 LYS A1019 8.749 17.488 -2.799 1.00 0.00 H new ATOM 0 HD3 LYS A1019 8.974 15.784 -2.456 1.00 0.00 H new ATOM 0 HE2 LYS A1019 10.760 17.537 -4.182 1.00 0.00 H new ATOM 0 HE3 LYS A1019 11.141 16.903 -2.593 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 12.208 15.587 -4.247 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 10.985 14.645 -3.539 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 10.750 15.324 -5.078 1.00 0.00 H new ATOM 1727 N GLN A1020 7.394 14.354 -1.801 1.00 0.00 N ATOM 1728 CA GLN A1020 7.857 13.185 -1.064 1.00 0.00 C ATOM 1729 C GLN A1020 6.672 12.351 -0.576 1.00 0.00 C ATOM 1730 O GLN A1020 6.766 11.128 -0.519 1.00 0.00 O ATOM 1731 CB GLN A1020 8.701 13.623 0.130 1.00 0.00 C ATOM 1732 CG GLN A1020 10.051 14.197 -0.259 1.00 0.00 C ATOM 1733 CD GLN A1020 10.865 14.624 0.944 1.00 0.00 C ATOM 1734 OE1 GLN A1020 11.621 13.836 1.506 1.00 0.00 O ATOM 1735 NE2 GLN A1020 10.718 15.877 1.342 1.00 0.00 N ATOM 0 H GLN A1020 7.572 15.237 -1.323 1.00 0.00 H new ATOM 0 HA GLN A1020 8.463 12.574 -1.733 1.00 0.00 H new ATOM 0 HB2 GLN A1020 8.149 14.370 0.700 1.00 0.00 H new ATOM 0 HB3 GLN A1020 8.855 12.768 0.789 1.00 0.00 H new ATOM 0 HG2 GLN A1020 10.609 13.452 -0.826 1.00 0.00 H new ATOM 0 HG3 GLN A1020 9.903 15.054 -0.917 1.00 0.00 H new ATOM 0 HE21 GLN A1020 10.079 16.498 0.846 1.00 0.00 H new ATOM 0 HE22 GLN A1020 11.244 16.222 2.145 1.00 0.00 H new ATOM 1744 N MET A1021 5.560 12.998 -0.253 1.00 0.00 N ATOM 1745 CA MET A1021 4.382 12.286 0.228 1.00 0.00 C ATOM 1746 C MET A1021 3.834 11.388 -0.860 1.00 0.00 C ATOM 1747 O MET A1021 3.714 10.187 -0.666 1.00 0.00 O ATOM 1748 CB MET A1021 3.294 13.270 0.684 1.00 0.00 C ATOM 1749 CG MET A1021 2.039 12.624 1.269 1.00 0.00 C ATOM 1750 SD MET A1021 0.926 11.905 0.034 1.00 0.00 S ATOM 1751 CE MET A1021 0.288 13.367 -0.775 1.00 0.00 C ATOM 0 H MET A1021 5.448 14.010 -0.315 1.00 0.00 H new ATOM 0 HA MET A1021 4.680 11.678 1.082 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.721 13.939 1.431 1.00 0.00 H new ATOM 0 HB3 MET A1021 3.004 13.886 -0.167 1.00 0.00 H new ATOM 0 HG2 MET A1021 2.339 11.844 1.969 1.00 0.00 H new ATOM 0 HG3 MET A1021 1.492 13.373 1.842 1.00 0.00 H new ATOM 0 HE1 MET A1021 -0.602 13.107 -1.348 1.00 0.00 H new ATOM 0 HE2 MET A1021 0.030 14.115 -0.025 1.00 0.00 H new ATOM 0 HE3 MET A1021 1.046 13.772 -1.445 1.00 0.00 H new ATOM 1761 N LEU A1022 3.571 11.947 -2.035 1.00 0.00 N ATOM 1762 CA LEU A1022 2.906 11.166 -3.057 1.00 0.00 C ATOM 1763 C LEU A1022 3.905 10.228 -3.722 1.00 0.00 C ATOM 1764 O LEU A1022 3.521 9.346 -4.470 1.00 0.00 O ATOM 1765 CB LEU A1022 2.203 12.057 -4.095 1.00 0.00 C ATOM 1766 CG LEU A1022 2.900 12.146 -5.456 1.00 0.00 C ATOM 1767 CD1 LEU A1022 1.909 12.560 -6.530 1.00 0.00 C ATOM 1768 CD2 LEU A1022 4.057 13.132 -5.406 1.00 0.00 C ATOM 0 H LEU A1022 3.801 12.906 -2.294 1.00 0.00 H new ATOM 0 HA LEU A1022 2.128 10.572 -2.578 1.00 0.00 H new ATOM 0 HB2 LEU A1022 1.191 11.682 -4.247 1.00 0.00 H new ATOM 0 HB3 LEU A1022 2.112 13.063 -3.685 1.00 0.00 H new ATOM 0 HG LEU A1022 3.296 11.161 -5.701 1.00 0.00 H new ATOM 0 HD11 LEU A1022 2.418 12.619 -7.492 1.00 0.00 H new ATOM 0 HD12 LEU A1022 1.107 11.824 -6.589 1.00 0.00 H new ATOM 0 HD13 LEU A1022 1.489 13.535 -6.281 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.537 13.179 -6.383 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.682 14.120 -5.138 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.782 12.805 -4.661 1.00 0.00 H new ATOM 1780 N THR A1023 5.194 10.443 -3.456 1.00 0.00 N ATOM 1781 CA THR A1023 6.234 9.553 -3.954 1.00 0.00 C ATOM 1782 C THR A1023 6.450 8.380 -2.994 1.00 0.00 C ATOM 1783 O THR A1023 6.747 7.273 -3.431 1.00 0.00 O ATOM 1784 CB THR A1023 7.565 10.303 -4.192 1.00 0.00 C ATOM 1785 OG1 THR A1023 7.383 11.285 -5.221 1.00 0.00 O ATOM 1786 CG2 THR A1023 8.683 9.351 -4.597 1.00 0.00 C ATOM 0 H THR A1023 5.539 11.225 -2.899 1.00 0.00 H new ATOM 