USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1155 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1045 LYS NZ :NH3+ -161:sc= 1.21 (180deg=-0.0175) USER MOD Set 1.2: A1049 GLN : amide:sc=-0.00991 K(o=1.2,f=-5.1!) USER MOD Set 2.1: A1011 THR OG1 : rot -4:sc= -0.416! USER MOD Set 2.2: A1012 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A1001 LYS NZ :NH3+ 180:sc= 1.27 (180deg=0) USER MOD Set 3.2: A1020 GLN : amide:sc= -0.772 K(o=0.5,f=-3.8) USER MOD Set 4.1: A 954 MET CE :methyl 154:sc= -1.86! (180deg=-3.39!) USER MOD Set 4.2: A1002 MET CE :methyl -179:sc= -5.92! (180deg=-5.95!) USER MOD Set 4.3: A1021 MET CE :methyl 154:sc= -6.18! (180deg=-8.1!) USER MOD Set 5.1: A 944 GLN :FLIP amide:sc= 0.462 F(o=0.38,f=1.1) USER MOD Set 5.2: A 951 TYR OH : rot -130:sc= 0.627 USER MOD Set 6.1: A 940 SER OG : rot 99:sc= 1.12 USER MOD Set 6.2: A1018 LYS NZ :NH3+ -161:sc= -4.34! (180deg=-7.63!) USER MOD Set 7.1: A 928 ASN : amide:sc= -6.82! C(o=-7.2!,f=-18!) USER MOD Set 7.2: A 968 THR OG1 : rot -121:sc= -0.35 USER MOD Single : A 909 SER OG : rot 46:sc= 0.0239 USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 921 SER OG : rot 45:sc= 0.309 USER MOD Single : A 922 ASN : amide:sc= -3.47! C(o=-3.5!,f=-3.6!) USER MOD Single : A 924 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.173) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 38:sc= -1.39! USER MOD Single : A 934 LYS NZ :NH3+ -163:sc= -0.0985 (180deg=-0.397) USER MOD Single : A 939 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -166:sc= -0.048 (180deg=-0.264) USER MOD Single : A 956 LYS NZ :NH3+ -169:sc= 1.08 (180deg=0.536) USER MOD Single : A 964 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 972 SER OG : rot 63:sc= 1.23 USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot 110:sc= -2.66! USER MOD Single : A 981 HIS :FLIP no HD1:sc= -1.03 F(o=-1.9,f=-1) USER MOD Single : A 986 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 988 GLN :FLIP amide:sc= -1.52 F(o=-7!,f=-1.5) USER MOD Single : A 989 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.125) USER MOD Single : A 992 ASN : amide:sc= -0.0933 X(o=-0.093,f=-0.22) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= 0.991 K(o=0.99,f=-0.025) USER MOD Single : A1003 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0188) USER MOD Single : A1006 GLN : amide:sc= -1.13 K(o=-1.1,f=-13!) USER MOD Single : A1007 GLN : amide:sc= -0.322 K(o=-0.32,f=-0.83) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl 156:sc= -0.227 (180deg=-0.975) USER MOD Single : A1014 GLN :FLIP amide:sc= -0.341 F(o=-1.4,f=-0.34) USER MOD Single : A1015 GLN :FLIP amide:sc= -0.0386 F(o=-1.5!,f=-0.039) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1019 LYS NZ :NH3+ -166:sc= -0.0416 (180deg=-0.238) USER MOD Single : A1023 THR OG1 : rot 70:sc= 1.32 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1033 LYS NZ :NH3+ -166:sc= 1.28 (180deg=0.617) USER MOD Single : A1034 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A1041 GLN : amide:sc= 0.76 K(o=0.76,f=-0.12) USER MOD Single : A1046 MET CE :methyl -135:sc= -2.54 (180deg=-3.82) USER MOD Single : A1048 SER OG : rot -28:sc= 0.501 USER MOD Single : A1050 SER OG : rot -49:sc= 0.143 USER MOD Single : A1053 HIS : no HD1:sc= -3.78! X(o=-3.8!,f=-3.4) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 908 1.507 -17.702 -20.588 1.00 0.00 N ATOM 2 CA GLY A 908 2.709 -16.933 -20.183 1.00 0.00 C ATOM 3 C GLY A 908 3.867 -17.159 -21.131 1.00 0.00 C ATOM 4 O GLY A 908 3.913 -16.582 -22.219 1.00 0.00 O ATOM 0 HA2 GLY A 908 2.467 -15.871 -20.151 1.00 0.00 H new ATOM 0 HA3 GLY A 908 3.003 -17.223 -19.174 1.00 0.00 H new ATOM 9 N SER A 909 4.798 -18.007 -20.722 1.00 0.00 N ATOM 10 CA SER A 909 5.956 -18.330 -21.539 1.00 0.00 C ATOM 11 C SER A 909 6.563 -19.663 -21.113 1.00 0.00 C ATOM 12 O SER A 909 7.177 -19.762 -20.050 1.00 0.00 O ATOM 13 CB SER A 909 6.991 -17.205 -21.453 1.00 0.00 C ATOM 14 OG SER A 909 7.135 -16.741 -20.117 1.00 0.00 O ATOM 0 H SER A 909 4.773 -18.487 -19.822 1.00 0.00 H new ATOM 0 HA SER A 909 5.636 -18.426 -22.576 1.00 0.00 H new ATOM 0 HB2 SER A 909 7.952 -17.562 -21.822 1.00 0.00 H new ATOM 0 HB3 SER A 909 6.689 -16.379 -22.097 1.00 0.00 H new ATOM 0 HG SER A 909 7.210 -17.507 -19.511 1.00 0.00 H new ATOM 20 N PRO A 910 6.390 -20.708 -21.944 1.00 0.00 N ATOM 21 CA PRO A 910 6.856 -22.071 -21.642 1.00 0.00 C ATOM 22 C PRO A 910 8.378 -22.183 -21.571 1.00 0.00 C ATOM 23 O PRO A 910 8.911 -23.132 -20.996 1.00 0.00 O ATOM 24 CB PRO A 910 6.325 -22.909 -22.813 1.00 0.00 C ATOM 25 CG PRO A 910 5.281 -22.067 -23.463 1.00 0.00 C ATOM 26 CD PRO A 910 5.707 -20.646 -23.245 1.00 0.00 C ATOM 0 HA PRO A 910 6.502 -22.397 -20.664 1.00 0.00 H new ATOM 0 HB2 PRO A 910 7.123 -23.155 -23.513 1.00 0.00 H new ATOM 0 HB3 PRO A 910 5.906 -23.852 -22.463 1.00 0.00 H new ATOM 0 HG2 PRO A 910 5.203 -22.293 -24.526 1.00 0.00 H new ATOM 0 HG3 PRO A 910 4.300 -22.253 -23.025 1.00 0.00 H new ATOM 0 HD2 PRO A 910 6.372 -20.297 -24.035 1.00 0.00 H new ATOM 0 HD3 PRO A 910 4.855 -19.967 -23.223 1.00 0.00 H new ATOM 34 N GLY A 911 9.071 -21.213 -22.159 1.00 0.00 N ATOM 35 CA GLY A 911 10.522 -21.225 -22.157 1.00 0.00 C ATOM 36 C GLY A 911 11.105 -20.968 -20.780 1.00 0.00 C ATOM 37 O GLY A 911 12.246 -21.340 -20.502 1.00 0.00 O ATOM 0 H GLY A 911 8.652 -20.416 -22.638 1.00 0.00 H new ATOM 0 HA2 GLY A 911 10.874 -22.190 -22.523 1.00 0.00 H new ATOM 0 HA3 GLY A 911 10.889 -20.468 -22.850 1.00 0.00 H new ATOM 40 N ILE A 912 10.317 -20.344 -19.916 1.00 0.00 N ATOM 41 CA ILE A 912 10.765 -20.026 -18.569 1.00 0.00 C ATOM 42 C ILE A 912 10.830 -21.289 -17.717 1.00 0.00 C ATOM 43 O ILE A 912 9.877 -22.071 -17.680 1.00 0.00 O ATOM 44 CB ILE A 912 9.832 -18.991 -17.898 1.00 0.00 C ATOM 45 CG1 ILE A 912 9.828 -17.683 -18.695 1.00 0.00 C ATOM 46 CG2 ILE A 912 10.246 -18.734 -16.456 1.00 0.00 C ATOM 47 CD1 ILE A 912 11.193 -17.039 -18.832 1.00 0.00 C ATOM 0 H ILE A 912 9.363 -20.048 -20.125 1.00 0.00 H new ATOM 0 HA ILE A 912 11.762 -19.592 -18.646 1.00 0.00 H new ATOM 0 HB ILE A 912 8.822 -19.400 -17.890 1.00 0.00 H new ATOM 0 HG12 ILE A 912 9.428 -17.877 -19.690 1.00 0.00 H new ATOM 0 HG13 ILE A 912 9.152 -16.978 -18.212 1.00 0.00 H new ATOM 0 HG21 ILE A 912 9.573 -18.002 -16.009 1.00 0.00 H new ATOM 0 HG22 ILE A 912 10.196 -19.665 -15.892 1.00 0.00 H new ATOM 0 HG23 ILE A 912 11.266 -18.350 -16.433 1.00 0.00 H new ATOM 0 HD11 ILE A 912 11.105 -16.118 -19.409 1.00 0.00 H new ATOM 0 HD12 ILE A 912 11.588 -16.811 -17.842 1.00 0.00 H new ATOM 0 HD13 ILE A 912 11.869 -17.724 -19.343 1.00 0.00 H new ATOM 59 N SER A 913 11.965 -21.486 -17.052 1.00 0.00 N ATOM 60 CA SER A 913 12.180 -22.651 -16.209 1.00 0.00 C ATOM 61 C SER A 913 11.103 -22.760 -15.131 1.00 0.00 C ATOM 62 O SER A 913 11.005 -21.919 -14.235 1.00 0.00 O ATOM 63 CB SER A 913 13.568 -22.580 -15.576 1.00 0.00 C ATOM 64 OG SER A 913 14.571 -22.490 -16.577 1.00 0.00 O ATOM 0 H SER A 913 12.757 -20.844 -17.084 1.00 0.00 H new ATOM 0 HA SER A 913 12.116 -23.544 -16.831 1.00 0.00 H new ATOM 0 HB2 SER A 913 13.628 -21.715 -14.915 1.00 0.00 H new ATOM 0 HB3 SER A 913 13.739 -23.464 -14.961 1.00 0.00 H new ATOM 0 HG SER A 913 15.453 -22.444 -16.153 1.00 0.00 H new ATOM 70 N GLY A 914 10.285 -23.796 -15.243 1.00 0.00 N ATOM 71 CA GLY A 914 9.202 -23.994 -14.308 1.00 0.00 C ATOM 72 C GLY A 914 7.856 -23.990 -15.001 1.00 0.00 C ATOM 73 O GLY A 914 6.893 -24.578 -14.509 1.00 0.00 O ATOM 0 H GLY A 914 10.355 -24.507 -15.971 1.00 0.00 H new ATOM 0 HA2 GLY A 914 9.340 -24.941 -13.787 1.00 0.00 H new ATOM 0 HA3 GLY A 914 9.225 -23.208 -13.553 1.00 0.00 H new ATOM 75 N GLY A 915 7.790 -23.330 -16.149 1.00 0.00 N ATOM 76 CA GLY A 915 6.553 -23.265 -16.901 1.00 0.00 C ATOM 77 C GLY A 915 5.795 -21.974 -16.660 1.00 0.00 C ATOM 78 O GLY A 915 5.066 -21.496 -17.534 1.00 0.00 O ATOM 0 H GLY A 915 8.575 -22.836 -16.574 1.00 0.00 H new ATOM 0 HA2 GLY A 915 6.772 -23.361 -17.964 1.00 0.00 H new ATOM 0 HA3 GLY A 915 5.921 -24.110 -16.629 1.00 0.00 H new ATOM 81 N GLY A 916 5.964 -21.411 -15.472 1.00 0.00 N ATOM 82 CA GLY A 916 5.300 -20.170 -15.132 1.00 0.00 C ATOM 83 C GLY A 916 4.687 -20.221 -13.750 1.00 0.00 C ATOM 84 O GLY A 916 5.204 -20.904 -12.863 1.00 0.00 O ATOM 0 H GLY A 916 6.553 -21.795 -14.733 1.00 0.00 H new ATOM 0 HA2 GLY A 916 6.016 -19.349 -15.182 1.00 0.00 H new ATOM 0 HA3 GLY A 916 4.523 -19.960 -15.867 1.00 0.00 H new ATOM 87 N GLY A 917 3.583 -19.512 -13.571 1.00 0.00 N ATOM 88 CA GLY A 917 2.925 -19.473 -12.283 1.00 0.00 C ATOM 89 C GLY A 917 3.261 -18.216 -11.506 1.00 0.00 C ATOM 90 O GLY A 917 3.892 -17.300 -12.037 1.00 0.00 O ATOM 0 H GLY A 917 3.129 -18.960 -14.299 1.00 0.00 H new ATOM 0 HA2 GLY A 917 1.846 -19.532 -12.426 1.00 0.00 H new ATOM 0 HA3 GLY A 917 3.217 -20.347 -11.701 1.00 0.00 H new ATOM 93 N GLY A 918 2.835 -18.170 -10.252 1.00 0.00 N ATOM 94 CA GLY A 918 3.104 -17.017 -9.419 1.00 0.00 C ATOM 95 C GLY A 918 1.904 -16.100 -9.302 1.00 0.00 C ATOM 96 O GLY A 918 0.793 -16.557 -9.039 1.00 0.00 O ATOM 0 H GLY A 918 2.306 -18.913 -9.796 1.00 0.00 H new ATOM 0 HA2 GLY A 918 3.401 -17.351 -8.425 1.00 0.00 H new ATOM 0 HA3 GLY A 918 3.945 -16.461 -9.833 1.00 0.00 H new ATOM 99 N ILE A 919 2.126 -14.812 -9.526 1.00 0.00 N ATOM 100 CA ILE A 919 1.121 -13.814 -9.396 1.00 0.00 C ATOM 101 C ILE A 919 0.173 -13.868 -10.593 1.00 0.00 C ATOM 102 O ILE A 919 0.627 -13.840 -11.744 1.00 0.00 O ATOM 103 CB ILE A 919 1.829 -12.443 -9.308 1.00 0.00 C ATOM 104 CG1 ILE A 919 0.962 -11.355 -9.876 1.00 0.00 C ATOM 105 CG2 ILE A 919 3.168 -12.448 -10.038 1.00 0.00 C ATOM 106 CD1 ILE A 919 -0.161 -10.904 -8.968 1.00 0.00 C ATOM 0 H ILE A 919 3.034 -14.444 -9.808 1.00 0.00 H new ATOM 0 HA ILE A 919 0.524 -13.979 -8.499 1.00 0.00 H new ATOM 0 HB ILE A 919 2.011 -12.251 -8.251 1.00 0.00 H new ATOM 0 HG12 ILE A 919 1.589 -10.495 -10.111 1.00 0.00 H new ATOM 0 HG13 ILE A 919 0.534 -11.704 -10.816 1.00 0.00 H new ATOM 0 HG21 ILE A 919 3.633 -11.466 -9.952 1.00 0.00 H new ATOM 0 HG22 ILE A 919 3.822 -13.199 -9.594 1.00 0.00 H new ATOM 0 HG23 ILE A 919 3.008 -12.683 -11.090 1.00 0.00 H new ATOM 0 HD11 ILE A 919 -0.733 -10.118 -9.460 1.00 0.00 H new ATOM 0 HD12 ILE A 919 -0.816 -11.748 -8.752 1.00 0.00 H new ATOM 0 HD13 ILE A 919 0.256 -10.521 -8.037 1.00 0.00 H new ATOM 118 N ARG A 920 -1.127 -13.962 -10.344 1.00 0.00 N ATOM 119 CA ARG A 920 -2.077 -14.051 -11.445 1.00 0.00 C ATOM 120 C ARG A 920 -3.519 -13.759 -11.035 1.00 0.00 C ATOM 121 O ARG A 920 -4.359 -13.514 -11.900 1.00 0.00 O ATOM 122 CB ARG A 920 -2.005 -15.435 -12.096 1.00 0.00 C ATOM 123 CG ARG A 920 -2.399 -16.579 -11.173 1.00 0.00 C ATOM 124 CD ARG A 920 -2.234 -17.923 -11.863 1.00 0.00 C ATOM 125 NE ARG A 920 -2.711 -19.035 -11.039 1.00 0.00 N ATOM 126 CZ ARG A 920 -2.044 -20.178 -10.872 1.00 0.00 C ATOM 127 NH1 ARG A 920 -0.848 -20.334 -11.429 1.00 0.00 N ATOM 128 NH2 ARG A 920 -2.570 -21.161 -10.145 1.00 0.00 N ATOM 0 H ARG A 920 -1.541 -13.978 -9.412 1.00 0.00 H new ATOM 0 HA ARG A 920 -1.786 -13.278 -12.156 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -2.656 -15.447 -12.970 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -0.989 -15.604 -12.453 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -1.785 -16.552 -10.273 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -3.435 -16.454 -10.856 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -2.779 -17.913 -12.807 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -1.182 -18.078 -12.104 1.00 0.00 H new ATOM 0 HE ARG A 920 -3.607 -18.929 -10.564 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -0.441 -19.580 -11.983 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -0.336 -21.207 -11.302 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -3.486 -21.042 -9.713 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -2.057 -22.034 -10.020 1.00 0.00 H new ATOM 142 N SER A 921 -3.830 -13.774 -9.746 1.00 0.00 N ATOM 143 CA SER A 921 -5.225 -13.657 -9.342 1.00 0.00 C ATOM 144 C SER A 921 -5.382 -13.057 -7.953 1.00 0.00 C ATOM 145 O SER A 921 -5.220 -13.749 -6.943 1.00 0.00 O ATOM 146 CB SER A 921 -5.894 -15.034 -9.397 1.00 0.00 C ATOM 147 OG SER A 921 -5.130 -15.995 -8.681 1.00 0.00 O ATOM 0 H SER A 921 -3.159 -13.863 -8.983 1.00 0.00 H new ATOM 0 HA SER A 921 -5.711 -12.976 -10.041 1.00 0.00 H new ATOM 0 HB2 SER A 921 -6.897 -14.973 -8.975 1.00 0.00 H new ATOM 0 HB3 SER A 921 -6.003 -15.349 -10.435 1.00 0.00 H new ATOM 0 HG SER A 921 -4.845 -15.614 -7.824 1.00 0.00 H new ATOM 153 N ASN A 922 -5.717 -11.774 -7.895 1.00 0.00 N ATOM 154 CA ASN A 922 -5.946 -11.129 -6.614 1.00 0.00 C ATOM 155 C ASN A 922 -7.151 -10.197 -6.673 1.00 0.00 C ATOM 156 O ASN A 922 -7.319 -9.453 -7.636 1.00 0.00 O ATOM 157 CB ASN A 922 -4.694 -10.384 -6.167 1.00 0.00 C ATOM 158 CG ASN A 922 -4.075 -9.582 -7.304 1.00 0.00 C ATOM 159 OD1 ASN A 922 -3.184 -10.055 -8.003 1.00 0.00 O ATOM 160 ND2 ASN A 922 -4.547 -8.365 -7.509 1.00 0.00 N ATOM 0 H ASN A 922 -5.834 -11.170 -8.708 1.00 0.00 H new ATOM 0 HA ASN A 922 -6.168 -11.900 -5.876 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -4.944 -9.714 -5.344 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -3.963 -11.098 -5.786 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -4.170 -7.792 -8.264 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -5.288 -7.998 -6.912 1.00 0.00 H new ATOM 167 N ASP A 923 -8.014 -10.294 -5.667 1.00 0.00 N ATOM 168 CA ASP A 923 -9.249 -9.501 -5.632 1.00 0.00 C ATOM 169 C ASP A 923 -9.181 -8.302 -4.673 1.00 0.00 C ATOM 170 O ASP A 923 -9.083 -7.155 -5.083 1.00 0.00 O ATOM 171 CB ASP A 923 -10.424 -10.389 -5.215 1.00 0.00 C ATOM 172 CG ASP A 923 -10.444 -11.732 -5.920 1.00 0.00 C ATOM 173 OD1 ASP A 923 -10.826 -11.787 -7.103 1.00 0.00 O ATOM 174 OD2 ASP A 923 -10.073 -12.746 -5.283 1.00 0.00 O ATOM 0 H ASP A 923 -7.886 -10.911 -4.865 1.00 0.00 H new ATOM 0 HA ASP A 923 -9.385 -9.108 -6.640 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -10.382 -10.553 -4.138 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -11.357 -9.865 -5.421 1.00 0.00 H new ATOM 179 N LYS A 924 -9.277 -8.566 -3.392 1.00 0.00 N ATOM 180 CA LYS A 924 -9.431 -7.482 -2.418 1.00 0.00 C ATOM 181 C LYS A 924 -8.174 -6.615 -2.226 1.00 0.00 C ATOM 182 O LYS A 924 -8.258 -5.407 -2.377 1.00 0.00 O ATOM 183 CB LYS A 924 -9.941 -8.000 -1.069 1.00 0.00 C ATOM 184 CG LYS A 924 -9.762 -9.491 -0.871 1.00 0.00 C ATOM 185 CD LYS A 924 -8.312 -9.888 -1.025 1.00 0.00 C ATOM 186 CE LYS A 924 -8.184 -11.359 -1.378 1.00 0.00 C ATOM 187 NZ LYS A 924 -8.913 -12.230 -0.414 1.00 0.00 N ATOM 0 H LYS A 924 -9.253 -9.504 -2.992 1.00 0.00 H new ATOM 0 HA LYS A 924 -10.184 -6.825 -2.853 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -9.420 -7.473 -0.269 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -10.999 -7.756 -0.975 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -10.117 -9.775 0.120 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -10.370 -10.033 -1.595 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -7.846 -9.282 -1.802 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -7.775 -9.685 -0.098 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -8.572 -11.526 -2.383 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -7.130 -11.638 -1.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -8.664 -13.225 -0.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -8.647 -11.971 0.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -9.938 -12.103 -0.538 1.00 0.00 H new ATOM 201 N VAL A 925 -7.013 -7.208 -1.928 1.00 0.00 N ATOM 202 CA VAL A 925 -5.836 -6.413 -1.513 1.00 0.00 C ATOM 203 C VAL A 925 -5.507 -5.310 -2.523 1.00 0.00 C ATOM 204 O VAL A 925 -5.203 -4.179 -2.156 1.00 0.00 O ATOM 205 CB VAL A 925 -4.573 -7.280 -1.303 1.00 0.00 C ATOM 206 CG1 VAL A 925 -3.531 -6.501 -0.524 1.00 0.00 C ATOM 207 CG2 VAL A 925 -4.913 -8.591 -0.607 1.00 0.00 C ATOM 0 H VAL A 925 -6.857 -8.215 -1.963 1.00 0.00 H new ATOM 0 HA VAL A 925 -6.116 -5.965 -0.560 1.00 0.00 H new ATOM 0 HB VAL A 925 -4.160 -7.530 -2.280 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -2.645 -7.120 -0.381 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -3.260 -5.602 -1.077 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -3.938 -6.220 0.447 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -4.005 -9.178 -0.474 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -5.356 -8.382 0.367 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -5.622 -9.153 -1.215 1.00 0.00 H new ATOM 217 N TYR A 926 -5.616 -5.645 -3.790 1.00 0.00 N ATOM 218 CA TYR A 926 -5.335 -4.715 -4.885 1.00 0.00 C ATOM 219 C TYR A 926 -6.504 -3.764 -5.146 1.00 0.00 C ATOM 220 O TYR A 926 -6.288 -2.713 -5.739 1.00 0.00 O ATOM 221 CB TYR A 926 -4.956 -5.462 -6.172 1.00 0.00 C ATOM 222 CG TYR A 926 -6.111 -5.626 -7.124 1.00 0.00 C ATOM 223 CD1 TYR A 926 -7.099 -6.535 -6.847 1.00 0.00 C ATOM 224 CD2 TYR A 926 -6.227 -4.853 -8.271 1.00 0.00 C ATOM 225 CE1 TYR A 926 -8.184 -6.692 -7.668 1.00 0.00 C ATOM 226 CE2 TYR A 926 -7.309 -5.000 -9.116 1.00 0.00 C ATOM 227 CZ TYR A 926 -8.293 -5.921 -8.807 1.00 0.00 C ATOM 228 OH TYR A 926 -9.386 -6.065 -9.633 1.00 0.00 O ATOM 0 H TYR A 926 -5.903 -6.573 -4.101 1.00 0.00 H new ATOM 0 HA TYR A 926 -4.482 -4.114 -4.571 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -4.153 -4.923 -6.674 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -4.565 -6.446 -5.912 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -7.020 -7.143 -5.958 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -5.462 -4.128 -8.505 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -8.949 -7.415 -7.425 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -7.386 -4.401 -10.011 1.00 0.00 H new ATOM 0 HH TYR A 926 -9.308 -5.447 -10.390 1.00 0.00 H new ATOM 238 N GLU A 927 -7.722 -4.080 -4.738 1.00 0.00 N ATOM 239 CA GLU A 927 -8.766 -3.058 -4.788 1.00 0.00 C ATOM 240 C GLU A 927 -8.581 -2.079 -3.624 1.00 0.00 C ATOM 241 O GLU A 927 -9.008 -0.927 -3.709 1.00 0.00 O ATOM 242 CB GLU A 927 -10.180 -3.624 -4.826 1.00 0.00 C ATOM 243 CG GLU A 927 -10.605 -4.161 -3.489 1.00 0.00 C ATOM 244 CD GLU A 927 -12.065 -4.548 -3.423 1.00 0.00 C ATOM 245 OE1 GLU A 927 -12.915 -3.651 -3.253 1.00 0.00 O ATOM 246 OE2 GLU A 927 -12.372 -5.753 -3.520 1.00 0.00 O ATOM 0 H GLU A 927 -8.009 -4.992 -4.383 1.00 0.00 H new ATOM 0 HA GLU A 927 -8.651 -2.527 -5.733 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -10.874 -2.845 -5.142 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -10.233 -4.419 -5.570 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -9.996 -5.033 -3.248 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -10.403 -3.410 -2.725 1.00 0.00 H new ATOM 253 N ASN A 928 -7.928 -2.516 -2.549 1.00 0.00 N ATOM 254 CA ASN A 928 -7.524 -1.604 -1.475 1.00 0.00 C ATOM 255 C ASN A 928 -6.431 -0.687 -2.023 1.00 0.00 C ATOM 256 O ASN A 928 -6.289 0.463 -1.614 1.00 0.00 O ATOM 257 CB ASN A 928 -7.004 -2.374 -0.248 1.00 0.00 C ATOM 258 CG ASN A 928 -7.758 -3.671 0.016 1.00 0.00 C ATOM 259 OD1 ASN A 928 -7.183 -4.636 0.503 1.00 0.00 O ATOM 260 ND2 ASN A 928 -9.048 -3.711 -0.285 1.00 0.00 N ATOM 0 H ASN A 928 -7.667 -3.490 -2.397 1.00 0.00 H new ATOM 0 HA ASN A 928 -8.387 -1.024 -1.149 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.947 -2.599 -0.391 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -7.078 -1.734 0.631 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -9.586 -4.560 -0.112 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -9.503 -2.893 -0.690 1.00 0.00 H new ATOM 267 N VAL A 929 -5.677 -1.228 -2.977 1.00 0.00 N ATOM 268 CA VAL A 929 -4.644 -0.489 -3.703 1.00 0.00 C ATOM 269 C VAL A 929 -5.283 0.346 -4.803 1.00 0.00 C ATOM 270 O VAL A 929 -4.776 1.418 -5.125 1.00 0.00 O ATOM 271 CB VAL A 929 -3.562 -1.402 -4.318 1.00 0.00 C ATOM 272 CG1 VAL A 929 -2.466 -0.581 -4.977 1.00 0.00 C ATOM 273 CG2 VAL A 929 -2.976 -2.325 -3.269 1.00 0.00 C ATOM 0 H VAL A 929 -5.766 -2.201 -3.271 1.00 0.00 H new ATOM 0 HA VAL A 929 -4.148 0.151 -2.973 1.00 0.00 H new ATOM 0 HB VAL A 929 -4.037 -2.012 -5.086 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -1.717 -1.249 -5.402 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -2.897 0.032 -5.769 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -1.997 0.064 -4.233 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -2.216 -2.959 -3.726 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -2.524 -1.732 -2.474 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -3.766 -2.949 -2.852 1.00 0.00 H new ATOM 283 N THR A 930 -6.389 -0.101 -5.355 1.00 0.00 N ATOM 284 CA THR A 930 -7.168 0.754 -6.230 1.00 0.00 C ATOM 285 C THR A 930 -7.548 2.013 -5.452 1.00 0.00 C ATOM 286 O THR A 930 -7.445 3.135 -5.946 1.00 0.00 O ATOM 287 CB THR A 930 -8.437 0.026 -6.721 1.00 0.00 C ATOM 288 OG1 THR A 930 -8.078 -1.238 -7.301 1.00 0.00 O ATOM 289 CG2 THR A 930 -9.197 0.853 -7.745 1.00 0.00 C ATOM 0 H THR A 930 -6.768 -1.038 -5.218 1.00 0.00 H new ATOM 0 HA THR A 930 -6.578 1.016 -7.108 1.00 0.00 H new ATOM 0 HB THR A 930 -9.086 -0.128 -5.859 1.00 0.00 H new ATOM 0 HG1 THR A 930 -7.346 -1.638 -6.786 1.00 0.00 H new ATOM 0 HG21 THR A 930 -10.084 0.308 -8.067 1.00 0.00 H new ATOM 0 HG22 THR A 930 -9.496 1.801 -7.297 1.00 0.00 H new ATOM 0 HG23 THR A 930 -8.556 1.045 -8.606 1.00 0.00 H new ATOM 297 N GLY A 931 -7.957 1.790 -4.209 1.00 0.00 N ATOM 298 CA GLY A 931 -8.275 2.876 -3.308 1.00 0.00 C ATOM 299 C GLY A 931 -7.071 3.733 -2.913 1.00 0.00 C ATOM 300 O GLY A 931 -7.113 4.958 -3.049 1.00 0.00 O ATOM 0 H GLY A 931 -8.075 0.860 -3.806 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -9.024 3.515 -3.776 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -8.726 2.464 -2.405 1.00 0.00 H new ATOM 304 N LEU A 932 -6.001 3.096 -2.431 1.00 0.00 N ATOM 305 CA LEU A 932 -4.828 3.827 -1.925 1.00 0.00 C ATOM 306 C LEU A 932 -4.096 4.619 -3.014 1.00 0.00 C ATOM 307 O LEU A 932 -3.809 5.802 -2.836 1.00 0.00 O ATOM 308 CB LEU A 932 -3.855 2.876 -1.185 1.00 0.00 C ATOM 309 CG LEU A 932 -2.943 1.969 -2.011 1.00 0.00 C ATOM 310 CD1 LEU A 932 -1.611 2.652 -2.298 1.00 0.00 C ATOM 311 CD2 LEU A 932 -2.715 0.663 -1.268 1.00 0.00 C ATOM 0 H LEU A 932 -5.919 2.081 -2.379 1.00 0.00 H new ATOM 0 HA LEU A 932 -5.209 4.560 -1.214 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -3.220 3.487 -0.544 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -4.450 2.239 -0.531 1.00 0.00 H new ATOM 0 HG LEU A 932 -3.428 1.762 -2.965 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -0.980 1.986 -2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -1.787 3.572 -2.855 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -1.112 2.887 -1.358 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -2.065 0.017 -1.858 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -2.246 0.869 -0.306 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -3.671 0.165 -1.106 1.00 0.00 H new ATOM 323 N VAL A 933 -3.800 3.965 -4.143 1.00 0.00 N ATOM 324 CA VAL A 933 -3.038 4.596 -5.226 1.00 0.00 C ATOM 325 C VAL A 933 -3.791 5.785 -5.773 1.00 0.00 C ATOM 326 O VAL A 933 -3.212 6.851 -6.039 1.00 0.00 O ATOM 327 CB VAL A 933 -2.760 3.610 -6.385 1.00 0.00 C ATOM 328 CG1 VAL A 933 -2.137 4.322 -7.582 1.00 0.00 C ATOM 329 CG2 VAL A 933 -1.856 2.487 -5.924 1.00 0.00 C ATOM 0 H VAL A 933 -4.076 3.001 -4.330 1.00 0.00 H new ATOM 0 HA VAL A 933 -2.086 4.914 -4.802 1.00 0.00 H new ATOM 0 HB VAL A 933 -3.717 3.191 -6.697 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -1.954 3.601 -8.379 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -2.817 5.095 -7.940 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -1.194 4.779 -7.283 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -1.672 1.804 -6.753 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -0.909 2.901 -5.578 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -2.335 1.946 -5.108 1.00 0.00 H new ATOM 339 N LYS A 934 -5.089 5.591 -5.927 1.00 0.00 N ATOM 340 CA LYS A 934 -5.954 6.631 -6.441 1.00 0.00 C ATOM 341 C LYS A 934 -5.871 7.866 -5.546 1.00 0.00 C ATOM 342 O LYS A 934 -5.827 8.988 -6.042 1.00 0.00 O ATOM 343 CB LYS A 934 -7.389 6.096 -6.559 1.00 0.00 C ATOM 344 CG LYS A 934 -8.377 7.029 -7.265 1.00 0.00 C ATOM 345 CD LYS A 934 -8.859 8.177 -6.384 1.00 0.00 C ATOM 346 CE LYS A 934 -9.768 7.695 -5.265 1.00 0.00 C ATOM 347 NZ LYS A 934 -10.988 7.023 -5.786 1.00 0.00 N ATOM 0 H LYS A 934 -5.566 4.718 -5.702 1.00 0.00 H new ATOM 0 HA LYS A 934 -5.629 6.929 -7.438 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -7.363 5.147 -7.095 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -7.765 5.886 -5.558 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -7.904 7.439 -8.157 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -9.238 6.450 -7.598 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -7.998 8.691 -5.956 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -9.392 8.904 -6.996 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -9.219 7.004 -4.625 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -10.059 8.542 -4.