0 HA THR A1023 5.895 9.164 -4.914 1.00 0.00 H new ATOM 0 HB THR A1023 7.851 10.783 -3.256 1.00 0.00 H new ATOM 0 HG1 THR A1023 6.798 11.999 -4.892 1.00 0.00 H new ATOM 0 HG21 THR A1023 9.602 9.915 -4.755 1.00 0.00 H new ATOM 0 HG22 THR A1023 8.840 8.617 -3.807 1.00 0.00 H new ATOM 0 HG23 THR A1023 8.408 8.839 -5.519 1.00 0.00 H new ATOM 1794 N ALA A1024 6.295 8.619 -1.694 1.00 0.00 N ATOM 1795 CA ALA A1024 6.327 7.543 -0.715 1.00 0.00 C ATOM 1796 C ALA A1024 4.988 6.830 -0.706 1.00 0.00 C ATOM 1797 O ALA A1024 4.880 5.687 -0.291 1.00 0.00 O ATOM 1798 CB ALA A1024 6.669 8.073 0.669 1.00 0.00 C ATOM 0 H ALA A1024 6.146 9.547 -1.298 1.00 0.00 H new ATOM 0 HA ALA A1024 7.107 6.834 -0.994 1.00 0.00 H new ATOM 0 HB1 ALA A1024 6.686 7.248 1.381 1.00 0.00 H new ATOM 0 HB2 ALA A1024 7.648 8.551 0.644 1.00 0.00 H new ATOM 0 HB3 ALA A1024 5.918 8.801 0.976 1.00 0.00 H new ATOM 1804 N ALA A1025 3.961 7.536 -1.144 1.00 0.00 N ATOM 1805 CA ALA A1025 2.662 6.941 -1.394 1.00 0.00 C ATOM 1806 C ALA A1025 2.598 6.362 -2.808 1.00 0.00 C ATOM 1807 O ALA A1025 1.798 5.473 -3.068 1.00 0.00 O ATOM 1808 CB ALA A1025 1.544 7.924 -1.126 1.00 0.00 C ATOM 0 H ALA A1025 4.005 8.537 -1.336 1.00 0.00 H new ATOM 0 HA ALA A1025 2.523 6.115 -0.697 1.00 0.00 H new ATOM 0 HB1 ALA A1025 0.584 7.446 -1.323 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.583 8.244 -0.085 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.658 8.791 -1.777 1.00 0.00 H new ATOM 1814 N HIS A1026 3.407 6.868 -3.730 1.00 0.00 N ATOM 1815 CA HIS A1026 3.642 6.147 -4.986 1.00 0.00 C ATOM 1816 C HIS A1026 4.537 4.947 -4.705 1.00 0.00 C ATOM 1817 O HIS A1026 4.460 3.945 -5.391 1.00 0.00 O ATOM 1818 CB HIS A1026 4.246 7.046 -6.080 1.00 0.00 C ATOM 1819 CG HIS A1026 4.537 6.334 -7.372 1.00 0.00 C ATOM 1820 ND1 HIS A1026 3.661 6.296 -8.435 1.00 0.00 N ATOM 1821 CD2 HIS A1026 5.624 5.624 -7.765 1.00 0.00 C ATOM 1822 CE1 HIS A1026 4.191 5.590 -9.416 1.00 0.00 C ATOM 1823 NE2 HIS A1026 5.382 5.173 -9.037 1.00 0.00 N ATOM 0 H HIS A1026 3.904 7.754 -3.642 1.00 0.00 H new ATOM 0 HA HIS A1026 2.680 5.810 -5.373 1.00 0.00 H new ATOM 0 HB2 HIS A1026 3.559 7.869 -6.278 1.00 0.00 H new ATOM 0 HB3 HIS A1026 5.170 7.485 -5.704 1.00 0.00 H new ATOM 0 HD2 HIS A1026 6.516 5.447 -7.183 1.00 0.00 H new ATOM 0 HE1 HIS A1026 3.726 5.388 -10.370 1.00 0.00 H new ATOM 0 HE2 HIS A1026 6.019 4.608 -9.598 1.00 0.00 H new ATOM 1832 N ALA A1027 5.373 5.060 -3.687 1.00 0.00 N ATOM 1833 CA ALA A1027 6.043 3.918 -3.057 1.00 0.00 C ATOM 1834 C ALA A1027 5.032 3.027 -2.368 1.00 0.00 C ATOM 1835 O ALA A1027 5.135 1.808 -2.460 1.00 0.00 O ATOM 1836 CB ALA A1027 7.074 4.412 -2.056 1.00 0.00 C ATOM 0 H ALA A1027 5.614 5.956 -3.264 1.00 0.00 H new ATOM 0 HA ALA A1027 6.547 3.337 -3.829 1.00 0.00 H new ATOM 0 HB1 ALA A1027 7.568 3.559 -1.591 1.00 0.00 H new ATOM 0 HB2 ALA A1027 7.815 5.025 -2.569 1.00 0.00 H new ATOM 0 HB3 ALA A1027 6.580 5.007 -1.288 1.00 0.00 H new ATOM 1842 N LEU A1028 4.057 3.601 -1.701 1.00 0.00 N ATOM 1843 CA LEU A1028 2.963 2.803 -1.193 1.00 0.00 C ATOM 1844 C LEU A1028 2.227 2.144 -2.344 1.00 0.00 C ATOM 1845 O LEU A1028 1.912 0.972 -2.278 1.00 0.00 O ATOM 1846 CB LEU A1028 2.022 3.634 -0.333 1.00 0.00 C ATOM 1847 CG LEU A1028 2.604 4.024 1.015 1.00 0.00 C ATOM 1848 CD1 LEU A1028 1.542 4.674 1.869 1.00 0.00 C ATOM 1849 CD2 LEU A1028 3.158 2.795 1.703 1.00 0.00 C ATOM 0 H LEU A1028 3.997 4.599 -1.500 1.00 0.00 H new ATOM 0 HA LEU A1028 3.372 2.022 -0.552 1.00 0.00 H new ATOM 0 HB2 LEU A1028 1.752 4.539 -0.877 1.00 0.00 H new ATOM 0 HB3 LEU A1028 1.102 3.073 -0.172 1.00 0.00 H new ATOM 0 HG LEU A1028 3.412 4.740 0.866 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.969 4.950 2.833 1.00 0.00 H new ATOM 0 HD12 LEU A1028 1.169 5.567 1.368 1.00 0.00 H new ATOM 0 HD13 LEU A1028 0.720 3.975 2.023 1.00 0.00 H new ATOM 0 HD21 LEU A1028 3.575 3.076 2.670 1.00 0.00 H new ATOM 0 HD22 LEU A1028 2.358 2.069 1.850 1.00 0.00 H new ATOM 0 HD23 LEU A1028 3.940 2.353 1.085 1.00 0.00 H new ATOM 1861 N ALA A1029 1.977 2.895 -3.404 1.00 0.00 N ATOM 1862 CA ALA A1029 1.436 2.333 -4.632 1.00 0.00 C ATOM 1863 C ALA A1029 2.354 1.244 -5.183 1.00 0.00 C ATOM 1864 O ALA A1029 1.887 0.203 -5.640 1.00 0.00 O ATOM 1865 CB ALA A1029 1.237 3.427 -5.671 1.00 0.00 C ATOM 0 H ALA A1029 2.141 3.901 -3.439 1.00 0.00 H new ATOM 0 HA ALA A1029 0.470 1.883 -4.403 1.00 0.00 H new ATOM 0 HB1 ALA A1029 0.832 2.992 -6.585 1.00 0.00 H new ATOM 0 HB2 ALA A1029 0.542 4.173 -5.285 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.194 3.901 -5.888 1.00 0.00 H new ATOM 1871 N VAL A1030 3.660 1.487 -5.120 1.00 0.00 N ATOM 1872 CA VAL A1030 4.638 0.561 -5.668 1.00 0.00 C ATOM 1873 C VAL A1030 4.654 -0.736 -4.876 1.00 0.00 C ATOM 1874 O VAL A1030 4.538 -1.825 -5.437 1.00 0.00 O ATOM 1875 CB VAL A1030 6.061 1.183 -5.672 1.00 0.00 C ATOM 1876 CG1 VAL A1030 7.140 0.109 -5.719 1.00 0.00 C ATOM 1877 CG2 VAL A1030 6.226 2.120 -6.857 1.00 0.00 C ATOM 0 H VAL A1030 4.063 2.321 -4.693 1.00 0.00 H new ATOM 0 HA VAL A1030 4.346 0.350 -6.697 1.00 0.00 H new ATOM 0 HB VAL A1030 6.175 1.744 -4.745 1.00 0.00 H new ATOM 0 HG11 VAL A1030 8.123 0.580 -5.721 1.00 0.00 H new ATOM 0 HG12 VAL A1030 7.049 -0.537 -4.846 1.00 0.00 H new ATOM 0 HG13 VAL A1030 7.022 -0.486 -6.624 1.00 0.00 H new ATOM 0 HG21 VAL A1030 7.228 2.548 -6.846 1.00 0.00 H new ATOM 0 HG22 VAL A1030 6.079 1.565 -7.783 1.00 0.00 H new ATOM 0 HG23 VAL A1030 5.489 2.921 -6.793 1.00 0.00 H new ATOM 1887 N ASP A1031 4.793 -0.608 -3.563 1.00 0.00 N ATOM 1888 CA ASP A1031 4.868 -1.765 -2.697 1.00 0.00 C ATOM 1889 C ASP A1031 3.511 -2.392 -2.451 1.00 0.00 C ATOM 1890 O ASP A1031 3.434 -3.565 -2.176 1.00 0.00 O ATOM 1891 CB ASP A1031 5.600 -1.470 -1.393 1.00 0.00 C ATOM 1892 CG ASP A1031 7.079 -1.785 -1.518 1.00 0.00 C ATOM 1893 OD1 ASP A1031 7.440 -2.986 -1.506 1.00 0.00 O ATOM 1894 OD2 ASP A1031 7.886 -0.846 -1.657 1.00 0.00 O ATOM 0 H ASP A1031 4.856 0.288 -3.079 1.00 0.00 H new ATOM 0 HA ASP A1031 5.464 -2.504 -3.232 1.00 0.00 H new ATOM 0 HB2 ASP A1031 5.469 -0.421 -1.127 1.00 0.00 H new ATOM 0 HB3 ASP A1031 5.166 -2.060 -0.586 1.00 0.00 H new ATOM 1899 N ALA A1032 2.439 -1.619 -2.512 1.00 0.00 N ATOM 1900 CA ALA A1032 1.098 -2.207 -2.501 1.00 0.00 C ATOM 1901 C ALA A1032 0.883 -3.002 -3.781 1.00 0.00 C ATOM 1902 O ALA A1032 0.204 -4.027 -3.768 1.00 0.00 O ATOM 1903 CB ALA A1032 0.011 -1.161 -2.325 1.00 0.00 C ATOM 0 H ALA A1032 2.462 -0.601 -2.569 1.00 0.00 H new ATOM 0 HA ALA A1032 1.029 -2.874 -1.641 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -0.965 -1.647 -2.323 1.00 0.00 H new ATOM 0 HB2 ALA A1032 0.158 -0.639 -1.379 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.058 -0.445 -3.146 1.00 0.00 H new ATOM 1909 N LYS A1033 1.486 -2.549 -4.874 1.00 0.00 N ATOM 1910 CA LYS A1033 1.530 -3.331 -6.105 1.00 0.00 C ATOM 1911 C LYS A1033 2.421 -4.554 -5.901 1.00 0.00 C ATOM 1912 O LYS A1033 2.129 -5.654 -6.363 1.00 0.00 O ATOM 1913 CB LYS A1033 2.096 -2.485 -7.248 1.00 0.00 C ATOM 1914 CG LYS A1033 2.097 -3.200 -8.589 1.00 0.00 C ATOM 1915 CD LYS A1033 2.761 -2.363 -9.667 1.00 0.00 C ATOM 1916 CE LYS A1033 2.804 -3.102 -10.995 1.00 0.00 C ATOM 1917 NZ LYS A1033 3.484 -2.304 -12.048 1.00 0.00 N ATOM 0 H LYS A1033 1.952 -1.643 -4.933 1.00 0.00 H new ATOM 0 HA LYS A1033 0.518 -3.646 -6.358 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.512 -1.568 -7.334 1.00 0.00 H new ATOM 0 HB3 LYS A1033 3.116 -2.191 -7.001 1.00 0.00 H new ATOM 0 HG2 LYS A1033 2.619 -4.152 -8.494 1.00 0.00 H new ATOM 0 HG3 LYS A1033 1.072 -3.426 -8.883 1.00 0.00 H new ATOM 0 HD2 LYS A1033 2.218 -1.426 -9.788 1.00 0.00 H new ATOM 0 HD3 LYS A1033 3.775 -2.107 -9.358 1.00 0.00 H new ATOM 0 HE2 LYS A1033 3.323 -4.052 -10.866 1.00 0.00 H new ATOM 0 HE3 LYS A1033 1.788 -3.335 -11.314 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 3.494 -2.841 -12.939 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 2.974 -1.409 -12.189 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 4.461 -2.103 -11.754 1.00 0.00 H new ATOM 1931 N ASN A1034 3.516 -4.331 -5.189 1.00 0.00 N ATOM 1932 CA ASN A1034 4.516 -5.357 -4.937 1.00 0.00 C ATOM 1933 C ASN A1034 4.001 -6.409 -3.967 1.00 0.00 C ATOM 1934 O ASN A1034 4.044 -7.591 -4.256 1.00 0.00 O ATOM 1935 CB ASN A1034 5.778 -4.712 -4.360 1.00 0.00 C ATOM 1936 CG ASN A1034 6.867 -5.712 -4.020 1.00 0.00 C ATOM 1937 OD1 ASN A1034 7.035 -6.727 -4.698 1.00 0.00 O ATOM 1938 ND2 ASN A1034 7.612 -5.431 -2.959 1.00 0.00 N ATOM 0 H ASN A1034 3.736 -3.428 -4.768 1.00 0.00 H new ATOM 0 HA ASN A1034 4.743 -5.847 -5.884 1.00 0.00 H new ATOM 0 HB2 ASN A1034 6.169 -3.991 -5.078 1.00 0.00 H new ATOM 0 HB3 ASN A1034 5.513 -4.155 -3.461 1.00 0.00 H new ATOM 0 HD21 ASN A1034 8.358 -6.067 -2.677 1.00 0.00 H new ATOM 0 HD22 ASN A1034 7.439 -4.579 -2.425 1.00 0.00 H new ATOM 1945 N LEU A1035 3.510 -5.963 -2.822 1.00 0.00 N ATOM 1946 CA LEU A1035 3.157 -6.854 -1.734 1.00 0.00 C ATOM 1947 C LEU A1035 2.013 -7.788 -2.119 1.00 0.00 C ATOM 1948 O LEU A1035 2.070 -8.970 -1.780 1.00 0.00 O ATOM 1949 CB LEU A1035 2.847 -6.073 -0.447 1.00 0.00 C ATOM 1950 CG LEU A1035 1.550 -5.254 -0.433 1.00 0.00 C ATOM 1951 CD1 LEU A1035 0.367 -6.090 0.034 1.00 0.00 C ATOM 1952 CD2 LEU A1035 1.713 -4.040 0.453 1.00 0.00 C ATOM 0 H LEU A1035 3.346 -4.976 -2.623 1.00 0.00 H new ATOM 0 HA LEU A1035 4.026 -7.481 -1.531 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.811 -6.782 0.380 1.00 0.00 H new ATOM 0 HB3 LEU A1035 3.679 -5.396 -0.251 1.00 0.00 H new ATOM 0 HG LEU A1035 1.347 -4.930 -1.454 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -0.535 -5.478 0.031 1.00 0.00 H new ATOM 0 HD12 LEU A1035 0.232 -6.937 -0.638 1.00 0.00 H new ATOM 0 HD13 LEU A1035 0.555 -6.455 1.044 1.00 0.00 H new ATOM 0 HD21 LEU A1035 0.787 -3.465 0.456 1.00 0.00 H new ATOM 0 HD22 LEU A1035 1.945 -4.360 1.469 1.00 0.00 H new ATOM 0 HD23 LEU A1035 2.524 -3.419 0.073 1.00 0.00 H new ATOM 1964 N LEU A1036 0.967 -7.310 -2.807 1.00 0.00 N ATOM 1965 CA LEU A1036 -0.098 -8.257 -3.108 1.00 0.00 C ATOM 1966 C LEU A1036 0.393 -9.239 -4.179 1.00 0.00 C ATOM 1967 O LEU A1036 0.037 -10.415 -4.182 1.00 0.00 O ATOM 1968 CB LEU A1036 -1.456 -7.571 -3.430 1.00 0.00 C ATOM 1969 CG LEU A1036 -1.775 -7.144 -4.881 1.00 0.00 C ATOM 1970 CD1 LEU A1036 -0.661 -6.327 -5.500 1.00 0.00 C ATOM 1971 CD2 LEU A1036 -2.119 -8.344 -5.753 1.00 0.00 C ATOM 0 H LEU A1036 0.842 -6.354 -3.140 1.00 0.00 H new ATOM 0 HA LEU A1036 -0.326 -8.835 -2.213 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -2.247 -8.249 -3.109 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -1.527 -6.680 -2.806 1.00 0.00 H new ATOM 0 HG LEU A1036 -2.653 -6.501 -4.828 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -0.934 -6.052 -6.519 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -0.502 -5.424 -4.911 1.00 0.00 H new ATOM 0 HD13 LEU A1036 0.256 -6.916 -5.517 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -2.338 -8.007 -6.766 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -1.274 -9.033 -5.774 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -2.992 -8.853 -5.344 1.00 0.00 H new ATOM 1983 N ASP A1037 1.249 -8.717 -5.069 1.00 0.00 N ATOM 1984 CA ASP A1037 1.983 -9.512 -6.053 1.00 0.00 C ATOM 1985 C ASP A1037 2.812 -10.578 -5.350 1.00 0.00 C ATOM 1986 O ASP A1037 2.856 -11.728 -5.757 1.00 0.00 O ATOM 1987 CB ASP A1037 2.915 -8.585 -6.836 1.00 0.00 C ATOM 1988 CG ASP A1037 3.852 -9.318 -7.772 1.00 0.00 C ATOM 1989 OD1 ASP A1037 3.398 -9.787 -8.832 1.00 0.00 O ATOM 1990 OD2 ASP A1037 5.063 -9.393 -7.469 1.00 0.00 O ATOM 0 H ASP A1037 1.451 -7.719 -5.123 1.00 0.00 H new ATOM 0 HA ASP A1037 1.278 -9.998 -6.727 1.00 0.00 H new ATOM 0 HB2 ASP A1037 2.314 -7.883 -7.414 1.00 0.00 H new ATOM 0 HB3 ASP A1037 3.504 -7.997 -6.132 1.00 