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -11.703 6.969 -5.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -11.369 7.567 -6.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -10.746 6.063 -6.104 1.00 0.00 H new ATOM 361 N ALA A 935 -5.797 7.665 -4.235 1.00 0.00 N ATOM 362 CA ALA A 935 -5.713 8.783 -3.305 1.00 0.00 C ATOM 363 C ALA A 935 -4.392 9.534 -3.463 1.00 0.00 C ATOM 364 O ALA A 935 -4.347 10.754 -3.328 1.00 0.00 O ATOM 365 CB ALA A 935 -5.883 8.295 -1.871 1.00 0.00 C ATOM 0 H ALA A 935 -5.793 6.745 -3.795 1.00 0.00 H new ATOM 0 HA ALA A 935 -6.522 9.476 -3.536 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.818 9.142 -1.188 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -6.856 7.816 -1.763 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -5.097 7.578 -1.635 1.00 0.00 H new ATOM 371 N VAL A 936 -3.324 8.795 -3.758 1.00 0.00 N ATOM 372 CA VAL A 936 -1.989 9.376 -3.929 1.00 0.00 C ATOM 373 C VAL A 936 -1.996 10.519 -4.945 1.00 0.00 C ATOM 374 O VAL A 936 -1.987 11.687 -4.569 1.00 0.00 O ATOM 375 CB VAL A 936 -0.968 8.307 -4.381 1.00 0.00 C ATOM 376 CG1 VAL A 936 0.420 8.908 -4.533 1.00 0.00 C ATOM 377 CG2 VAL A 936 -0.947 7.141 -3.404 1.00 0.00 C ATOM 0 H VAL A 936 -3.356 7.783 -3.885 1.00 0.00 H new ATOM 0 HA VAL A 936 -1.694 9.770 -2.956 1.00 0.00 H new ATOM 0 HB VAL A 936 -1.279 7.933 -5.356 1.00 0.00 H new ATOM 0 HG11 VAL A 936 1.119 8.134 -4.852 1.00 0.00 H new ATOM 0 HG12 VAL A 936 0.393 9.702 -5.279 1.00 0.00 H new ATOM 0 HG13 VAL A 936 0.745 9.319 -3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -0.222 6.399 -3.739 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -0.667 7.501 -2.414 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -1.937 6.687 -3.358 1.00 0.00 H new ATOM 387 N ILE A 937 -2.039 10.175 -6.219 1.00 0.00 N ATOM 388 CA ILE A 937 -1.941 11.159 -7.305 1.00 0.00 C ATOM 389 C ILE A 937 -3.156 12.093 -7.372 1.00 0.00 C ATOM 390 O ILE A 937 -3.008 13.325 -7.516 1.00 0.00 O ATOM 391 CB ILE A 937 -1.768 10.456 -8.669 1.00 0.00 C ATOM 392 CG1 ILE A 937 -2.873 9.415 -8.891 1.00 0.00 C ATOM 393 CG2 ILE A 937 -0.395 9.803 -8.750 1.00 0.00 C ATOM 394 CD1 ILE A 937 -2.838 8.761 -10.255 1.00 0.00 C ATOM 0 H ILE A 937 -2.142 9.212 -6.539 1.00 0.00 H new ATOM 0 HA ILE A 937 -1.063 11.766 -7.084 1.00 0.00 H new ATOM 0 HB ILE A 937 -1.848 11.205 -9.457 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -2.789 8.642 -8.127 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -3.842 9.894 -8.754 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -0.283 9.310 -9.716 1.00 0.00 H new ATOM 0 HG22 ILE A 937 0.377 10.564 -8.640 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -0.295 9.066 -7.953 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -3.650 8.038 -10.333 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -2.954 9.522 -11.027 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -1.884 8.251 -10.389 1.00 0.00 H new ATOM 406 N GLU A 938 -4.336 11.536 -7.212 1.00 0.00 N ATOM 407 CA GLU A 938 -5.564 12.289 -7.468 1.00 0.00 C ATOM 408 C GLU A 938 -5.729 13.414 -6.464 1.00 0.00 C ATOM 409 O GLU A 938 -6.012 14.553 -6.836 1.00 0.00 O ATOM 410 CB GLU A 938 -6.792 11.379 -7.462 1.00 0.00 C ATOM 411 CG GLU A 938 -6.863 10.452 -8.665 1.00 0.00 C ATOM 412 CD GLU A 938 -7.085 11.196 -9.968 1.00 0.00 C ATOM 413 OE1 GLU A 938 -6.126 11.799 -10.491 1.00 0.00 O ATOM 414 OE2 GLU A 938 -8.219 11.166 -10.487 1.00 0.00 O ATOM 0 H GLU A 938 -4.481 10.573 -6.909 1.00 0.00 H new ATOM 0 HA GLU A 938 -5.478 12.725 -8.463 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.787 10.780 -6.551 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.691 11.995 -7.434 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -5.938 9.880 -8.732 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -7.671 9.736 -8.519 1.00 0.00 H new ATOM 421 N MET A 939 -5.528 13.108 -5.195 1.00 0.00 N ATOM 422 CA MET A 939 -5.622 14.129 -4.171 1.00 0.00 C ATOM 423 C MET A 939 -4.453 15.100 -4.288 1.00 0.00 C ATOM 424 O MET A 939 -4.603 16.283 -3.994 1.00 0.00 O ATOM 425 CB MET A 939 -5.664 13.517 -2.768 1.00 0.00 C ATOM 426 CG MET A 939 -7.024 12.957 -2.366 1.00 0.00 C ATOM 427 SD MET A 939 -7.599 11.630 -3.444 1.00 0.00 S ATOM 428 CE MET A 939 -9.142 11.197 -2.645 1.00 0.00 C ATOM 0 H MET A 939 -5.302 12.174 -4.853 1.00 0.00 H new ATOM 0 HA MET A 939 -6.555 14.671 -4.325 1.00 0.00 H new ATOM 0 HB2 MET A 939 -4.924 12.718 -2.711 1.00 0.00 H new ATOM 0 HB3 MET A 939 -5.369 14.277 -2.044 1.00 0.00 H new ATOM 0 HG2 MET A 939 -6.968 12.585 -1.343 1.00 0.00 H new ATOM 0 HG3 MET A 939 -7.757 13.764 -2.372 1.00 0.00 H new ATOM 0 HE1 MET A 939 -9.621 10.387 -3.194 1.00 0.00 H new ATOM 0 HE2 MET A 939 -8.944 10.875 -1.623 1.00 0.00 H new ATOM 0 HE3 MET A 939 -9.801 12.065 -2.631 1.00 0.00 H new ATOM 438 N SER A 940 -3.320 14.603 -4.807 1.00 0.00 N ATOM 439 CA SER A 940 -2.069 15.360 -4.819 1.00 0.00 C ATOM 440 C SER A 940 -2.238 16.742 -5.413 1.00 0.00 C ATOM 441 O SER A 940 -1.724 17.722 -4.888 1.00 0.00 O ATOM 442 CB SER A 940 -0.994 14.628 -5.619 1.00 0.00 C ATOM 443 OG SER A 940 -0.390 13.621 -4.830 1.00 0.00 O ATOM 0 H SER A 940 -3.250 13.675 -5.225 1.00 0.00 H new ATOM 0 HA SER A 940 -1.767 15.457 -3.776 1.00 0.00 H new ATOM 0 HB2 SER A 940 -1.435 14.184 -6.511 1.00 0.00 H new ATOM 0 HB3 SER A 940 -0.238 15.337 -5.957 1.00 0.00 H new ATOM 0 HG SER A 940 -0.794 12.753 -5.042 1.00 0.00 H new ATOM 449 N SER A 941 -2.944 16.808 -6.536 1.00 0.00 N ATOM 450 CA SER A 941 -3.130 18.066 -7.245 1.00 0.00 C ATOM 451 C SER A 941 -4.551 18.613 -7.085 1.00 0.00 C ATOM 452 O SER A 941 -4.773 19.813 -7.245 1.00 0.00 O ATOM 453 CB SER A 941 -2.840 17.847 -8.733 1.00 0.00 C ATOM 454 OG SER A 941 -1.566 17.250 -8.919 1.00 0.00 O ATOM 0 H SER A 941 -3.396 16.005 -6.974 1.00 0.00 H new ATOM 0 HA SER A 941 -2.443 18.796 -6.818 1.00 0.00 H new ATOM 0 HB2 SER A 941 -3.611 17.211 -9.168 1.00 0.00 H new ATOM 0 HB3 SER A 941 -2.879 18.801 -9.259 1.00 0.00 H new ATOM 0 HG SER A 941 -1.403 17.118 -9.876 1.00 0.00 H new ATOM 460 N LYS A 942 -5.515 17.751 -6.770 1.00 0.00 N ATOM 461 CA LYS A 942 -6.914 18.179 -6.838 1.00 0.00 C ATOM 462 C LYS A 942 -7.325 18.894 -5.559 1.00 0.00 C ATOM 463 O LYS A 942 -7.745 20.051 -5.594 1.00 0.00 O ATOM 464 CB LYS A 942 -7.861 17.022 -7.205 1.00 0.00 C ATOM 465 CG LYS A 942 -9.340 17.402 -7.281 1.00 0.00 C ATOM 466 CD LYS A 942 -10.011 17.370 -5.911 1.00 0.00 C ATOM 467 CE LYS A 942 -11.462 17.824 -5.976 1.00 0.00 C ATOM 468 NZ LYS A 942 -11.591 19.220 -6.470 1.00 0.00 N ATOM 0 H LYS A 942 -5.365 16.786 -6.475 1.00 0.00 H new ATOM 0 HA LYS A 942 -7.002 18.899 -7.652 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -7.556 16.613 -8.168 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -7.742 16.227 -6.469 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -9.436 18.400 -7.708 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -9.856 16.717 -7.953 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -9.965 16.358 -5.509 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -9.461 18.012 -5.223 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -12.021 17.155 -6.631 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -11.910 17.748 -4.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -12.552 19.569 -6.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -10.899 19.826 -5.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -11.413 19.244 -7.494 1.00 0.00 H new ATOM 482 N ILE A 943 -7.211 18.212 -4.435 1.00 0.00 N ATOM 483 CA ILE A 943 -7.601 18.792 -3.161 1.00 0.00 C ATOM 484 C ILE A 943 -6.522 19.766 -2.656 1.00 0.00 C ATOM 485 O ILE A 943 -6.650 20.359 -1.584 1.00 0.00 O ATOM 486 CB ILE A 943 -7.948 17.689 -2.122 1.00 0.00 C ATOM 487 CG1 ILE A 943 -8.543 18.291 -0.844 1.00 0.00 C ATOM 488 CG2 ILE A 943 -6.742 16.830 -1.797 1.00 0.00 C ATOM 489 CD1 ILE A 943 -9.880 18.976 -1.057 1.00 0.00 C ATOM 0 H ILE A 943 -6.853 17.259 -4.377 1.00 0.00 H new ATOM 0 HA ILE A 943 -8.512 19.373 -3.307 1.00 0.00 H new ATOM 0 HB ILE A 943 -8.703 17.048 -2.577 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -8.664 17.501 -0.103 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -7.838 19.011 -0.430 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -7.022 16.070 -1.068 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -6.384 16.346 -2.706 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -5.951 17.455 -1.383 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -10.238 19.377 -0.109 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -9.762 19.789 -1.774 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -10.601 18.255 -1.442 1.00 0.00 H new ATOM 501 N GLN A 944 -5.459 19.923 -3.453 1.00 0.00 N ATOM 502 CA GLN A 944 -4.381 20.868 -3.156 1.00 0.00 C ATOM 503 C GLN A 944 -4.442 22.101 -4.078 1.00 0.00 C ATOM 504 O GLN A 944 -3.685 22.196 -5.049 1.00 0.00 O ATOM 505 CB GLN A 944 -3.027 20.175 -3.329 1.00 0.00 C ATOM 506 CG GLN A 944 -1.829 21.034 -2.958 1.00 0.00 C ATOM 507 CD GLN A 944 -0.513 20.423 -3.407 1.00 0.00 C ATOM 508 OE1 GLN A 944 -0.119 20.719 -4.637 1.00 0.00 O flip ATOM 509 NE2 GLN A 944 0.145 19.692 -2.667 1.00 0.00 N flip ATOM 0 H GLN A 944 -5.324 19.400 -4.318 1.00 0.00 H new ATOM 0 HA GLN A 944 -4.503 21.204 -2.126 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -3.014 19.272 -2.718 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -2.924 19.859 -4.367 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -1.940 22.020 -3.408 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -1.809 21.177 -1.878 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -0.189 19.486 -1.726 1.00 0.00 H new ATOM 0 HE22 GLN A 944 1.024 19.293 -2.995 1.00 0.00 H new ATOM 518 N PRO A 945 -5.353 23.052 -3.813 1.00 0.00 N ATOM 519 CA PRO A 945 -5.465 24.283 -4.581 1.00 0.00 C ATOM 520 C PRO A 945 -4.667 25.423 -3.948 1.00 0.00 C ATOM 521 O PRO A 945 -3.648 25.860 -4.482 1.00 0.00 O ATOM 522 CB PRO A 945 -6.972 24.578 -4.531 1.00 0.00 C ATOM 523 CG PRO A 945 -7.538 23.697 -3.447 1.00 0.00 C ATOM 524 CD PRO A 945 -6.375 23.012 -2.774 1.00 0.00 C ATOM 0 HA PRO A 945 -5.069 24.188 -5.592 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -7.156 25.630 -4.313 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -7.442 24.365 -5.491 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -8.104 24.288 -2.728 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -8.225 22.963 -3.868 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -6.060 23.536 -1.872 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -6.618 21.991 -2.481 1.00 0.00 H new ATOM 532 N ALA A 946 -5.140 25.885 -2.798 1.00 0.00 N ATOM 533 CA ALA A 946 -4.465 26.921 -2.031 1.00 0.00 C ATOM 534 C ALA A 946 -4.451 26.548 -0.542 1.00 0.00 C ATOM 535 O ALA A 946 -3.406 26.631 0.105 1.00 0.00 O ATOM 536 CB ALA A 946 -5.118 28.281 -2.254 1.00 0.00 C ATOM 0 H ALA A 946 -6.004 25.551 -2.371 1.00 0.00 H new ATOM 0 HA ALA A 946 -3.434 26.995 -2.377 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -4.594 29.037 -1.669 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -5.066 28.540 -3.311 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -6.161 28.239 -1.941 1.00 0.00 H new ATOM 542 N PRO A 947 -5.607 26.141 0.038 1.00 0.00 N ATOM 543 CA PRO A 947 -5.635 25.562 1.385 1.00 0.00 C ATOM 544 C PRO A 947 -5.069 24.144 1.386 1.00 0.00 C ATOM 545 O PRO A 947 -4.963 23.518 0.330 1.00 0.00 O ATOM 546 CB PRO A 947 -7.125 25.547 1.736 1.00 0.00 C ATOM 547 CG PRO A 947 -7.818 25.458 0.423 1.00 0.00 C ATOM 548 CD PRO A 947 -6.967 26.238 -0.539 1.00 0.00 C ATOM 0 HA PRO A 947 -5.031 26.124 2.097 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -7.374 24.699 2.374 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -7.414 26.448 2.277 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -7.920 24.421 0.104 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -8.824 25.874 0.482 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -7.007 25.815 -1.543 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -7.296 27.274 -0.616 1.00 0.00 H new ATOM 556 N PRO A 948 -4.692 23.617 2.560 1.00 0.00 N ATOM 557 CA PRO A 948 -4.136 22.267 2.666 1.00 0.00 C ATOM 558 C PRO A 948 -5.137 21.187 2.263 1.00 0.00 C ATOM 559 O PRO A 948 -6.351 21.384 2.334 1.00 0.00 O ATOM 560 CB PRO A 948 -3.771 22.135 4.152 1.00 0.00 C ATOM 561 CG PRO A 948 -4.600 23.160 4.848 1.00 0.00 C ATOM 562 CD PRO A 948 -4.771 24.289 3.871 1.00 0.00 C ATOM 0 HA PRO A 948 -3.288 22.130 1.995 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -3.988 21.134 4.524 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -2.708 22.312 4.314 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -5.566 22.748 5.140 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -4.111 23.504 5.760 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -5.726 24.797 4.006 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -3.991 25.042 3.985 1.00 0.00 H new ATOM 570 N GLU A 949 -4.602 20.046 1.855 1.00 0.00 N ATOM 571 CA GLU A 949 -5.403 18.886 1.461 1.00 0.00 C ATOM 572 C GLU A 949 -5.988 18.189 2.664 1.00 0.00 C ATOM 573 O GLU A 949 -6.606 17.129 2.543 1.00 0.00 O ATOM 574 CB GLU A 949 -4.513 17.904 0.716 1.00 0.00 C ATOM 575 CG GLU A 949 -4.087 18.404 -0.636 1.00 0.00 C ATOM 576 CD GLU A 949 -3.126 17.461 -1.306 1.00 0.00 C ATOM 577 OE1 GLU A 949 -3.452 16.263 -1.449 1.00 0.00 O ATOM 578 OE2 GLU A 949 -2.009 17.899 -1.642 1.00 0.00 O ATOM 0 H GLU A 949 -3.596 19.893 1.786 1.00 0.00 H new ATOM 0 HA GLU A 949 -6.220 19.232 0.828 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -3.627 17.698 1.316 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -5.044 16.960 0.597 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -4.966 18.536 -1.267 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -3.620 19.383 -0.530 1.00 0.00 H new ATOM 585 N GLU A 950 -5.811 18.807 3.817 1.00 0.00 N ATOM 586 CA GLU A 950 -5.997 18.132 5.075 1.00 0.00 C ATOM 587 C GLU A 950 -5.208 16.828 5.031 1.00 0.00 C ATOM 588 O GLU A 950 -5.768 15.739 4.994 1.00 0.00 O ATOM 589 CB GLU A 950 -7.482 17.897 5.365 1.00 0.00 C ATOM 590 CG GLU A 950 -8.142 19.018 6.156 1.00 0.00 C ATOM 591 CD GLU A 950 -7.996 20.377 5.505 1.00 0.00 C ATOM 592 OE1 GLU A 950 -8.771 20.681 4.574 1.00 0.00 O ATOM 593 OE2 GLU A 950 -7.120 21.155 5.935 1.00 0.00 O ATOM 0 H GLU A 950 -5.536 19.786 3.901 1.00 0.00 H new ATOM 0 HA GLU A 950 -5.627 18.751 5.892 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -8.011 17.772 4.420 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -7.591 16.963 5.917 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -9.202 18.793 6.277 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -7.707 19.053 7.155 1.00 0.00 H new ATOM 600 N TYR A 951 -3.900 16.981 4.935 1.00 0.00 N ATOM 601 CA TYR A 951 -2.977 15.866 4.760 1.00 0.00 C ATOM 602 C TYR A 951 -3.159 14.770 5.798 1.00 0.00 C ATOM 603 O TYR A 951 -3.256 13.615 5.437 1.00 0.00 O ATOM 604 CB TYR A 951 -1.539 16.368 4.770 1.00 0.00 C ATOM 605 CG TYR A 951 -1.184 17.183 3.552 1.00 0.00 C ATOM 606 CD1 TYR A 951 -1.673 16.850 2.306 1.00 0.00 C ATOM 607 CD2 TYR A 951 -0.357 18.284 3.647 1.00 0.00 C ATOM 608 CE1 TYR A 951 -1.351 17.599 1.199 1.00 0.00 C ATOM 609 CE2 TYR A 951 -0.031 19.040 2.540 1.00 0.00 C ATOM 610 CZ TYR A 951 -0.529 18.688 1.318 1.00 0.00 C ATOM 611 OH TYR A 951 -0.210 19.432 0.212 1.00 0.00 O ATOM 0 H TYR A 951 -3.440 17.891 4.976 1.00 0.00 H new ATOM 0 HA TYR A 951 -3.206 15.419 3.792 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -1.379 16.973 5.663 1.00 0.00 H new ATOM 0 HB3 TYR A 951 -0.864 15.515 4.837 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -2.317 15.990 2.199 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.044 18.560 4.611 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -1.748 17.328 0.232 1.00 0.00 H new ATOM 0 HE2 TYR A 951 0.612 19.902 2.639 1.00 0.00 H new ATOM 0 HH TYR A 951 0.761 19.557 0.171 1.00 0.00 H new ATOM 621 N VAL A 952 -3.161 15.119 7.075 1.00 0.00 N ATOM 622 CA VAL A 952 -3.456 14.155 8.133 1.00 0.00 C ATOM 623 C VAL A 952 -4.793 13.448 7.880 1.00 0.00 C ATOM 624 O VAL A 952 -4.856 12.226 7.891 1.00 0.00 O ATOM 625 CB VAL A 952 -3.458 14.811 9.533 1.00 0.00 C ATOM 626 CG1 VAL A 952 -3.777 13.783 10.609 1.00 0.00 C ATOM 627 CG2 VAL A 952 -2.120 15.475 9.810 1.00 0.00 C ATOM 0 H VAL A 952 -2.962 16.062 7.408 1.00 0.00 H new ATOM 0 HA VAL A 952 -2.657 13.414 8.113 1.00 0.00 H new ATOM 0 HB VAL A 952 -4.234 15.576 9.552 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -3.773 14.266 11.586 1.00 0.00 H new ATOM 0 HG12 VAL A 952 -4.761 13.353 10.421 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -3.026 12.993 10.592 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -2.138 15.932 10.799 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -1.328 14.727 9.770 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -1.932 16.243 9.059 1.00 0.00 H new ATOM 637 N PRO A 953 -5.895 14.187 7.685 1.00 0.00 N ATOM 638 CA PRO A 953 -7.158 13.586 7.239 1.00 0.00 C ATOM 639 C PRO A 953 -6.994 12.640 6.028 1.00 0.00 C ATOM 640 O PRO A 953 -7.555 11.555 6.000 1.00 0.00 O ATOM 641 CB PRO A 953 -7.972 14.821 6.875 1.00 0.00 C ATOM 642 CG PRO A 953 -7.560 15.801 7.908 1.00 0.00 C ATOM 643 CD PRO A 953 -6.071 15.620 8.014 1.00 0.00 C ATOM 0 HA PRO A 953 -7.613 12.946 7.995 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -7.744 15.174 5.869 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -9.043 14.624 6.909 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -7.818 16.819 7.617 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -8.054 15.607 8.860 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -5.534 16.264 7.318 1.00 0.00 H new ATOM 0 HD3 PRO A 953 -5.704 15.854 9.013 1.00 0.00 H new ATOM 651 N MET A 954 -6.203 13.073 5.042 1.00 0.00 N ATOM 652 CA MET A 954 -5.940 12.304 3.810 1.00 0.00 C ATOM 653 C MET A 954 -5.052 11.080 4.074 1.00 0.00 C ATOM 654 O MET A 954 -5.331 9.976 3.615 1.00 0.00 O ATOM 655 CB MET A 954 -5.288 13.235 2.780 1.00 0.00 C ATOM 656 CG MET A 954 -4.389 12.542 1.766 1.00 0.00 C ATOM 657 SD MET A 954 -5.253 11.344 0.737 1.00 0.00 S ATOM 658 CE MET A 954 -3.875 10.664 -0.178 1.00 0.00 C ATOM 0 H MET A 954 -5.722 13.972 5.071 1.00 0.00 H new ATOM 0 HA MET A 954 -6.887 11.925 3.425 1.00 0.00 H new ATOM 0 HB2 MET A 954 -6.074 13.766 2.243 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.702 13.985 3.310 1.00 0.00 H new ATOM 0 HG2 MET A 954 -3.930 13.295 1.125 1.00 0.00 H new ATOM 0 HG3 MET A 954 -3.580 12.038 2.295 1.00 0.00 H new ATOM 0 HE1 MET A 954 -4.116 9.650 -0.498 1.00 0.00 H new ATOM 0 HE2 MET A 954 -3.678 11.284 -1.053 1.00 0.00 H new ATOM 0 HE3 MET A 954 -2.990 10.643 0.458 1.00 0.00 H new ATOM 668 N VAL A 955 -3.970 11.304 4.786 1.00 0.00 N ATOM 669 CA VAL A 955 -3.132 10.236 5.332 1.00 0.00 C ATOM 670 C VAL A 955 -3.968 9.264 6.169 1.00 0.00 C ATOM 671 O VAL A 955 -3.647 8.078 6.261 1.00 0.00 O ATOM 672 CB VAL A 955 -1.976 10.820 6.179 1.00 0.00 C ATOM 673 CG1 VAL A 955 -2.332 10.939 7.643 1.00 0.00 C ATOM 674 CG2 VAL A 955 -0.719 9.994 5.997 1.00 0.00 C ATOM 0 H VAL A 955 -3.635 12.241 5.010 1.00 0.00 H new ATOM 0 HA VAL A 955 -2.700 9.687 4.495 1.00 0.00 H new ATOM 0 HB VAL A 955 -1.793 11.832 5.818 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -1.486 11.354 8.191 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -3.194 11.596 7.755 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -2.573 9.953 8.040 1.00 0.00 H new ATOM 0 HG21 VAL A 955 0.085 10.417 6.599 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.908 8.969 6.314 1.00 0.00 H new ATOM 0 HG23 VAL A 955 -0.428 10.001 4.947 1.00 0.00 H new ATOM 684 N LYS A 956 -5.030 9.762 6.772 1.00 0.00 N ATOM 685 CA LYS A 956 -6.020 8.902 7.413 1.00 0.00 C ATOM 686 C LYS A 956 -6.807 8.082 6.372 1.00 0.00 C ATOM 687 O LYS A 956 -7.196 6.945 6.635 1.00 0.00 O ATOM 688 CB LYS A 956 -6.951 9.753 8.297 1.00 0.00 C ATOM 689 CG LYS A 956 -8.302 9.124 8.607 1.00 0.00 C ATOM 690 CD LYS A 956 -9.349 9.556 7.594 1.00 0.00 C ATOM 691 CE LYS A 956 -10.673 8.852 7.816 1.00 0.00 C ATOM 692 NZ LYS A 956 -11.696 9.302 6.842 1.00 0.00 N ATOM 0 H LYS A 956 -5.234 10.759 6.834 1.00 0.00 H new ATOM 0 HA LYS A 956 -5.505 8.183 8.050 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -6.441 9.963 9.237 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -7.118 10.711 7.804 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -8.211 8.038 8.601 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -8.620 9.412 9.609 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -9.495 10.634 7.660 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -8.989 9.344 6.587 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -10.533 7.775 7.727 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -11.024 9.045 8.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -12.630 8.948 7.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -11.713 10.341 6.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -11.463 8.932 5.898 1.00 0.00 H new ATOM 706 N GLU A 957 -7.001 8.650 5.180 1.00 0.00 N ATOM 707 CA GLU A 957 -7.791 8.001 4.128 1.00 0.00 C ATOM 708 C GLU A 957 -6.968 6.907 3.447 1.00 0.00 C ATOM 709 O GLU A 957 -7.447 5.799 3.209 1.00 0.00 O ATOM 710 CB GLU A 957 -8.219 9.027 3.069 1.00 0.00 C ATOM 711 CG GLU A 957 -8.792 10.317 3.636 1.00 0.00 C ATOM 712 CD GLU A 957 -10.192 10.163 4.198 1.00 0.00 C ATOM 713 OE1 GLU A 957 -10.671 9.019 4.334 1.00 0.00 O ATOM 714 OE2 GLU A 957 -10.828 11.194 4.508 1.00 0.00 O ATOM 0 H GLU A 957 -6.622 9.560 4.917 1.00 0.00 H new ATOM 0 HA GLU A 957 -8.675 7.563 4.591 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.357 9.270 2.447 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -8.963 8.569 2.418 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -8.132 10.683 4.422 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -8.805 11.074 2.852 1.00 0.00 H new ATOM 721 N VAL A 958 -5.718 7.233 3.142 1.00 0.00 N ATOM 722 CA VAL A 958 -4.806 6.286 2.510 1.00 0.00 C ATOM 723 C VAL A 958 -4.287 5.285 3.538 1.00 0.00 C ATOM 724 O VAL A 958 -3.970 4.141 3.202 1.00 0.00 O ATOM 725 CB VAL A 958 -3.639 7.009 1.792 1.00 0.00 C ATOM 726 CG1 VAL A 958 -2.857 7.892 2.753 1.00 0.00 C ATOM 727 CG2 VAL A 958 -2.717 6.015 1.097 1.00 0.00 C ATOM 0 H VAL A 958 -5.311 8.150 3.323 1.00 0.00 H new ATOM 0 HA VAL A 958 -5.361 5.741 1.747 1.00 0.00 H new ATOM 0 HB VAL A 958 -4.076 7.653 1.029 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -2.046 8.384 2.217 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -3.521 8.645 3.177 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.443 7.280 3.555 1.00 0.00 H new ATOM 0 HG21 VAL A 958 -1.908 6.553 0.602 1.00 0.00 H new ATOM 0 HG22 VAL A 958 -2.299 5.330 1.834 1.00 0.00 H new ATOM 0 HG23 VAL A 958 -3.283 5.450 0.356 1.00 0.00 H new ATOM 737 N GLY A 959 -4.238 5.707 4.795 1.00 0.00 N ATOM 738 CA GLY A 959 -3.955 4.779 5.870 1.00 0.00 C ATOM 739 C GLY A 959 -5.070 3.769 5.997 1.00 0.00 C ATOM 740 O GLY A 959 -4.841 2.597 6.302 1.00 0.00 O ATOM 0 H GLY A 959 -4.389 6.672 5.088 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -3.012 4.267 5.679 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -3.839 5.322 6.808 1.00 0.00 H new ATOM 744 N LEU A 960 -6.287 4.239 5.738 1.00 0.00 N ATOM 745 CA LEU A 960 -7.461 3.384 5.695 1.00 0.00 C ATOM 746 C LEU A 960 -7.342 2.368 4.562 1.00 0.00 C ATOM 747 O LEU A 960 -7.810 1.242 4.681 1.00 0.00 O ATOM 748 CB LEU A 960 -8.725 4.232 5.511 1.00 0.00 C ATOM 749 CG LEU A 960 -10.048 3.470 5.574 1.00 0.00 C ATOM 750 CD1 LEU A 960 -10.359 3.042 6.999 1.00 0.00 C ATOM 751 CD2 LEU A 960 -11.180 4.312 5.006 1.00 0.00 C ATOM 0 H LEU A 960 -6.483 5.223 5.553 1.00 0.00 H new ATOM 0 HA LEU A 960 -7.531 2.844 6.639 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -8.736 5.006 6.278 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -8.664 4.738 4.548 1.00 0.00 H new ATOM 0 HG LEU A 960 -9.951 2.571 4.965 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -11.305 2.502 7.018 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -9.563 2.394 7.366 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -10.432 3.923 7.636 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -12.113 3.751 5.060 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -11.275 5.231 5.584 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -10.964 4.558 