0.00 H new ATOM 1995 N VAL A1038 3.476 -10.139 -4.293 1.00 0.00 N ATOM 1996 CA VAL A1038 4.262 -10.995 -3.412 1.00 0.00 C ATOM 1997 C VAL A1038 3.430 -12.132 -2.839 1.00 0.00 C ATOM 1998 O VAL A1038 3.934 -13.233 -2.713 1.00 0.00 O ATOM 1999 CB VAL A1038 4.918 -10.168 -2.272 1.00 0.00 C ATOM 2000 CG1 VAL A1038 5.442 -11.056 -1.156 1.00 0.00 C ATOM 2001 CG2 VAL A1038 6.053 -9.321 -2.821 1.00 0.00 C ATOM 0 H VAL A1038 3.485 -9.157 -4.016 1.00 0.00 H new ATOM 0 HA VAL A1038 5.054 -11.438 -4.016 1.00 0.00 H new ATOM 0 HB VAL A1038 4.145 -9.523 -1.856 1.00 0.00 H new ATOM 0 HG11 VAL A1038 5.893 -10.437 -0.380 1.00 0.00 H new ATOM 0 HG12 VAL A1038 4.619 -11.630 -0.730 1.00 0.00 H new ATOM 0 HG13 VAL A1038 6.191 -11.739 -1.556 1.00 0.00 H new ATOM 0 HG21 VAL A1038 6.503 -8.747 -2.011 1.00 0.00 H new ATOM 0 HG22 VAL A1038 6.806 -9.969 -3.269 1.00 0.00 H new ATOM 0 HG23 VAL A1038 5.665 -8.639 -3.577 1.00 0.00 H new ATOM 2011 N ILE A1039 2.177 -11.885 -2.496 1.00 0.00 N ATOM 2012 CA ILE A1039 1.302 -12.961 -2.036 1.00 0.00 C ATOM 2013 C ILE A1039 0.732 -13.758 -3.194 1.00 0.00 C ATOM 2014 O ILE A1039 0.538 -14.969 -3.077 1.00 0.00 O ATOM 2015 CB ILE A1039 0.190 -12.461 -1.091 1.00 0.00 C ATOM 2016 CG1 ILE A1039 0.754 -12.368 0.313 1.00 0.00 C ATOM 2017 CG2 ILE A1039 -1.036 -13.366 -1.112 1.00 0.00 C ATOM 2018 CD1 ILE A1039 1.619 -11.152 0.549 1.00 0.00 C ATOM 0 H ILE A1039 1.743 -10.963 -2.525 1.00 0.00 H new ATOM 0 HA ILE A1039 1.928 -13.634 -1.450 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.140 -11.481 -1.434 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -0.071 -12.358 1.025 1.00 0.00 H new ATOM 0 HG13 ILE A1039 1.341 -13.264 0.518 1.00 0.00 H new ATOM 0 HG21 ILE A1039 -1.791 -12.972 -0.431 1.00 0.00 H new ATOM 0 HG22 ILE A1039 -1.443 -13.404 -2.122 1.00 0.00 H new ATOM 0 HG23 ILE A1039 -0.752 -14.370 -0.798 1.00 0.00 H new ATOM 0 HD11 ILE A1039 1.984 -11.159 1.576 1.00 0.00 H new ATOM 0 HD12 ILE A1039 2.466 -11.169 -0.137 1.00 0.00 H new ATOM 0 HD13 ILE A1039 1.032 -10.249 0.378 1.00 0.00 H new ATOM 2030 N ASP A1040 0.503 -13.117 -4.312 1.00 0.00 N ATOM 2031 CA ASP A1040 0.155 -13.847 -5.517 1.00 0.00 C ATOM 2032 C ASP A1040 1.302 -14.772 -5.912 1.00 0.00 C ATOM 2033 O ASP A1040 1.095 -15.905 -6.350 1.00 0.00 O ATOM 2034 CB ASP A1040 -0.167 -12.884 -6.645 1.00 0.00 C ATOM 2035 CG ASP A1040 -1.637 -12.866 -6.994 1.00 0.00 C ATOM 2036 OD1 ASP A1040 -2.127 -13.864 -7.570 1.00 0.00 O ATOM 2037 OD2 ASP A1040 -2.308 -11.855 -6.718 1.00 0.00 O ATOM 0 H ASP A1040 0.549 -12.104 -4.419 1.00 0.00 H new ATOM 0 HA ASP A1040 -0.731 -14.451 -5.322 1.00 0.00 H new ATOM 0 HB2 ASP A1040 0.147 -11.880 -6.361 1.00 0.00 H new ATOM 0 HB3 ASP A1040 0.409 -13.160 -7.528 1.00 0.00 H new ATOM 2042 N GLN A1041 2.513 -14.287 -5.740 1.00 0.00 N ATOM 2043 CA GLN A1041 3.696 -15.092 -5.935 1.00 0.00 C ATOM 2044 C GLN A1041 3.905 -16.038 -4.761 1.00 0.00 C ATOM 2045 O GLN A1041 4.411 -17.127 -4.937 1.00 0.00 O ATOM 2046 CB GLN A1041 4.911 -14.195 -6.117 1.00 0.00 C ATOM 2047 CG GLN A1041 4.982 -13.556 -7.497 1.00 0.00 C ATOM 2048 CD GLN A1041 6.224 -12.718 -7.715 1.00 0.00 C ATOM 2049 OE1 GLN A1041 6.659 -12.011 -6.690 1.00 0.00 O flip ATOM 2050 NE2 GLN A1041 6.759 -12.667 -8.823 1.00 0.00 N flip ATOM 0 H GLN A1041 2.703 -13.324 -5.461 1.00 0.00 H new ATOM 0 HA GLN A1041 3.562 -15.693 -6.834 1.00 0.00 H new ATOM 0 HB2 GLN A1041 4.892 -13.410 -5.361 1.00 0.00 H new ATOM 0 HB3 GLN A1041 5.815 -14.780 -5.947 1.00 0.00 H new ATOM 0 HG2 GLN A1041 4.946 -14.340 -8.253 1.00 0.00 H new ATOM 0 HG3 GLN A1041 4.102 -12.930 -7.644 1.00 0.00 H new ATOM 0 HE21 GLN A1041 6.394 -13.229 -9.592 1.00 0.00 H new ATOM 0 HE22 GLN A1041 7.567 -12.063 -8.972 1.00 0.00 H new ATOM 2059 N ALA A1042 3.524 -15.598 -3.567 1.00 0.00 N ATOM 2060 CA ALA A1042 3.625 -16.403 -2.349 1.00 0.00 C ATOM 2061 C ALA A1042 2.907 -17.714 -2.481 1.00 0.00 C ATOM 2062 O ALA A1042 3.497 -18.780 -2.294 1.00 0.00 O ATOM 2063 CB ALA A1042 3.019 -15.655 -1.184 1.00 0.00 C ATOM 0 H ALA A1042 3.134 -14.668 -3.413 1.00 0.00 H new ATOM 0 HA ALA A1042 4.685 -16.594 -2.182 1.00 0.00 H new ATOM 0 HB1 ALA A1042 3.098 -16.261 -0.282 1.00 0.00 H new ATOM 0 HB2 ALA A1042 3.552 -14.715 -1.038 1.00 0.00 H new ATOM 0 HB3 ALA A1042 1.969 -15.448 -1.391 1.00 0.00 H new ATOM 2069 N ARG A1043 1.630 -17.631 -2.820 1.00 0.00 N ATOM 2070 CA ARG A1043 0.799 -18.808 -2.918 1.00 0.00 C ATOM 2071 C ARG A1043 1.317 -19.674 -4.048 1.00 0.00 C ATOM 2072 O ARG A1043 1.299 -20.903 -3.978 1.00 0.00 O ATOM 2073 CB ARG A1043 -0.664 -18.413 -3.156 1.00 0.00 C ATOM 2074 CG ARG A1043 -0.829 -17.348 -4.229 1.00 0.00 C ATOM 2075 CD ARG A1043 -0.878 -17.921 -5.636 1.00 0.00 C ATOM 2076 NE ARG A1043 -2.071 -18.727 -5.872 1.00 0.00 N ATOM 2077 CZ ARG A1043 -2.645 -18.854 -7.066 1.00 0.00 C ATOM 2078 NH1 ARG A1043 -2.170 -18.188 -8.109 1.00 0.00 N ATOM 2079 NH2 ARG A1043 -3.709 -19.632 -7.214 1.00 0.00 N ATOM 0 H ARG A1043 1.151 -16.756 -3.031 1.00 0.00 H new ATOM 0 HA ARG A1043 0.840 -19.369 -1.984 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -1.231 -19.299 -3.442 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -1.092 -18.048 -2.222 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -1.745 -16.788 -4.039 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -0.003 -16.640 -4.160 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -0.847 -17.105 -6.358 1.00 0.00 H new ATOM 0 HD3 ARG A1043 0.008 -18.532 -5.807 1.00 0.00 H new ATOM 0 HE ARG A1043 -2.487 -19.219 -5.081 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -1.362 -17.576 -7.998 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -2.613 -18.288 -9.023 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -4.089 -20.134 -6.412 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -4.147 -19.728 -8.130 1.00 0.00 H new ATOM 2093 N LEU A1044 1.814 -19.009 -5.083 1.00 0.00 N ATOM 2094 CA LEU A1044 2.381 -19.702 -6.205 1.00 0.00 C ATOM 2095 C LEU A1044 3.638 -20.428 -5.756 1.00 0.00 C ATOM 2096 O LEU A1044 3.732 -21.636 -5.861 1.00 0.00 O ATOM 2097 CB LEU A1044 2.722 -18.730 -7.337 1.00 0.00 C ATOM 2098 CG LEU A1044 3.537 -19.338 -8.482 1.00 0.00 C ATOM 2099 CD1 LEU A1044 2.690 -20.310 -9.289 1.00 0.00 C ATOM 2100 CD2 LEU A1044 4.109 -18.244 -9.369 1.00 0.00 C ATOM 0 H LEU A1044 1.830 -17.992 -5.158 1.00 0.00 H new ATOM 0 HA LEU A1044 1.649 -20.417 -6.582 1.00 0.00 H new ATOM 0 HB2 LEU A1044 1.794 -18.328 -7.744 1.00 0.00 H new ATOM 0 HB3 LEU A1044 3.278 -17.890 -6.920 1.00 0.00 H new ATOM 0 HG LEU A1044 4.370 -19.896 -8.054 1.00 0.00 H new ATOM 0 HD11 LEU A1044 3.289 -20.730 -10.097 1.00 0.00 H new ATOM 0 HD12 LEU A1044 2.341 -21.114 -8.641 1.00 0.00 H new ATOM 0 HD13 LEU A1044 1.833 -19.784 -9.708 1.00 0.00 H new ATOM 0 HD21 LEU A1044 4.685 -18.695 -10.177 1.00 0.00 H new ATOM 0 HD22 LEU A1044 3.295 -17.654 -9.789 1.00 0.00 H new ATOM 0 HD23 LEU A1044 4.758 -17.598 -8.777 1.00 0.00 H new ATOM 2112 N LYS A1045 4.577 -19.650 -5.235 1.00 0.00 N ATOM 2113 CA LYS A1045 5.865 -20.116 -4.765 1.00 0.00 C ATOM 2114 C LYS A1045 5.745 -21.268 -3.784 1.00 0.00 C ATOM 2115 O LYS A1045 6.502 -22.225 -3.873 1.00 0.00 O ATOM 2116 CB LYS A1045 6.600 -18.948 -4.119 1.00 0.00 C ATOM 2117 CG LYS A1045 8.104 -19.106 -4.098 1.00 0.00 C ATOM 2118 CD LYS A1045 8.768 -17.755 -4.248 1.00 0.00 C ATOM 2119 CE LYS A1045 8.581 -16.883 -3.014 1.00 0.00 C ATOM 2120 NZ LYS A1045 9.208 -15.548 -3.185 1.00 0.00 N ATOM 0 H LYS A1045 4.454 -18.643 -5.126 1.00 0.00 H new ATOM 0 HA LYS A1045 6.423 -20.494 -5.621 1.00 0.00 H new ATOM 0 HB2 LYS A1045 6.348 -18.032 -4.654 1.00 0.00 H new ATOM 0 HB3 LYS A1045 6.243 -18.828 -3.096 1.00 0.00 H new ATOM 0 HG2 LYS A1045 8.416 -19.572 -3.163 1.00 0.00 H new ATOM 0 HG3 LYS A1045 8.420 -19.767 -4.905 1.00 0.00 H new ATOM 0 HD2 LYS A1045 9.833 -17.894 -4.435 1.00 0.00 H new ATOM 0 HD3 LYS A1045 8.356 -17.244 -5.118 1.00 0.00 H new ATOM 0 HE2 LYS A1045 7.517 -16.762 -2.812 1.00 0.00 H new ATOM 0 HE3 LYS A1045 9.016 -17.381 -2.147 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 9.060 -14.982 -2.325 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 10.228 -15.662 -3.353 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 8.776 -15.063 -3.997 1.00 0.00 H new ATOM 2134 N MET A1046 4.809 -21.203 -2.848 1.00 0.00 N ATOM 2135 CA MET A1046 4.667 -22.306 -1.911 1.00 0.00 C ATOM 2136 C MET A1046 4.167 -23.578 -2.599 1.00 0.00 C ATOM 2137 O MET A1046 4.341 -24.678 -2.077 1.00 0.00 O ATOM 2138 CB MET A1046 3.771 -21.948 -0.736 1.00 0.00 C ATOM 2139 CG MET A1046 2.445 -21.323 -1.093 1.00 0.00 C ATOM 2140 SD MET A1046 1.231 -21.502 0.228 1.00 0.00 S ATOM 2141 CE MET A1046 1.083 -23.286 0.323 1.00 0.00 C ATOM 0 H MET A1046 4.158 -20.428 -2.719 1.00 0.00 H new ATOM 0 HA MET A1046 5.665 -22.504 -1.520 1.00 0.00 H new ATOM 0 HB2 MET A1046 3.582 -22.852 -0.158 1.00 0.00 H new ATOM 0 HB3 MET A1046 4.313 -21.261 -0.085 1.00 0.00 H new ATOM 0 HG2 MET A1046 2.591 -20.265 -1.310 1.00 0.00 H new ATOM 0 HG3 MET A1046 2.061 -21.785 -2.003 1.00 0.00 H new ATOM 0 HE1 MET A1046 0.072 -23.551 0.634 1.00 0.00 H new ATOM 0 HE2 MET A1046 1.288 -23.721 -0.655 1.00 0.00 H new ATOM 0 HE3 MET A1046 1.799 -23.672 1.049 1.00 0.00 H new ATOM 2151 N ILE A1047 3.550 -23.432 -3.764 1.00 0.00 N ATOM 2152 CA ILE A1047 3.149 -24.588 -4.556 1.00 0.00 C ATOM 2153 C ILE A1047 4.201 -24.922 -5.625 1.00 0.00 C ATOM 2154 O ILE A1047 4.399 -26.087 -5.974 1.00 0.00 O ATOM 2155 CB ILE A1047 1.786 -24.338 -5.242 1.00 0.00 C ATOM 2156 CG1 ILE A1047 0.735 -23.926 -4.207 1.00 0.00 C ATOM 2157 CG2 ILE A1047 1.330 -25.573 -6.005 1.00 0.00 C ATOM 2158 CD1 ILE A1047 0.443 -24.986 -3.161 1.00 0.00 C ATOM 0 H ILE A1047 3.317 -22.530 -4.180 1.00 0.00 H new ATOM 0 HA ILE A1047 3.059 -25.433 -3.873 1.00 0.00 H new ATOM 0 HB ILE A1047 1.907 -23.524 -5.956 1.00 0.00 H new ATOM 0 HG12 ILE A1047 1.072 -23.019 -3.705 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -0.191 -23.678 -4.725 1.00 0.00 H new ATOM 0 HG21 ILE A1047 0.369 -25.373 -6.479 1.00 0.00 H new ATOM 0 HG22 ILE A1047 2.067 -25.822 -6.769 1.00 0.00 H new ATOM 0 HG23 ILE A1047 1.227 -26.410 -5.314 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -0.311 -24.615 -2.467 1.00 0.00 H new ATOM 0 HD12 ILE A1047 0.074 -25.888 -3.650 1.00 0.00 H new ATOM 0 HD13 ILE A1047 1.356 -25.218 -2.614 1.00 0.00 H new ATOM 2170 N SER A1048 4.881 -23.898 -6.133 1.00 0.00 N ATOM 2171 CA SER A1048 5.806 -24.060 -7.249 1.00 0.00 C ATOM 2172 C SER A1048 7.189 -24.519 -6.792 1.00 0.00 C ATOM 2173 O SER A1048 7.902 -25.186 -7.547 1.00 0.00 O ATOM 2174 CB SER A1048 5.922 -22.750 -8.035 1.00 0.00 C ATOM 2175 OG SER A1048 6.381 -21.693 -7.211 1.00 0.00 O ATOM 0 H SER A1048 4.807 -22.942 -5.786 1.00 0.00 H new ATOM 0 HA SER A1048 5.400 -24.839 -7.894 1.00 0.00 H new ATOM 0 HB2 SER A1048 6.607 -22.885 -8.872 1.00 0.00 H new ATOM 0 HB3 SER A1048 4.951 -22.490 -8.457 1.00 0.00 H new ATOM 0 HG SER A1048 6.446 -20.871 -7.740 1.00 0.00 H new ATOM 2181 N GLN A1049 7.581 -24.149 -5.573 1.00 0.00 N ATOM 2182 CA GLN A1049 8.879 -24.547 -5.042 1.00 0.00 C ATOM 2183 C GLN A1049 8.995 -26.058 -4.989 1.00 0.00 C ATOM 2184 O GLN A1049 8.102 -26.745 -4.487 1.00 0.00 O ATOM 2185 CB GLN A1049 9.124 -23.957 -3.651 1.00 0.00 C ATOM 2186 CG GLN A1049 9.552 -22.496 -3.667 1.00 0.00 C ATOM 2187 CD GLN A1049 10.897 -22.271 -4.343 1.00 0.00 C ATOM 2188 OE1 GLN A1049 11.291 -22.999 -5.257 1.00 0.00 O ATOM 2189 NE2 GLN A1049 11.619 -21.257 -3.895 1.00 0.00 N ATOM 0 H GLN A1049 7.021 -23.578 -4.940 1.00 0.00 H new ATOM 0 HA GLN A1049 9.640 -24.154 -5.716 1.00 0.00 H new ATOM 0 HB2 GLN A1049 8.212 -24.052 -3.061 1.00 0.00 H new ATOM 0 HB3 GLN A1049 9.892 -24.545 -3.148 1.00 0.00 H new ATOM 0 HG2 GLN A1049 8.792 -21.907 -4.181 1.00 0.00 H new ATOM 0 HG3 GLN A1049 