3.966 1.00 0.00 H new ATOM 763 N ALA A 961 -6.692 2.755 3.474 1.00 0.00 N ATOM 764 CA ALA A 961 -6.556 1.874 2.327 1.00 0.00 C ATOM 765 C ALA A 961 -5.513 0.796 2.599 1.00 0.00 C ATOM 766 O ALA A 961 -5.821 -0.387 2.516 1.00 0.00 O ATOM 767 CB ALA A 961 -6.215 2.675 1.088 1.00 0.00 C ATOM 0 H ALA A 961 -6.253 3.669 3.363 1.00 0.00 H new ATOM 0 HA ALA A 961 -7.509 1.374 2.152 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -6.116 2.003 0.236 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -7.008 3.396 0.891 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -5.275 3.204 1.244 1.00 0.00 H new ATOM 773 N LEU A 962 -4.278 1.203 2.902 1.00 0.00 N ATOM 774 CA LEU A 962 -3.263 0.273 3.415 1.00 0.00 C ATOM 775 C LEU A 962 -3.816 -0.683 4.459 1.00 0.00 C ATOM 776 O LEU A 962 -3.589 -1.868 4.349 1.00 0.00 O ATOM 777 CB LEU A 962 -2.057 0.998 4.016 1.00 0.00 C ATOM 778 CG LEU A 962 -1.413 0.254 5.198 1.00 0.00 C ATOM 779 CD1 LEU A 962 -0.483 -0.847 4.713 1.00 0.00 C ATOM 780 CD2 LEU A 962 -0.674 1.202 6.120 1.00 0.00 C ATOM 0 H LEU A 962 -3.955 2.165 2.802 1.00 0.00 H new ATOM 0 HA LEU A 962 -2.945 -0.298 2.543 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -1.307 1.144 3.238 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -2.368 1.988 4.348 1.00 0.00 H new ATOM 0 HG LEU A 962 -2.222 -0.204 5.767 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -0.042 -1.355 5.571 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -1.048 -1.564 4.117 1.00 0.00 H new ATOM 0 HD13 LEU A 962 0.309 -0.412 4.103 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -0.233 0.639 6.943 1.00 0.00 H new ATOM 0 HD22 LEU A 962 0.114 1.710 5.564 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -1.371 1.940 6.518 1.00 0.00 H new ATOM 792 N ARG A 963 -4.501 -0.208 5.481 1.00 0.00 N ATOM 793 CA ARG A 963 -4.982 -1.134 6.505 1.00 0.00 C ATOM 794 C ARG A 963 -6.025 -2.084 5.927 1.00 0.00 C ATOM 795 O ARG A 963 -6.152 -3.217 6.383 1.00 0.00 O ATOM 796 CB ARG A 963 -5.552 -0.400 7.702 1.00 0.00 C ATOM 797 CG ARG A 963 -6.934 0.164 7.430 1.00 0.00 C ATOM 798 CD ARG A 963 -7.332 1.210 8.451 1.00 0.00 C ATOM 799 NE ARG A 963 -7.253 0.715 9.821 1.00 0.00 N ATOM 800 CZ ARG A 963 -8.100 1.051 10.791 1.00 0.00 C ATOM 801 NH1 ARG A 963 -9.156 1.817 10.529 1.00 0.00 N ATOM 802 NH2 ARG A 963 -7.893 0.600 12.020 1.00 0.00 N ATOM 0 H ARG A 963 -4.734 0.774 5.629 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.124 -1.714 6.845 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -5.601 -1.080 8.552 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -4.880 0.411 7.981 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -6.956 0.604 6.433 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -7.664 -0.646 7.437 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -6.685 2.081 8.345 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -8.350 1.543 8.247 1.00 0.00 H new ATOM 0 HE ARG A 963 -6.498 0.068 10.051 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -9.321 2.151 9.579 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -9.801 2.070 11.278 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -7.091 0.001 12.215 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -8.536 0.852 12.771 1.00 0.00 H new ATOM 816 N THR A 964 -6.747 -1.638 4.912 1.00 0.00 N ATOM 817 CA THR A 964 -7.656 -2.526 4.213 1.00 0.00 C ATOM 818 C THR A 964 -6.831 -3.550 3.449 1.00 0.00 C ATOM 819 O THR A 964 -7.145 -4.738 3.423 1.00 0.00 O ATOM 820 CB THR A 964 -8.591 -1.771 3.244 1.00 0.00 C ATOM 821 OG1 THR A 964 -9.280 -0.730 3.946 1.00 0.00 O ATOM 822 CG2 THR A 964 -9.612 -2.725 2.650 1.00 0.00 C ATOM 0 H THR A 964 -6.722 -0.681 4.559 1.00 0.00 H new ATOM 0 HA THR A 964 -8.296 -3.012 4.949 1.00 0.00 H new ATOM 0 HB THR A 964 -7.988 -1.341 2.444 1.00 0.00 H new ATOM 0 HG1 THR A 964 -8.717 0.071 3.978 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.265 -2.180 1.968 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.097 -3.516 2.105 1.00 0.00 H new ATOM 0 HG23 THR A 964 -10.208 -3.165 3.450 1.00 0.00 H new ATOM 830 N LEU A 965 -5.737 -3.061 2.887 1.00 0.00 N ATOM 831 CA LEU A 965 -4.782 -3.887 2.160 1.00 0.00 C ATOM 832 C LEU A 965 -4.090 -4.860 3.100 1.00 0.00 C ATOM 833 O LEU A 965 -3.836 -6.014 2.766 1.00 0.00 O ATOM 834 CB LEU A 965 -3.738 -2.987 1.487 1.00 0.00 C ATOM 835 CG LEU A 965 -2.377 -3.644 1.230 1.00 0.00 C ATOM 836 CD1 LEU A 965 -1.937 -3.421 -0.204 1.00 0.00 C ATOM 837 CD2 LEU A 965 -1.330 -3.096 2.187 1.00 0.00 C ATOM 0 H LEU A 965 -5.484 -2.074 2.922 1.00 0.00 H new ATOM 0 HA LEU A 965 -5.318 -4.460 1.403 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -4.141 -2.639 0.536 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -3.586 -2.106 2.110 1.00 0.00 H new ATOM 0 HG LEU A 965 -2.481 -4.716 1.400 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -0.969 -3.895 -0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -2.672 -3.856 -0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -1.854 -2.351 -0.397 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.371 -3.574 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -1.235 -2.019 2.045 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.633 -3.301 3.214 1.00 0.00 H new ATOM 849 N LEU A 966 -3.786 -4.379 4.288 1.00 0.00 N ATOM 850 CA LEU A 966 -2.996 -5.134 5.218 1.00 0.00 C ATOM 851 C LEU A 966 -3.860 -6.204 5.838 1.00 0.00 C ATOM 852 O LEU A 966 -3.420 -7.321 6.053 1.00 0.00 O ATOM 853 CB LEU A 966 -2.396 -4.197 6.281 1.00 0.00 C ATOM 854 CG LEU A 966 -1.411 -4.824 7.278 1.00 0.00 C ATOM 855 CD1 LEU A 966 -0.472 -3.759 7.821 1.00 0.00 C ATOM 856 CD2 LEU A 966 -2.148 -5.489 8.433 1.00 0.00 C ATOM 0 H LEU A 966 -4.079 -3.463 4.627 1.00 0.00 H new ATOM 0 HA LEU A 966 -2.165 -5.617 4.704 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -1.887 -3.382 5.767 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -3.216 -3.755 6.846 1.00 0.00 H new ATOM 0 HG LEU A 966 -0.836 -5.585 6.750 1.00 0.00 H new ATOM 0 HD11 LEU A 966 0.223 -4.213 8.527 1.00 0.00 H new ATOM 0 HD12 LEU A 966 0.086 -3.313 6.998 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -1.051 -2.987 8.327 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -1.425 -5.924 9.123 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -2.748 -4.746 8.958 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -2.798 -6.273 8.046 1.00 0.00 H new ATOM 868 N ALA A 967 -5.104 -5.838 6.111 1.00 0.00 N ATOM 869 CA ALA A 967 -6.071 -6.761 6.668 1.00 0.00 C ATOM 870 C ALA A 967 -6.499 -7.797 5.643 1.00 0.00 C ATOM 871 O ALA A 967 -6.787 -8.917 6.016 1.00 0.00 O ATOM 872 CB ALA A 967 -7.279 -6.027 7.225 1.00 0.00 C ATOM 0 H ALA A 967 -5.466 -4.898 5.952 1.00 0.00 H new ATOM 0 HA ALA A 967 -5.584 -7.283 7.492 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -7.986 -6.748 7.635 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -6.959 -5.344 8.012 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -7.760 -5.461 6.428 1.00 0.00 H new ATOM 878 N THR A 968 -6.531 -7.450 4.363 1.00 0.00 N ATOM 879 CA THR A 968 -6.837 -8.444 3.341 1.00 0.00 C ATOM 880 C THR A 968 -5.697 -9.455 3.227 1.00 0.00 C ATOM 881 O THR A 968 -5.930 -10.654 3.091 1.00 0.00 O ATOM 882 CB THR A 968 -7.122 -7.798 1.970 1.00 0.00 C ATOM 883 OG1 THR A 968 -6.151 -6.794 1.691 1.00 0.00 O ATOM 884 CG2 THR A 968 -8.512 -7.189 1.931 1.00 0.00 C ATOM 0 H THR A 968 -6.353 -6.509 4.012 1.00 0.00 H new ATOM 0 HA THR A 968 -7.745 -8.961 3.650 1.00 0.00 H new ATOM 0 HB THR A 968 -7.066 -8.579 1.212 1.00 0.00 H new ATOM 0 HG1 THR A 968 -6.599 -5.932 1.562 1.00 0.00 H new ATOM 0 HG21 THR A 968 -8.686 -6.741 0.953 1.00 0.00 H new ATOM 0 HG22 THR A 968 -9.255 -7.966 2.111 1.00 0.00 H new ATOM 0 HG23 THR A 968 -8.595 -6.422 2.701 1.00 0.00 H new ATOM 892 N VAL A 969 -4.466 -8.962 3.312 1.00 0.00 N ATOM 893 CA VAL A 969 -3.285 -9.831 3.351 1.00 0.00 C ATOM 894 C VAL A 969 -3.191 -10.572 4.689 1.00 0.00 C ATOM 895 O VAL A 969 -2.915 -11.772 4.717 1.00 0.00 O ATOM 896 CB VAL A 969 -1.975 -9.052 3.104 1.00 0.00 C ATOM 897 CG1 VAL A 969 -0.771 -9.973 3.191 1.00 0.00 C ATOM 898 CG2 VAL A 969 -2.007 -8.366 1.755 1.00 0.00 C ATOM 0 H VAL A 969 -4.255 -7.965 3.355 1.00 0.00 H new ATOM 0 HA VAL A 969 -3.408 -10.553 2.543 1.00 0.00 H new ATOM 0 HB VAL A 969 -1.887 -8.293 3.881 1.00 0.00 H new ATOM 0 HG11 VAL A 969 0.139 -9.400 3.013 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -0.728 -10.423 4.183 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -0.858 -10.758 2.440 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -1.075 -7.823 1.601 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -2.126 -9.113 0.970 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -2.843 -7.668 1.722 1.00 0.00 H new ATOM 908 N ASP A 970 -3.488 -9.884 5.780 1.00 0.00 N ATOM 909 CA ASP A 970 -3.410 -10.496 7.109 1.00 0.00 C ATOM 910 C ASP A 970 -4.442 -11.600 7.196 1.00 0.00 C ATOM 911 O ASP A 970 -4.173 -12.712 7.660 1.00 0.00 O ATOM 912 CB ASP A 970 -3.662 -9.457 8.207 1.00 0.00 C ATOM 913 CG ASP A 970 -3.801 -10.069 9.588 1.00 0.00 C ATOM 914 OD1 ASP A 970 -2.788 -10.535 10.145 1.00 0.00 O ATOM 915 OD2 ASP A 970 -4.929 -10.076 10.126 1.00 0.00 O ATOM 0 H ASP A 970 -3.784 -8.908 5.779 1.00 0.00 H new ATOM 0 HA ASP A 970 -2.410 -10.903 7.257 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -2.841 -8.740 8.215 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -4.569 -8.900 7.970 1.00 0.00 H new ATOM 920 N GLU A 971 -5.613 -11.282 6.681 1.00 0.00 N ATOM 921 CA GLU A 971 -6.707 -12.215 6.612 1.00 0.00 C ATOM 922 C GLU A 971 -6.306 -13.401 5.750 1.00 0.00 C ATOM 923 O GLU A 971 -6.622 -14.540 6.059 1.00 0.00 O ATOM 924 CB GLU A 971 -7.908 -11.495 6.019 1.00 0.00 C ATOM 925 CG GLU A 971 -9.188 -12.313 5.979 1.00 0.00 C ATOM 926 CD GLU A 971 -9.729 -12.620 7.357 1.00 0.00 C ATOM 927 OE1 GLU A 971 -10.297 -11.705 7.993 1.00 0.00 O ATOM 928 OE2 GLU A 971 -9.603 -13.778 7.806 1.00 0.00 O ATOM 0 H GLU A 971 -5.828 -10.362 6.298 1.00 0.00 H new ATOM 0 HA GLU A 971 -6.962 -12.588 7.604 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -8.091 -10.588 6.596 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -7.662 -11.183 5.004 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -9.943 -11.771 5.410 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -9.000 -13.248 5.451 1.00 0.00 H new ATOM 935 N SER A 972 -5.566 -13.113 4.684 1.00 0.00 N ATOM 936 CA SER A 972 -5.082 -14.138 3.767 1.00 0.00 C ATOM 937 C SER A 972 -4.109 -15.093 4.449 1.00 0.00 C ATOM 938 O SER A 972 -3.903 -16.208 3.964 1.00 0.00 O ATOM 939 CB SER A 972 -4.417 -13.501 2.545 1.00 0.00 C ATOM 940 OG SER A 972 -5.375 -12.857 1.723 1.00 0.00 O ATOM 0 H SER A 972 -5.286 -12.165 4.432 1.00 0.00 H new ATOM 0 HA SER A 972 -5.948 -14.714 3.442 1.00 0.00 H new ATOM 0 HB2 SER A 972 -3.667 -12.779 2.869 1.00 0.00 H new ATOM 0 HB3 SER A 972 -3.895 -14.266 1.970 1.00 0.00 H new ATOM 0 HG SER A 972 -5.795 -12.125 2.222 1.00 0.00 H new ATOM 946 N LEU A 973 -3.539 -14.683 5.582 1.00 0.00 N ATOM 947 CA LEU A 973 -2.591 -15.527 6.296 1.00 0.00 C ATOM 948 C LEU A 973 -3.311 -16.765 6.852 1.00 0.00 C ATOM 949 O LEU A 973 -2.878 -17.889 6.596 1.00 0.00 O ATOM 950 CB LEU A 973 -1.894 -14.717 7.411 1.00 0.00 C ATOM 951 CG LEU A 973 -0.732 -15.404 8.140 1.00 0.00 C ATOM 952 CD1 LEU A 973 0.161 -14.361 8.791 1.00 0.00 C ATOM 953 CD2 LEU A 973 -1.238 -16.372 9.199 1.00 0.00 C ATOM 0 H LEU A 973 -3.717 -13.779 6.019 1.00 0.00 H new ATOM 0 HA LEU A 973 -1.818 -15.872 5.609 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -1.521 -13.790 6.975 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -2.645 -14.442 8.152 1.00 0.00 H new ATOM 0 HG LEU A 973 -0.162 -15.969 7.403 1.00 0.00 H new ATOM 0 HD11 LEU A 973 0.983 -14.857 9.306 1.00 0.00 H new ATOM 0 HD12 LEU A 973 0.561 -13.696 8.026 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -0.420 -13.781 9.508 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -0.390 -16.842 9.697 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -1.835 -15.830 9.932 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -1.852 -17.139 8.727 1.00 0.00 H new ATOM 965 N PRO A 974 -4.416 -16.596 7.616 1.00 0.00 N ATOM 966 CA PRO A 974 -5.246 -17.732 8.034 1.00 0.00 C ATOM 967 C PRO A 974 -6.228 -18.209 6.958 1.00 0.00 C ATOM 968 O PRO A 974 -6.751 -19.322 7.053 1.00 0.00 O ATOM 969 CB PRO A 974 -6.031 -17.198 9.236 1.00 0.00 C ATOM 970 CG PRO A 974 -5.464 -15.848 9.527 1.00 0.00 C ATOM 971 CD PRO A 974 -4.889 -15.360 8.235 1.00 0.00 C ATOM 0 HA PRO A 974 -4.619 -18.597 8.249 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -7.095 -17.134 9.010 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -5.926 -17.859 10.096 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -6.236 -15.170 9.892 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -4.697 -15.904 10.300 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -5.637 -14.858 7.621 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.078 -14.649 8.394 1.00 0.00 H new ATOM 979 N VAL A 975 -6.493 -17.377 5.950 1.00 0.00 N ATOM 980 CA VAL A 975 -7.451 -17.736 4.899 1.00 0.00 C ATOM 981 C VAL A 975 -7.062 -19.030 4.183 1.00 0.00 C ATOM 982 O VAL A 975 -7.748 -20.040 4.340 1.00 0.00 O ATOM 983 CB VAL A 975 -7.684 -16.593 3.868 1.00 0.00 C ATOM 984 CG1 VAL A 975 -8.186 -17.129 2.532 1.00 0.00 C ATOM 985 CG2 VAL A 975 -8.700 -15.600 4.410 1.00 0.00 C ATOM 0 H VAL A 975 -6.064 -16.459 5.838 1.00 0.00 H new ATOM 0 HA VAL A 975 -8.397 -17.902 5.415 1.00 0.00 H new ATOM 0 HB VAL A 975 -6.724 -16.103 3.707 1.00 0.00 H new ATOM 0 HG11 VAL A 975 -8.336 -16.300 1.841 1.00 0.00 H new ATOM 0 HG12 VAL A 975 -7.451 -17.819 2.117 1.00 0.00 H new ATOM 0 HG13 VAL A 975 -9.130 -17.652 2.682 1.00 0.00 H new ATOM 0 HG21 VAL A 975 -8.856 -14.805 3.681 1.00 0.00 H new ATOM 0 HG22 VAL A 975 -9.644 -16.111 4.597 1.00 0.00 H new ATOM 0 HG23 VAL A 975 -8.329 -15.172 5.341 1.00 0.00 H new ATOM 995 N LEU A 976 -5.967 -19.038 3.425 1.00 0.00 N ATOM 996 CA LEU A 976 -5.676 -20.220 2.605 1.00 0.00 C ATOM 997 C LEU A 976 -4.185 -20.506 2.470 1.00 0.00 C ATOM 998 O LEU A 976 -3.741 -21.594 2.839 1.00 0.00 O ATOM 999 CB LEU A 976 -6.309 -20.105 1.206 1.00 0.00 C ATOM 1000 CG LEU A 976 -7.828 -20.283 1.146 1.00 0.00 C ATOM 1001 CD1 LEU A 976 -8.330 -20.045 -0.267 1.00 0.00 C ATOM 1002 CD2 LEU A 976 -8.222 -21.673 1.623 1.00 0.00 C ATOM 0 H LEU A 976 -5.291 -18.277 3.358 1.00 0.00 H new ATOM 0 HA LEU A 976 -6.123 -21.060 3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -6.060 -19.127 0.795 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -5.849 -20.850 0.557 1.00 0.00 H new ATOM 0 HG LEU A 976 -8.289 -19.550 1.808 1.00 0.00 H new ATOM 0 HD11 LEU A 976 -9.412 -20.175 -0.295 1.00 0.00 H new ATOM 0 HD12 LEU A 976 -8.078 -19.031 -0.577 1.00 0.00 H new ATOM 0 HD13 LEU A 976 -7.861 -20.758 -0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -9.305 -21.781 1.573 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -7.753 -22.423 0.986 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -7.890 -21.812 2.652 1.00 0.00 H new ATOM 1014 N PRO A 977 -3.395 -19.558 1.926 1.00 0.00 N ATOM 1015 CA PRO A 977 -1.984 -19.803 1.596 1.00 0.00 C ATOM 1016 C PRO A 977 -1.161 -20.322 2.782 1.00 0.00 C ATOM 1017 O PRO A 977 -0.723 -19.554 3.641 1.00 0.00 O ATOM 1018 CB PRO A 977 -1.486 -18.432 1.143 1.00 0.00 C ATOM 1019 CG PRO A 977 -2.701 -17.710 0.689 1.00 0.00 C ATOM 1020 CD PRO A 977 -3.797 -18.175 1.595 1.00 0.00 C ATOM 0 HA PRO A 977 -1.879 -20.583 0.842 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -0.994 -17.902 1.959 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -0.758 -18.524 0.337 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -2.566 -16.631 0.757 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -2.928 -17.938 -0.352 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -3.874 -17.553 2.487 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -4.768 -18.145 1.101 1.00 0.00 H new ATOM 1028 N ALA A 978 -0.957 -21.636 2.811 1.00 0.00 N ATOM 1029 CA ALA A 978 -0.224 -22.285 3.889 1.00 0.00 C ATOM 1030 C ALA A 978 1.269 -22.040 3.750 1.00 0.00 C ATOM 1031 O ALA A 978 1.839 -22.250 2.683 1.00 0.00 O ATOM 1032 CB ALA A 978 -0.519 -23.775 3.906 1.00 0.00 C ATOM 0 H ALA A 978 -1.294 -22.276 2.092 1.00 0.00 H new ATOM 0 HA ALA A 978 -0.553 -21.854 4.835 1.00 0.00 H new ATOM 0 HB1 ALA A 978 0.036 -24.247 4.717 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -1.587 -23.933 4.057 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -0.218 -24.216 2.956 1.00 0.00 H new ATOM 1038 N SER A 979 1.879 -21.564 4.834 1.00 0.00 N ATOM 1039 CA SER A 979 3.305 -21.212 4.867 1.00 0.00 C ATOM 1040 C SER A 979 3.638 -20.078 3.893 1.00 0.00 C ATOM 1041 O SER A 979 4.778 -19.629 3.810 1.00 0.00 O ATOM 1042 CB SER A 979 4.180 -22.439 4.613 1.00 0.00 C ATOM 1043 OG SER A 979 3.860 -23.485 5.518 1.00 0.00 O ATOM 0 H SER A 979 1.399 -21.409 5.721 1.00 0.00 H new ATOM 0 HA SER A 979 3.525 -20.845 5.870 1.00 0.00 H new ATOM 0 HB2 SER A 979 4.041 -22.784 3.588 1.00 0.00 H new ATOM 0 HB3 SER A 979 5.231 -22.170 4.719 1.00 0.00 H new ATOM 0 HG SER A 979 4.431 -24.261 5.336 1.00 0.00 H new ATOM 1049 N THR A 980 2.630 -19.599 3.184 1.00 0.00 N ATOM 1050 CA THR A 980 2.725 -18.346 2.465 1.00 0.00 C ATOM 1051 C THR A 980 2.687 -17.213 3.481 1.00 0.00 C ATOM 1052 O THR A 980 3.037 -16.071 3.199 1.00 0.00 O ATOM 1053 CB THR A 980 1.554 -18.220 1.478 1.00 0.00 C ATOM 1054 OG1 THR A 980 1.635 -19.253 0.493 1.00 0.00 O ATOM 1055 CG2 THR A 980 1.520 -16.864 0.798 1.00 0.00 C ATOM 0 H THR A 980 1.728 -20.067 3.092 1.00 0.00 H new ATOM 0 HA THR A 980 3.654 -18.303 1.897 1.00 0.00 H new ATOM 0 HB THR A 980 0.632 -18.323 2.051 1.00 0.00 H new ATOM 0 HG1 THR A 980 0.911 -19.898 0.635 1.00 0.00 H new ATOM 0 HG21 THR A 980 0.675 -16.823 0.110 1.00 0.00 H new ATOM 0 HG22 THR A 980 1.414 -16.082 1.550 1.00 0.00 H new ATOM 0 HG23 THR A 980 2.446 -16.711 0.244 1.00 0.00 H new ATOM 1063 N HIS A 981 2.277 -17.584 4.687 1.00 0.00 N ATOM 1064 CA HIS A 981 2.183 -16.665 5.821 1.00 0.00 C ATOM 1065 C HIS A 981 3.467 -15.880 6.073 1.00 0.00 C ATOM 1066 O HIS A 981 3.400 -14.805 6.638 1.00 0.00 O ATOM 1067 CB HIS A 981 1.738 -17.398 7.101 1.00 0.00 C ATOM 1068 CG HIS A 981 2.610 -18.533 7.553 1.00 0.00 C ATOM 1069 ND1 HIS A 981 3.942 -18.602 7.770 1.00 0.00 N flip ATOM 1070 CD2 HIS A 981 2.106 -19.769 7.887 1.00 0.00 C flip ATOM 1071 CE1 HIS A 981 4.214 -19.868 8.228 1.00 0.00 C flip ATOM 1072 NE2 HIS A 981 3.091 -20.552 8.291 1.00 0.00 N flip ATOM 0 H HIS A 981 1.997 -18.539 4.911 1.00 0.00 H new ATOM 0 HA HIS A 981 1.420 -15.936 5.548 1.00 0.00 H new ATOM 0 HB2 HIS A 981 1.678 -16.669 7.909 1.00 0.00 H new ATOM 0 HB3 HIS A 981 0.730 -17.782 6.943 1.00 0.00 H new ATOM 0 HD2 HIS A 981 1.066 -20.055 7.828 1.00 0.00 H new ATOM 0 HE1 HIS A 981 5.192 -20.242 8.494 1.00 0.00 H new ATOM 0 HE2 HIS A 981 2.997 -21.520 8.599 1.00 0.00 H new ATOM 1081 N ARG A 982 4.620 -16.372 5.637 1.00 0.00 N ATOM 1082 CA ARG A 982 5.863 -15.620 5.840 1.00 0.00 C ATOM 1083 C ARG A 982 6.035 -14.557 4.758 1.00 0.00 C ATOM 1084 O ARG A 982 6.741 -13.570 4.966 1.00 0.00 O ATOM 1085 CB ARG A 982 7.093 -16.527 5.936 1.00 0.00 C ATOM 1086 CG ARG A 982 7.221 -17.485 4.756 1.00 0.00 C ATOM 1087 CD ARG A 982 8.577 -18.172 4.719 1.00 0.00 C ATOM 1088 NE ARG A 982 9.641 -17.261 4.302 1.00 0.00 N ATOM 1089 CZ ARG A 982 10.902 -17.632 4.079 1.00 0.00 C ATOM 1090 NH1 ARG A 982 11.253 -18.907 4.168 1.00 0.00 N ATOM 1091 NH2 ARG A 982 11.807 -16.731 3.723 1.00 0.00 N ATOM 0 H ARG A 982 4.726 -17.263 5.153 1.00 0.00 H new ATOM 0 HA ARG A 982 5.779 -15.118 6.804 1.00 0.00 H new ATOM 0 HB2 ARG A 982 7.989 -15.909 5.994 1.00 0.00 H new ATOM 0 HB3 ARG A 982 7.042 -17.103 6.860 1.00 0.00 H new ATOM 0 HG2 ARG A 982 6.435 -18.238 4.815 1.00 0.00 H new ATOM 0 HG3 ARG A 982 7.068 -16.937 3.827 1.00 0.00 H new ATOM 0 HD2 ARG A 982 8.808 -18.571 5.706 1.00 0.00 H new ATOM 0 HD3 ARG A 982 8.536 -19.019 4.034 1.00 0.00 H new ATOM 0 HE ARG A 982 9.403 -16.277 4.173 1.00 0.00 H new ATOM 0 HH11 ARG A 982 10.556 -19.612 4.409 1.00 0.00 H new ATOM 0 HH12 ARG A 982 12.220 -19.183 3.996 1.00 0.00 H new ATOM 0 HH21 ARG A 982 11.539 -15.752 3.619 1.00 0.00 H new ATOM 0 HH22 ARG A 982 12.771 -17.016 3.553 1.00 0.00 H new ATOM 1105 N GLU A 983 5.376 -14.719 3.628 1.00 0.00 N ATOM 1106 CA GLU A 983 5.288 -13.643 2.657 1.00 0.00 C ATOM 1107 C GLU A 983 4.241 -12.649 3.110 1.00 0.00 C ATOM 1108 O GLU A 983 4.380 -11.442 2.923 1.00 0.00 O ATOM 1109 CB GLU A 983 4.922 -14.183 1.289 1.00 0.00 C ATOM 1110 CG GLU A 983 6.030 -14.019 0.271 1.00 0.00 C ATOM 1111 CD GLU A 983 7.365 -14.513 0.772 1.00 0.00 C ATOM 1112 OE1 GLU A 983 7.395 -15.532 1.492 1.00 0.00 O ATOM 1113 OE2 GLU A 983 8.394 -13.900 0.424 1.00 0.00 O ATOM 0 H GLU A 983 4.896 -15.578 3.359 1.00 0.00 H new ATOM 0 HA GLU A 983 6.259 -13.153 2.584 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.671 -15.240 1.377 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.028 -13.672 0.930 1.00 0.00 H new ATOM 0 HG2 GLU A 983 5.765 -14.561 -0.637 1.00 0.00 H new ATOM 0 HG3 GLU A 983 6.116 -12.966 0.001 1.00 0.00 H new ATOM 1120 N ILE A 984 3.213 -13.180 3.748 1.00 0.00 N ATOM 1121 CA ILE A 984 2.116 -12.381 4.254 1.00 0.00 C ATOM 1122 C ILE A 984 2.630 -11.565 5.427 1.00 0.00 C ATOM 1123 O ILE A 984 2.215 -10.425 5.636 1.00 0.00 O ATOM 1124 CB ILE A 984 0.929 -13.279 4.684 1.00 0.00 C ATOM 1125 CG1 ILE A 984 0.295 -13.972 3.467 1.00 0.00 C ATOM 1126 CG2 ILE A 984 -0.110 -12.477 5.451 1.00 0.00 C ATOM 1127 CD1 ILE A 984 -0.473 -15.229 3.806 1.00 0.00 C ATOM 0 H ILE A 984 3.117 -14.179 3.929 1.00 0.00 H new ATOM 0 HA ILE A 984 1.748 -11.718 3.471 1.00 0.00 H new ATOM 0 HB ILE A 984 1.317 -14.051 5.348 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -0.377 -13.271 2.972 1.00 0.00 H new ATOM 0 HG13 ILE A 984 1.080 -14.220 2.753 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -0.933 -13.131 5.741 1.00 0.00 H new ATOM 0 HG22 ILE A 984 0.347 -12.050 6.344 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -0.490 -11.675 4.819 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -0.889 -15.658 2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 984 0.198 -15.950 4.273 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -1.282 -14.986 4.495 1.00 0.00 H new ATOM 1139 N GLU A 985 3.598 -12.128 6.122 1.00 0.00 N ATOM 1140 CA GLU A 985 4.273 -11.433 7.191 1.00 0.00 C ATOM 1141 C GLU A 985 5.025 -10.232 6.660 1.00 0.00 C ATOM 1142 O GLU A 985 4.789 -9.101 7.069 1.00 0.00 O ATOM 1143 CB GLU A 985 5.278 -12.376 7.850 1.00 0.00 C ATOM 1144 CG GLU A 985 4.648 -13.355 8.814 1.00 0.00 C ATOM 1145 CD GLU A 985 4.410 -12.739 10.175 1.00 0.00 C ATOM 1146 OE1 GLU A 985 5.354 -12.730 10.990 1.00 0.00 O ATOM 1147 OE2 GLU A 985 3.293 -12.255 10.441 1.00 0.00 O ATOM 0 H GLU A 985 3.935 -13.077 5.960 1.00 0.00 H new ATOM 0 HA GLU A 985 3.525 -11.100 7.910 1.00 0.00 H new ATOM 0 HB2 GLU A 985 5.805 -12.931 7.074 1.00 0.00 H new ATOM 0 HB3 GLU A 985 6.024 -11.785 8.381 1.00 0.00 H new ATOM 0 HG2 GLU A 985 3.701 -13.707 8.405 1.00 0.00 H new ATOM 0 HG3 GLU A 985 5.294 -14.227 8.919 1.00 0.00 H new ATOM 1154 N MET A 986 5.890 -10.493 5.693 1.00 0.00 N ATOM 1155 CA MET A 986 6.855 -9.506 5.249 1.00 0.00 C ATOM 1156 C MET A 986 6.189 -8.379 4.480 1.00 0.00 C ATOM 1157 O MET A 986 6.463 -7.201 4.703 1.00 0.00 O ATOM 1158 CB MET A 986 7.920 -10.180 4.383 1.00 0.00 C ATOM 1159 CG MET A 986 8.861 -11.072 5.175 1.00 0.00 C ATOM 1160 SD MET A 986 10.137 -11.821 4.146 1.00 0.00 S ATOM 1161 CE MET A 986 11.040 -12.769 5.371 1.00 0.00 C ATOM 0 H MET A 986 5.942 -11.385 5.200 1.00 0.00 H new ATOM 0 HA MET A 986 7.324 -9.070 6.131 1.00 0.00 H new ATOM 0 HB2 MET A 986 7.429 -10.775 3.612 1.00 0.00 H new ATOM 0 HB3 MET A 986 8.502 -9.413 3.872 1.00 0.00 H new ATOM 0 HG2 MET A 986 9.333 -10.486 5.964 1.00 0.00 H new ATOM 0 HG3 MET A 986 8.285 -11.858 5.663 1.00 0.00 H new ATOM 0 HE1 MET A 986 11.866 -13.293 4.889 1.00 0.00 H new ATOM 0 HE2 MET A 986 11.433 -12.097 6.134 1.00 0.00 H new ATOM 0 HE3 MET A 986 10.372 -13.494 5.835 1.00 0.00 H new ATOM 1171 N ALA A 987 5.294 -8.763 3.587 1.00 0.00 N ATOM 1172 CA ALA A 987 4.670 -7.832 2.672 1.00 0.00 C ATOM 1173 C ALA A 987 3.772 -6.833 3.388 1.00 0.00 C ATOM 1174 O ALA A 987 3.864 -5.631 3.141 1.00 0.00 O ATOM 1175 CB ALA A 987 3.888 -8.595 1.628 1.00 0.00 C ATOM 0 H ALA A 987 4.982 -9.728 3.478 1.00 0.00 H new ATOM 0 HA ALA A 987 5.461 -7.257 2.190 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.419 -7.892 0.940 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.562 -9.250 1.075 1.00 0.00 H new ATOM 0 HB3 ALA A 987 3.119 -9.194 2.115 1.00 0.00 H new ATOM 1181 N GLN A 988 2.888 -7.317 