9.602 -22.128 -2.642 1.00 0.00 H new ATOM 0 HE21 GLN A1049 11.264 -20.674 -3.137 1.00 0.00 H new ATOM 0 HE22 GLN A1049 12.531 -21.058 -4.307 1.00 0.00 H new ATOM 2198 N SER A1050 10.100 -26.572 -5.501 1.00 0.00 N ATOM 2199 CA SER A1050 10.288 -28.004 -5.607 1.00 0.00 C ATOM 2200 C SER A1050 10.694 -28.614 -4.268 1.00 0.00 C ATOM 2201 O SER A1050 10.785 -29.837 -4.143 1.00 0.00 O ATOM 2202 CB SER A1050 11.323 -28.324 -6.692 1.00 0.00 C ATOM 2203 OG SER A1050 12.532 -27.611 -6.484 1.00 0.00 O ATOM 0 H SER A1050 10.881 -26.016 -5.850 1.00 0.00 H new ATOM 0 HA SER A1050 9.336 -28.451 -5.892 1.00 0.00 H new ATOM 0 HB2 SER A1050 11.527 -29.395 -6.697 1.00 0.00 H new ATOM 0 HB3 SER A1050 10.915 -28.073 -7.671 1.00 0.00 H new ATOM 0 HG SER A1050 13.171 -27.838 -7.191 1.00 0.00 H new ATOM 2209 N ARG A1051 10.938 -27.772 -3.263 1.00 0.00 N ATOM 2210 CA ARG A1051 11.263 -28.279 -1.940 1.00 0.00 C ATOM 2211 C ARG A1051 10.912 -27.285 -0.818 1.00 0.00 C ATOM 2212 O ARG A1051 9.903 -27.472 -0.136 1.00 0.00 O ATOM 2213 CB ARG A1051 12.737 -28.706 -1.863 1.00 0.00 C ATOM 2214 CG ARG A1051 13.131 -29.285 -0.516 1.00 0.00 C ATOM 2215 CD ARG A1051 14.572 -29.760 -0.510 1.00 0.00 C ATOM 2216 NE ARG A1051 15.522 -28.664 -0.688 1.00 0.00 N ATOM 2217 CZ ARG A1051 16.677 -28.787 -1.343 1.00 0.00 C ATOM 2218 NH1 ARG A1051 16.980 -29.922 -1.960 1.00 0.00 N ATOM 2219 NH2 ARG A1051 17.525 -27.770 -1.402 1.00 0.00 N ATOM 0 H ARG A1051 10.916 -26.755 -3.341 1.00 0.00 H new ATOM 0 HA ARG A1051 10.640 -29.159 -1.779 1.00 0.00 H new ATOM 0 HB2 ARG A1051 12.934 -29.446 -2.639 1.00 0.00 H new ATOM 0 HB3 ARG A1051 13.368 -27.844 -2.077 1.00 0.00 H new ATOM 0 HG2 ARG A1051 12.993 -28.531 0.259 1.00 0.00 H new ATOM 0 HG3 ARG A1051 12.472 -30.118 -0.271 1.00 0.00 H new ATOM 0 HD2 ARG A1051 14.780 -30.268 0.432 1.00 0.00 H new ATOM 0 HD3 ARG A1051 14.713 -30.492 -1.305 1.00 0.00 H new ATOM 0 HE ARG A1051 15.289 -27.755 -0.289 1.00 0.00 H new ATOM 0 HH11 ARG A1051 16.328 -30.706 -1.935 1.00 0.00 H new ATOM 0 HH12 ARG A1051 17.865 -30.010 -2.460 1.00 0.00 H new ATOM 0 HH21 ARG A1051 17.296 -26.887 -0.945 1.00 0.00 H new ATOM 0 HH22 ARG A1051 18.407 -27.870 -1.904 1.00 0.00 H new ATOM 2233 N PRO A1052 11.699 -26.207 -0.603 1.00 0.00 N ATOM 2234 CA PRO A1052 11.591 -25.406 0.603 1.00 0.00 C ATOM 2235 C PRO A1052 10.755 -24.131 0.450 1.00 0.00 C ATOM 2236 O PRO A1052 11.109 -23.224 -0.311 1.00 0.00 O ATOM 2237 CB PRO A1052 13.054 -25.058 0.871 1.00 0.00 C ATOM 2238 CG PRO A1052 13.717 -25.049 -0.480 1.00 0.00 C ATOM 2239 CD PRO A1052 12.749 -25.661 -1.471 1.00 0.00 C ATOM 0 HA PRO A1052 11.077 -25.943 1.400 1.00 0.00 H new ATOM 0 HB2 PRO A1052 13.144 -24.088 1.359 1.00 0.00 H new ATOM 0 HB3 PRO A1052 13.518 -25.791 1.531 1.00 0.00 H new ATOM 0 HG2 PRO A1052 13.973 -24.031 -0.774 1.00 0.00 H new ATOM 0 HG3 PRO A1052 14.647 -25.616 -0.453 1.00 0.00 H new ATOM 0 HD2 PRO A1052 12.355 -24.917 -2.164 1.00 0.00 H new ATOM 0 HD3 PRO A1052 13.222 -26.438 -2.072 1.00 0.00 H new ATOM 2247 N HIS A1053 9.644 -24.081 1.176 1.00 0.00 N ATOM 2248 CA HIS A1053 8.847 -22.867 1.306 1.00 0.00 C ATOM 2249 C HIS A1053 7.695 -23.116 2.262 1.00 0.00 C ATOM 2250 CB HIS A1053 8.304 -22.391 -0.045 1.00 0.00 C ATOM 2251 CG HIS A1053 7.984 -20.929 -0.053 1.00 0.00 C ATOM 2252 ND1 HIS A1053 8.952 -19.961 0.087 1.00 0.00 N ATOM 2253 CD2 HIS A1053 6.808 -20.263 -0.163 1.00 0.00 C ATOM 2254 CE1 HIS A1053 8.394 -18.771 0.065 1.00 0.00 C ATOM 2255 NE2 HIS A1053 7.096 -18.924 -0.086 1.00 0.00 N ATOM 0 H HIS A1053 9.271 -24.879 1.690 1.00 0.00 H new ATOM 0 HA HIS A1053 9.495 -22.082 1.696 1.00 0.00 H new ATOM 0 HB2 HIS A1053 9.038 -22.603 -0.823 1.00 0.00 H new ATOM 0 HB3 HIS A1053 7.406 -22.957 -0.291 1.00 0.00 H new ATOM 0 HD2 HIS A1053 5.830 -20.703 -0.288 1.00 0.00 H new ATOM 0 HE1 HIS A1053 8.913 -17.828 0.155 1.00 0.00 H new ATOM 0 HE2 HIS A1053 6.413 -18.168 -0.138 1.00 0.00 H new TER 2264 HIS A1053