4.256 1.00 0.00 N ATOM 1182 CA GLN A 988 1.999 -6.406 4.971 1.00 0.00 C ATOM 1183 C GLN A 988 2.793 -5.428 5.849 1.00 0.00 C ATOM 1184 O GLN A 988 2.367 -4.295 6.061 1.00 0.00 O ATOM 1185 CB GLN A 988 0.951 -7.169 5.785 1.00 0.00 C ATOM 1186 CG GLN A 988 1.470 -7.833 7.048 1.00 0.00 C ATOM 1187 CD GLN A 988 0.416 -8.700 7.710 1.00 0.00 C ATOM 1188 OE1 GLN A 988 -0.849 -8.355 7.504 1.00 0.00 O flip ATOM 1189 NE2 GLN A 988 0.733 -9.672 8.391 1.00 0.00 N flip ATOM 0 H GLN A 988 2.769 -8.305 4.477 1.00 0.00 H new ATOM 0 HA GLN A 988 1.464 -5.817 4.226 1.00 0.00 H new ATOM 0 HB2 GLN A 988 0.153 -6.478 6.058 1.00 0.00 H new ATOM 0 HB3 GLN A 988 0.506 -7.934 5.148 1.00 0.00 H new ATOM 0 HG2 GLN A 988 2.340 -8.443 6.805 1.00 0.00 H new ATOM 0 HG3 GLN A 988 1.802 -7.068 7.749 1.00 0.00 H new ATOM 0 HE21 GLN A 988 1.718 -9.902 8.524 1.00 0.00 H new ATOM 0 HE22 GLN A 988 0.011 -10.249 8.823 1.00 0.00 H new ATOM 1198 N LYS A 989 3.955 -5.865 6.331 1.00 0.00 N ATOM 1199 CA LYS A 989 4.863 -4.990 7.076 1.00 0.00 C ATOM 1200 C LYS A 989 5.506 -3.955 6.167 1.00 0.00 C ATOM 1201 O LYS A 989 5.764 -2.819 6.564 1.00 0.00 O ATOM 1202 CB LYS A 989 5.995 -5.797 7.674 1.00 0.00 C ATOM 1203 CG LYS A 989 5.556 -6.818 8.693 1.00 0.00 C ATOM 1204 CD LYS A 989 6.731 -7.660 9.120 1.00 0.00 C ATOM 1205 CE LYS A 989 6.289 -8.932 9.829 1.00 0.00 C ATOM 1206 NZ LYS A 989 5.259 -8.671 10.870 1.00 0.00 N ATOM 0 H LYS A 989 4.292 -6.821 6.219 1.00 0.00 H new ATOM 0 HA LYS A 989 4.266 -4.503 7.847 1.00 0.00 H new ATOM 0 HB2 LYS A 989 6.526 -6.307 6.871 1.00 0.00 H new ATOM 0 HB3 LYS A 989 6.705 -5.115 8.142 1.00 0.00 H new ATOM 0 HG2 LYS A 989 5.124 -6.317 9.559 1.00 0.00 H new ATOM 0 HG3 LYS A 989 4.777 -7.453 8.271 1.00 0.00 H new ATOM 0 HD2 LYS A 989 7.328 -7.920 8.246 1.00 0.00 H new ATOM 0 HD3 LYS A 989 7.372 -7.079 9.783 1.00 0.00 H new ATOM 0 HE2 LYS A 989 5.891 -9.634 9.096 1.00 0.00 H new ATOM 0 HE3 LYS A 989 7.155 -9.408 10.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 5.162 -9.508 11.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 5.547 -7.854 11.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 4.347 -8.468 10.413 1.00 0.00 H new ATOM 1220 N LEU A 990 5.850 -4.404 4.965 1.00 0.00 N ATOM 1221 CA LEU A 990 6.496 -3.550 3.981 1.00 0.00 C ATOM 1222 C LEU A 990 5.757 -2.216 3.786 1.00 0.00 C ATOM 1223 O LEU A 990 6.316 -1.153 4.058 1.00 0.00 O ATOM 1224 CB LEU A 990 6.589 -4.299 2.659 1.00 0.00 C ATOM 1225 CG LEU A 990 6.886 -3.422 1.461 1.00 0.00 C ATOM 1226 CD1 LEU A 990 8.333 -2.949 1.474 1.00 0.00 C ATOM 1227 CD2 LEU A 990 6.567 -4.164 0.174 1.00 0.00 C ATOM 0 H LEU A 990 5.690 -5.361 4.649 1.00 0.00 H new ATOM 0 HA LEU A 990 7.493 -3.306 4.349 1.00 0.00 H new ATOM 0 HB2 LEU A 990 7.367 -5.058 2.740 1.00 0.00 H new ATOM 0 HB3 LEU A 990 5.649 -4.823 2.486 1.00 0.00 H new ATOM 0 HG LEU A 990 6.250 -2.538 1.516 1.00 0.00 H new ATOM 0 HD11 LEU A 990 8.518 -2.321 0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 990 8.520 -2.375 2.381 1.00 0.00 H new ATOM 0 HD13 LEU A 990 8.998 -3.812 1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 990 6.785 -3.522 -0.680 1.00 0.00 H new ATOM 0 HD22 LEU A 990 7.175 -5.067 0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.512 -4.436 0.163 1.00 0.00 H new ATOM 1239 N LEU A 991 4.500 -2.269 3.362 1.00 0.00 N ATOM 1240 CA LEU A 991 3.717 -1.050 3.145 1.00 0.00 C ATOM 1241 C LEU A 991 3.441 -0.375 4.472 1.00 0.00 C ATOM 1242 O LEU A 991 3.292 0.841 4.555 1.00 0.00 O ATOM 1243 CB LEU A 991 2.397 -1.386 2.475 1.00 0.00 C ATOM 1244 CG LEU A 991 1.913 -0.394 1.416 1.00 0.00 C ATOM 1245 CD1 LEU A 991 1.266 0.820 2.060 1.00 0.00 C ATOM 1246 CD2 LEU A 991 3.074 0.025 0.526 1.00 0.00 C ATOM 0 H LEU A 991 4.000 -3.135 3.162 1.00 0.00 H new ATOM 0 HA LEU A 991 4.288 -0.380 2.502 1.00 0.00 H new ATOM 0 HB2 LEU A 991 2.487 -2.368 2.011 1.00 0.00 H new ATOM 0 HB3 LEU A 991 1.631 -1.467 3.246 1.00 0.00 H new ATOM 0 HG LEU A 991 1.158 -0.886 0.802 1.00 0.00 H new ATOM 0 HD11 LEU A 991 0.931 1.508 1.284 1.00 0.00 H new ATOM 0 HD12 LEU A 991 0.411 0.503 2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 991 1.991 1.321 2.702 1.00 0.00 H new ATOM 0 HD21 LEU A 991 2.720 0.731 -0.225 1.00 0.00 H new ATOM 0 HD22 LEU A 991 3.846 0.498 1.133 1.00 0.00 H new ATOM 0 HD23 LEU A 991 3.489 -0.853 0.031 1.00 0.00 H new ATOM 1258 N ASN A 992 3.387 -1.198 5.499 1.00 0.00 N ATOM 1259 CA ASN A 992 3.170 -0.752 6.862 1.00 0.00 C ATOM 1260 C ASN A 992 4.160 0.349 7.243 1.00 0.00 C ATOM 1261 O ASN A 992 3.763 1.452 7.626 1.00 0.00 O ATOM 1262 CB ASN A 992 3.347 -1.963 7.769 1.00 0.00 C ATOM 1263 CG ASN A 992 3.177 -1.664 9.241 1.00 0.00 C ATOM 1264 OD1 ASN A 992 4.096 -1.183 9.903 1.00 0.00 O ATOM 1265 ND2 ASN A 992 2.017 -2.008 9.773 1.00 0.00 N ATOM 0 H ASN A 992 3.494 -2.209 5.411 1.00 0.00 H new ATOM 0 HA ASN A 992 2.169 -0.333 6.966 1.00 0.00 H new ATOM 0 HB2 ASN A 992 2.627 -2.728 7.479 1.00 0.00 H new ATOM 0 HB3 ASN A 992 4.340 -2.382 7.607 1.00 0.00 H new ATOM 0 HD21 ASN A 992 1.855 -1.878 10.772 1.00 0.00 H new ATOM 0 HD22 ASN A 992 1.283 -2.403 9.185 1.00 0.00 H new ATOM 1272 N SER A 993 5.442 0.062 7.098 1.00 0.00 N ATOM 1273 CA SER A 993 6.479 1.024 7.439 1.00 0.00 C ATOM 1274 C SER A 993 6.607 2.112 6.366 1.00 0.00 C ATOM 1275 O SER A 993 6.877 3.268 6.682 1.00 0.00 O ATOM 1276 CB SER A 993 7.809 0.296 7.660 1.00 0.00 C ATOM 1277 OG SER A 993 8.828 1.177 8.100 1.00 0.00 O ATOM 0 H SER A 993 5.791 -0.829 6.746 1.00 0.00 H new ATOM 0 HA SER A 993 6.199 1.525 8.366 1.00 0.00 H new ATOM 0 HB2 SER A 993 7.671 -0.496 8.396 1.00 0.00 H new ATOM 0 HB3 SER A 993 8.119 -0.183 6.731 1.00 0.00 H new ATOM 0 HG SER A 993 9.660 0.676 8.231 1.00 0.00 H new ATOM 1283 N ASP A 994 6.403 1.756 5.106 1.00 0.00 N ATOM 1284 CA ASP A 994 6.493 2.743 4.029 1.00 0.00 C ATOM 1285 C ASP A 994 5.398 3.814 4.132 1.00 0.00 C ATOM 1286 O ASP A 994 5.633 4.982 3.830 1.00 0.00 O ATOM 1287 CB ASP A 994 6.481 2.070 2.658 1.00 0.00 C ATOM 1288 CG ASP A 994 7.884 1.758 2.185 1.00 0.00 C ATOM 1289 OD1 ASP A 994 8.468 0.753 2.647 1.00 0.00 O ATOM 1290 OD2 ASP A 994 8.435 2.551 1.390 1.00 0.00 O ATOM 0 H ASP A 994 6.177 0.809 4.803 1.00 0.00 H new ATOM 0 HA ASP A 994 7.449 3.253 4.145 1.00 0.00 H new ATOM 0 HB2 ASP A 994 5.899 1.150 2.708 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.988 2.721 1.936 1.00 0.00 H new ATOM 1295 N LEU A 995 4.202 3.415 4.545 1.00 0.00 N ATOM 1296 CA LEU A 995 3.125 4.363 4.833 1.00 0.00 C ATOM 1297 C LEU A 995 3.414 5.125 6.116 1.00 0.00 C ATOM 1298 O LEU A 995 2.863 6.202 6.330 1.00 0.00 O ATOM 1299 CB LEU A 995 1.754 3.667 4.876 1.00 0.00 C ATOM 1300 CG LEU A 995 0.563 4.547 5.275 1.00 0.00 C ATOM 1301 CD1 LEU A 995 -0.678 4.148 4.494 1.00 0.00 C ATOM 1302 CD2 LEU A 995 0.291 4.452 6.772 1.00 0.00 C ATOM 0 H LEU A 995 3.949 2.437 4.690 1.00 0.00 H new ATOM 0 HA LEU A 995 3.083 5.086 4.018 1.00 0.00 H new ATOM 0 HB2 LEU A 995 1.553 3.243 3.892 1.00 0.00 H new ATOM 0 HB3 LEU A 995 1.814 2.833 5.576 1.00 0.00 H new ATOM 0 HG LEU A 995 0.814 5.580 5.036 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -1.514 4.783 4.790 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -0.491 4.268 3.427 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -0.921 3.107 4.705 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -0.558 5.085 7.028 1.00 0.00 H new ATOM 0 HD22 LEU A 995 0.066 3.419 7.036 1.00 0.00 H new ATOM 0 HD23 LEU A 995 1.171 4.784 7.323 1.00 0.00 H new ATOM 1314 N ALA A 996 4.313 4.630 6.936 1.00 0.00 N ATOM 1315 CA ALA A 996 4.831 5.462 8.023 1.00 0.00 C ATOM 1316 C ALA A 996 5.775 6.541 7.458 1.00 0.00 C ATOM 1317 O ALA A 996 5.902 7.628 8.029 1.00 0.00 O ATOM 1318 CB ALA A 996 5.512 4.626 9.096 1.00 0.00 C ATOM 0 H ALA A 996 4.698 3.687 6.884 1.00 0.00 H new ATOM 0 HA ALA A 996 3.989 5.960 8.504 1.00 0.00 H new ATOM 0 HB1 ALA A 996 5.883 5.280 9.885 1.00 0.00 H new ATOM 0 HB2 ALA A 996 4.796 3.920 9.516 1.00 0.00 H new ATOM 0 HB3 ALA A 996 6.346 4.079 8.656 1.00 0.00 H new ATOM 1324 N GLU A 997 6.379 6.268 6.305 1.00 0.00 N ATOM 1325 CA GLU A 997 7.184 7.268 5.600 1.00 0.00 C ATOM 1326 C GLU A 997 6.262 8.282 4.935 1.00 0.00 C ATOM 1327 O GLU A 997 6.536 9.489 4.938 1.00 0.00 O ATOM 1328 CB GLU A 997 8.073 6.608 4.539 1.00 0.00 C ATOM 1329 CG GLU A 997 8.934 7.592 3.762 1.00 0.00 C ATOM 1330 CD GLU A 997 9.949 8.304 4.631 1.00 0.00 C ATOM 1331 OE1 GLU A 997 10.966 7.680 5.002 1.00 0.00 O ATOM 1332 OE2 GLU A 997 9.739 9.493 4.939 1.00 0.00 O ATOM 0 H GLU A 997 6.328 5.363 5.837 1.00 0.00 H new ATOM 0 HA GLU A 997 7.827 7.769 6.324 1.00 0.00 H new ATOM 0 HB2 GLU A 997 8.720 5.877 5.024 1.00 0.00 H new ATOM 0 HB3 GLU A 997 7.442 6.060 3.839 1.00 0.00 H new ATOM 0 HG2 GLU A 997 9.455 7.061 2.966 1.00 0.00 H new ATOM 0 HG3 GLU A 997 8.291 8.331 3.284 1.00 0.00 H new ATOM 1339 N LEU A 998 5.148 7.789 4.403 1.00 0.00 N ATOM 1340 CA LEU A 998 4.167 8.650 3.764 1.00 0.00 C ATOM 1341 C LEU A 998 3.706 9.730 4.738 1.00 0.00 C ATOM 1342 O LEU A 998 3.669 10.915 4.402 1.00 0.00 O ATOM 1343 CB LEU A 998 2.960 7.829 3.284 1.00 0.00 C ATOM 1344 CG LEU A 998 1.584 8.365 3.722 1.00 0.00 C ATOM 1345 CD1 LEU A 998 1.160 9.541 2.876 1.00 0.00 C ATOM 1346 CD2 LEU A 998 0.526 7.292 3.665 1.00 0.00 C ATOM 0 H LEU A 998 4.905 6.798 4.403 1.00 0.00 H new ATOM 0 HA LEU A 998 4.633 9.123 2.899 1.00 0.00 H new ATOM 0 HB2 LEU A 998 2.983 7.782 2.195 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.067 6.808 3.650 1.00 0.00 H new ATOM 0 HG LEU A 998 1.688 8.694 4.756 1.00 0.00 H new ATOM 0 HD11 LEU A 998 0.185 9.897 3.210 1.00 0.00 H new ATOM 0 HD12 LEU A 998 1.892 10.343 2.974 1.00 0.00 H new ATOM 0 HD13 LEU A 998 1.096 9.234 1.832 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.431 7.707 3.981 1.00 0.00 H new ATOM 0 HD22 LEU A 998 0.441 6.919 2.644 1.00 0.00 H new ATOM 0 HD23 LEU A 998 0.803 6.473 4.329 1.00 0.00 H new ATOM 1358 N ILE A 999 3.399 9.305 5.960 1.00 0.00 N ATOM 1359 CA ILE A 999 2.848 10.199 6.980 1.00 0.00 C ATOM 1360 C ILE A 999 3.806 11.342 7.305 1.00 0.00 C ATOM 1361 O ILE A 999 3.389 12.491 7.368 1.00 0.00 O ATOM 1362 CB ILE A 999 2.524 9.436 8.287 1.00 0.00 C ATOM 1363 CG1 ILE A 999 1.498 8.331 8.023 1.00 0.00 C ATOM 1364 CG2 ILE A 999 2.009 10.395 9.355 1.00 0.00 C ATOM 1365 CD1 ILE A 999 1.193 7.474 9.235 1.00 0.00 C ATOM 0 H ILE A 999 3.523 8.342 6.272 1.00 0.00 H new ATOM 0 HA ILE A 999 1.929 10.610 6.563 1.00 0.00 H new ATOM 0 HB ILE A 999 3.443 8.976 8.651 1.00 0.00 H new ATOM 0 HG12 ILE A 999 0.572 8.785 7.669 1.00 0.00 H new ATOM 0 HG13 ILE A 999 1.866 7.691 7.221 1.00 0.00 H new ATOM 0 HG21 ILE A 999 1.787 9.840 10.266 1.00 0.00 H new ATOM 0 HG22 ILE A 999 2.769 11.148 9.565 1.00 0.00 H new ATOM 0 HG23 ILE A 999 1.103 10.884 8.998 1.00 0.00 H new ATOM 0 HD11 ILE A 999 0.458 6.715 8.968 1.00 0.00 H new ATOM 0 HD12 ILE A 999 2.107 6.990 9.578 1.00 0.00 H new ATOM 0 HD13 ILE A 999 0.794 8.101 10.033 1.00 0.00 H new ATOM 1377 N ASN A1000 5.084 11.026 7.499 1.00 0.00 N ATOM 1378 CA ASN A1000 6.068 12.037 7.904 1.00 0.00 C ATOM 1379 C ASN A1000 6.154 13.197 6.906 1.00 0.00 C ATOM 1380 O ASN A1000 6.253 14.366 7.295 1.00 0.00 O ATOM 1381 CB ASN A1000 7.458 11.410 8.076 1.00 0.00 C ATOM 1382 CG ASN A1000 7.650 10.731 9.420 1.00 0.00 C ATOM 1383 OD1 ASN A1000 8.059 11.364 10.395 1.00 0.00 O ATOM 1384 ND2 ASN A1000 7.372 9.438 9.486 1.00 0.00 N ATOM 0 H ASN A1000 5.464 10.087 7.384 1.00 0.00 H new ATOM 0 HA ASN A1000 5.726 12.436 8.859 1.00 0.00 H new ATOM 0 HB2 ASN A1000 7.620 10.681 7.282 1.00 0.00 H new ATOM 0 HB3 ASN A1000 8.215 12.185 7.957 1.00 0.00 H new ATOM 0 HD21 ASN A1000 7.495 8.934 10.364 1.00 0.00 H new ATOM 0 HD22 ASN A1000 7.035 8.946 8.658 1.00 0.00 H new ATOM 1391 N LYS A1001 6.089 12.881 5.623 1.00 0.00 N ATOM 1392 CA LYS A1001 6.257 13.894 4.583 1.00 0.00 C ATOM 1393 C LYS A1001 4.936 14.602 4.324 1.00 0.00 C ATOM 1394 O LYS A1001 4.880 15.817 4.126 1.00 0.00 O ATOM 1395 CB LYS A1001 6.804 13.255 3.307 1.00 0.00 C ATOM 1396 CG LYS A1001 8.168 12.612 3.502 1.00 0.00 C ATOM 1397 CD LYS A1001 9.180 13.612 4.040 1.00 0.00 C ATOM 1398 CE LYS A1001 10.502 12.950 4.397 1.00 0.00 C ATOM 1399 NZ LYS A1001 11.225 12.439 3.202 1.00 0.00 N ATOM 0 H LYS A1001 5.922 11.937 5.273 1.00 0.00 H new ATOM 0 HA LYS A1001 6.978 14.638 4.921 1.00 0.00 H new ATOM 0 HB2 LYS A1001 6.100 12.501 2.954 1.00 0.00 H new ATOM 0 HB3 LYS A1001 6.874 14.014 2.528 1.00 0.00 H new ATOM 0 HG2 LYS A1001 8.081 11.773 4.192 1.00 0.00 H new ATOM 0 HG3 LYS A1001 8.521 12.209 2.553 1.00 0.00 H new ATOM 0 HD2 LYS A1001 9.353 14.389 3.295 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.770 14.103 4.923 1.00 0.00 H new ATOM 0 HE2 LYS A1001 11.134 13.667 4.921 1.00 0.00 H new ATOM 0 HE3 LYS A1001 10.317 12.126 5.086 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 12.119 11.998 3.499 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 10.636 11.734 2.715 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 11.427 13.228 2.555 1.00 0.00 H new ATOM 1413 N MET A1002 3.873 13.827 4.391 1.00 0.00 N ATOM 1414 CA MET A1002 2.514 14.346 4.321 1.00 0.00 C ATOM 1415 C MET A1002 2.315 15.359 5.446 1.00 0.00 C ATOM 1416 O MET A1002 1.628 16.382 5.304 1.00 0.00 O ATOM 1417 CB MET A1002 1.526 13.182 4.494 1.00 0.00 C ATOM 1418 CG MET A1002 0.068 13.590 4.500 1.00 0.00 C ATOM 1419 SD MET A1002 -0.617 13.784 2.844 1.00 0.00 S ATOM 1420 CE MET A1002 -1.029 12.090 2.450 1.00 0.00 C ATOM 0 H MET A1002 3.923 12.814 4.496 1.00 0.00 H new ATOM 0 HA MET A1002 2.343 14.829 3.359 1.00 0.00 H new ATOM 0 HB2 MET A1002 1.686 12.464 3.689 1.00 0.00 H new ATOM 0 HB3 MET A1002 1.750 12.668 5.429 1.00 0.00 H new ATOM 0 HG2 MET A1002 -0.511 12.841 5.041 1.00 0.00 H new ATOM 0 HG3 MET A1002 -0.038 14.529 5.043 1.00 0.00 H new ATOM 0 HE1 MET A1002 -1.449 12.042 1.445 1.00 0.00 H new ATOM 0 HE2 MET A1002 -0.129 11.476 2.497 1.00 0.00 H new ATOM 0 HE3 MET A1002 -1.761 11.717 3.167 1.00 0.00 H new ATOM 1430 N LYS A1003 3.005 15.082 6.544 1.00 0.00 N ATOM 1431 CA LYS A1003 2.764 15.749 7.805 1.00 0.00 C ATOM 1432 C LYS A1003 3.220 17.198 7.761 1.00 0.00 C ATOM 1433 O LYS A1003 2.452 18.115 8.045 1.00 0.00 O ATOM 1434 CB LYS A1003 3.511 15.025 8.927 1.00 0.00 C ATOM 1435 CG LYS A1003 2.784 15.027 10.257 1.00 0.00 C ATOM 1436 CD LYS A1003 1.499 14.222 10.175 1.00 0.00 C ATOM 1437 CE LYS A1003 0.877 14.013 11.550 1.00 0.00 C ATOM 1438 NZ LYS A1003 0.553 15.296 12.233 1.00 0.00 N ATOM 0 H LYS A1003 3.749 14.385 6.580 1.00 0.00 H new ATOM 0 HA LYS A1003 1.691 15.727 7.993 1.00 0.00 H new ATOM 0 HB2 LYS A1003 3.688 13.993 8.624 1.00 0.00 H new ATOM 0 HB3 LYS A1003 4.488 15.491 9.058 1.00 0.00 H new ATOM 0 HG2 LYS A1003 3.430 14.610 11.029 1.00 0.00 H new ATOM 0 HG3 LYS A1003 2.557 16.052 10.550 1.00 0.00 H new ATOM 0 HD2 LYS A1003 0.788 14.736 9.528 1.00 0.00 H new ATOM 0 HD3 LYS A1003 1.704 13.254 9.717 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -0.032 13.421 11.447 1.00 0.00 H new ATOM 0 HE3 LYS A1003 1.563 13.438 12.172 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 0.071 15.098 13.133 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 1.431 15.822 12.418 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -0.070 15.865 11.625 1.00 0.00 H new ATOM 1452 N LEU A1004 4.475 17.399 7.382 1.00 0.00 N ATOM 1453 CA LEU A1004 5.058 18.734 7.350 1.00 0.00 C ATOM 1454 C LEU A1004 4.589 19.522 6.140 1.00 0.00 C ATOM 1455 O LEU A1004 4.760 20.739 6.094 1.00 0.00 O ATOM 1456 CB LEU A1004 6.586 18.684 7.375 1.00 0.00 C ATOM 1457 CG LEU A1004 7.231 18.464 8.747 1.00 0.00 C ATOM 1458 CD1 LEU A1004 6.778 19.538 9.718 1.00 0.00 C ATOM 1459 CD2 LEU A1004 6.914 17.080 9.290 1.00 0.00 C ATOM 0 H LEU A1004 5.109 16.655 7.092 1.00 0.00 H new ATOM 0 HA LEU A1004 4.714 19.244 8.250 1.00 0.00 H new ATOM 0 HB2 LEU A1004 6.914 17.885 6.710 1.00 0.00 H new ATOM 0 HB3 LEU A1004 6.967 19.619 6.963 1.00 0.00 H new ATOM 0 HG LEU A1004 8.312 18.533 8.629 1.00 0.00 H new ATOM 0 HD11 LEU A1004 7.243 19.370 10.689 1.00 0.00 H new ATOM 0 HD12 LEU A1004 7.071 20.517 9.340 1.00 0.00 H new ATOM 0 HD13 LEU A1004 5.694 19.499 9.824 1.00 0.00 H new ATOM 0 HD21 LEU A1004 7.386 16.955 10.265 1.00 0.00 H new ATOM 0 HD22 LEU A1004 5.835 16.968 9.392 1.00 0.00 H new ATOM 0 HD23 LEU A1004 7.294 16.324 8.603 1.00 0.00 H new ATOM 1471 N ALA A1005 3.975 18.854 5.178 1.00 0.00 N ATOM 1472 CA ALA A1005 3.508 19.559 4.000 1.00 0.00 C ATOM 1473 C ALA A1005 2.354 20.481 4.375 1.00 0.00 C ATOM 1474 O ALA A1005 2.367 21.644 4.010 1.00 0.00 O ATOM 1475 CB ALA A1005 3.140 18.608 2.873 1.00 0.00 C ATOM 0 H ALA A1005 3.792 17.851 5.188 1.00 0.00 H new ATOM 0 HA ALA A1005 4.325 20.171 3.618 1.00 0.00 H new ATOM 0 HB1 ALA A1005 2.796 19.180 2.012 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.014 18.021 2.592 1.00 0.00 H new ATOM 0 HB3 ALA A1005 2.346 17.940 3.206 1.00 0.00 H new ATOM 1481 N GLN A1006 1.368 19.989 5.114 1.00 0.00 N ATOM 1482 CA GLN A1006 0.335 20.888 5.653 1.00 0.00 C ATOM 1483 C GLN A1006 0.879 21.778 6.760 1.00 0.00 C ATOM 1484 O GLN A1006 0.482 22.948 6.836 1.00 0.00 O ATOM 1485 CB GLN A1006 -0.891 20.141 6.161 1.00 0.00 C ATOM 1486 CG GLN A1006 -0.562 19.010 7.121 1.00 0.00 C ATOM 1487 CD GLN A1006 -1.771 18.550 7.899 1.00 0.00 C ATOM 1488 OE1 GLN A1006 -2.526 17.697 7.447 1.00 0.00 O ATOM 1489 NE2 GLN A1006 -1.958 19.104 9.081 1.00 0.00 N ATOM 0 H GLN A1006 1.255 19.004 5.353 1.00 0.00 H new ATOM 0 HA GLN A1006 0.028 21.512 4.813 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -1.555 20.847 6.659 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -1.437 19.736 5.309 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -0.151 18.169 6.562 1.00 0.00 H new ATOM 0 HG3 GLN A1006 0.211 19.339 7.816 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -1.306 19.811 9.422 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -2.754 18.826 9.655 1.00 0.00 H new ATOM 1498 N GLN A1007 1.786 21.257 7.587 1.00 0.00 N ATOM 1499 CA GLN A1007 2.409 22.059 8.640 1.00 0.00 C ATOM 1500 C GLN A1007 2.790 23.438 8.114 1.00 0.00 C ATOM 1501 O GLN A1007 2.413 24.462 8.683 1.00 0.00 O ATOM 1502 CB GLN A1007 3.634 21.342 9.204 1.00 0.00 C ATOM 1503 CG GLN A1007 3.275 20.268 10.220 1.00 0.00 C ATOM 1504 CD GLN A1007 2.645 20.851 11.468 1.00 0.00 C ATOM 1505 OE1 GLN A1007 1.428 21.013 11.544 1.00 0.00 O ATOM 1506 NE2 GLN A1007 3.462 21.169 12.456 1.00 0.00 N ATOM 0 H GLN A1007 2.104 20.289 7.549 1.00 0.00 H new ATOM 0 HA GLN A1007 1.685 22.190 9.444 1.00 0.00 H new ATOM 0 HB2 GLN A1007 4.192 20.888 8.385 1.00 0.00 H new ATOM 0 HB3 GLN A1007 4.293 22.073 9.673 1.00 0.00 H new ATOM 0 HG2 GLN A1007 2.586 19.556 9.766 1.00 0.00 H new ATOM 0 HG3 GLN A1007 4.173 19.713 10.493 1.00 0.00 H new ATOM 0 HE21 GLN A1007 4.466 21.020 12.356 1.00 0.00 H new ATOM 0 HE22 GLN A1007 3.089 21.564 13.319 1.00 0.00 H new ATOM 1515 N TYR A1008 3.504 23.462 7.003 1.00 0.00 N ATOM 1516 CA TYR A1008 3.723 24.706 6.297 1.00 0.00 C ATOM 1517 C TYR A1008 3.244 24.582 4.860 1.00 0.00 C ATOM 1518 O TYR A1008 3.982 24.850 3.909 1.00 0.00 O ATOM 1519 CB TYR A1008 5.182 25.162 6.377 1.00 0.00 C ATOM 1520 CG TYR A1008 5.552 25.718 7.736 1.00 0.00 C ATOM 1521 CD1 TYR A1008 5.935 24.882 8.776 1.00 0.00 C ATOM 1522 CD2 TYR A1008 5.496 27.085 7.980 1.00 0.00 C ATOM 1523 CE1 TYR A1008 6.255 25.391 10.020 1.00 0.00 C ATOM 1524 CE2 TYR A1008 5.812 27.601 9.221 1.00 0.00 C ATOM 1525 CZ TYR A1008 6.190 26.751 10.238 1.00 0.00 C ATOM 1526 OH TYR A1008 6.495 27.262 11.479 1.00 0.00 O ATOM 0 H TYR A1008 3.937 22.643 6.576 1.00 0.00 H new ATOM 0 HA TYR A1008 3.135 25.483 6.786 1.00 0.00 H new ATOM 0 HB2 TYR A1008 5.834 24.320 6.145 1.00 0.00 H new ATOM 0 HB3 TYR A1008 5.362 25.923 5.618 1.00 0.00 H new ATOM 0 HD1 TYR A1008 5.984 23.816 8.610 1.00 0.00 H new ATOM 0 HD2 TYR A1008 5.200 27.755 7.186 1.00 0.00 H new ATOM 0 HE1 TYR A1008 6.554 24.727 10.817 1.00 0.00 H new ATOM 0 HE2 TYR A1008 5.763 28.666 9.394 1.00 0.00 H new ATOM 0 HH TYR A1008 6.401 28.237 11.463 1.00 0.00 H new ATOM 1536 N VAL A1009 1.987 24.137 4.728 1.00 0.00 N ATOM 1537 CA VAL A1009 1.258 24.154 3.458 1.00 0.00 C ATOM 1538 C VAL A1009 1.269 25.547 2.865 1.00 0.00 C ATOM 1539 O VAL A1009 0.999 25.742 1.677 1.00 0.00 O ATOM 1540 CB VAL A1009 -0.204 23.681 3.633 1.00 0.00 C ATOM 1541 CG1 VAL A1009 -0.996 24.651 4.502 1.00 0.00 C ATOM 1542 CG2 VAL A1009 -0.874 23.484 2.282 1.00 0.00 C ATOM 0 H VAL A1009 1.447 23.754 5.504 1.00 0.00 H new ATOM 0 HA VAL A1009 1.763 23.463 2.783 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.186 22.718 4.144 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -2.020 24.292 4.607 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -0.533 24.719 5.486 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -1.003 25.636 4.035 1.00 0.00 H new ATOM 0 HG21 VAL A1009 -1.901 23.151 2.430 1.00 0.00 H new ATOM 0 HG22 VAL A1009 -0.873 24.427 1.735 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -0.328 22.733 1.711 1.00 0.00 H new ATOM 1552 N MET A1010 1.565 26.513 3.709 1.00 0.00 N ATOM 1553 CA MET A1010 1.888 27.846 3.242 1.00 0.00 C ATOM 1554 C MET A1010 3.157 27.808 2.372 1.00 0.00 C ATOM 1555 O MET A1010 4.272 28.034 2.848 1.00 0.00 O ATOM 1556 CB MET A1010 2.034 28.817 4.423 1.00 0.00 C ATOM 1557 CG MET A1010 2.944 28.320 5.540 1.00 0.00 C ATOM 1558 SD MET A1010 2.963 29.425 6.967 1.00 0.00 S ATOM 1559 CE MET A1010 1.238 29.388 7.453 1.00 0.00 C ATOM 0 H MET A1010 1.589 26.401 4.723 1.00 0.00 H new ATOM 0 HA MET A1010 1.069 28.213 2.624 1.00 0.00 H new ATOM 0 HB2 MET A1010 2.421 29.766 4.051 1.00 0.00 H new ATOM 0 HB3 MET A1010 1.046 29.016 4.838 1.00 0.00 H new ATOM 0 HG2 MET A1010 2.616 27.330 5.857 1.00 0.00 H new ATOM 0 HG3 MET A1010 3.958 28.212 5.156 1.00 0.00 H new ATOM 0 HE1 MET A1010 1.152 29.645 8.509 1.00 0.00 H new ATOM 0 HE2 MET A1010 0.677 30.108 6.858 1.00 0.00 H new ATOM 0 HE3 MET A1010 0.835 28.389 7.288 1.00 0.00 H new ATOM 1569 N THR A1011 2.945 27.431 1.110 1.00 0.00 N ATOM 1570 CA THR A1011 3.949 27.393 0.032 1.00 0.00 C ATOM 1571 C THR A1011 5.046 26.324 0.214 1.00 0.00 C ATOM 1572 O THR A1011 4.883 25.186 -0.247 1.00 0.00 O ATOM 1573 CB THR A1011 4.583 28.786 -0.269 1.00 0.00 C ATOM 1574 OG1 THR A1011 5.152 29.379 0.904 1.00 0.00 O ATOM 1575 CG2 THR A1011 3.541 29.726 -0.854 1.00 0.00 C ATOM 0 H THR A1011 2.025 27.128 0.791 1.00 0.00 H new ATOM 0 HA THR A1011 3.369 27.093 -0.841 1.00 0.00 H new ATOM 0 HB THR A1011 5.383 28.626 -0.992 1.00 0.00 H new ATOM 0 HG1 THR A1011 4.961 28.814 1.682 1.00 0.00 H new ATOM 0 HG21 THR A1011 3.998 30.694 -1.059 1.00 0.00 H new ATOM 0 HG22 THR A1011 3.151 29.305 -1.781 1.00 0.00 H new ATOM 0 HG23 THR A1011 2.725 29.853 -0.142 1.00 0.00 H new ATOM 1583 N SER A1012 6.135 26.690 0.897 1.00 0.00 N ATOM 1584 CA SER A1012 7.387 25.920 0.896 1.00 0.00 C ATOM 1585 C SER A1012 7.206 24.409 1.095 1.00 0.00 C ATOM 1586 O SER A1012 7.271 23.640 0.123 1.00 0.00 O ATOM 1587 CB SER A1012 8.331 26.481 1.960 1.00 0.00 C ATOM 1588 OG SER A1012 8.566 27.861 1.739 1.00 0.00 O ATOM 0 H SER A1012 6.175 27.533 1.470 1.00 0.00 H new ATOM 0 HA SER A1012 7.812 26.033 -0.101 1.00 0.00 H new ATOM 0 HB2 SER A1012 7.900 26.334 2.950 1.00 0.00 H new ATOM 0 HB3 SER A1012 9.276 25.938 1.939 1.00 0.00 H new ATOM 0 HG SER A1012 9.171 28.205 2.430 1.00 0.00 H new ATOM 1594 N LEU A1013 7.005 23.970 2.339 1.00 0.00 N ATOM 1595 CA LEU A1013 6.935 22.542 2.638 1.00 0.00 C ATOM 1596 C LEU A1013 5.907 21.839 1.800 1.00 0.00 C ATOM 1597 O LEU A1013 6.117 20.699 1.406 1.00 0.00 O ATOM 1598 CB LEU A1013 6.590 22.286 4.100 1.00 0.00 C ATOM 1599 CG LEU A1013 7.439 23.056 5.118 1.00 0.00 C ATOM 1600 CD1 LEU A1013 7.254 22.484 6.514 1.00 0.00 C ATOM 1601 CD2 LEU A1013 8.909 23.030 4.727 1.00 0.00 C ATOM 0 H LEU A1013 6.889 24.579 3.149 1.00 0.00 H new ATOM 0 HA LEU A1013 7.927 22.150 2.412 1.00 0.00 H new ATOM 0 HB2 LEU A1013 5.542 22.541 4.259 1.00 0.00 H new ATOM 0 HB3 LEU A1013 6.692 21.219 4.299 1.00 0.00 H new ATOM 0 HG LEU A1013 7.103 24.093 5.121 1.00 0.00 H new ATOM 0 HD11 LEU A1013 7.865 23.045 7.221 1.00 0.00 H new ATOM 0 HD12 LEU A1013 6.205 22.559 6.802 1.00 0.00 H new ATOM 0 HD13 LEU A1013 7.558 21.437 6.522 1.00 0.00 H new ATOM 0 HD21 LEU A1013 9.491 23.583 5.464 1.00 0.00 H new ATOM 0 HD22 LEU A1013 9.257 21.998 4.689 1.00 0.00 H new ATOM 0 HD23 LEU A1013 9.033 23.491 3.747 1.00 0.00 H new ATOM 1613 N GLN A1014 4.812 22.523 1.514 1.00 0.00 N ATOM 1614 CA GLN A1014 3.657 21.867 0.946 1.00 0.00 C ATOM 1615 C GLN A1014 4.032 21.103 -0.316 1.00 0.00 C ATOM 1616 O GLN A1014 3.716 19.934 -0.467 1.00 0.00 O ATOM 1617 CB GLN A1014 2.567 22.881 0.641 1.00 0.00 C ATOM 1618 CG GLN A1014 1.507 22.356 -0.310 1.00 0.00 C ATOM 1619 CD GLN A1014 1.363 23.207 -1.564 1.00 0.00 C ATOM 1620 OE1 GLN A1014 2.469 23.764 -2.038 1.00 0.00 O flip ATOM 1621 NE2 GLN A1014 0.272 23.352 -2.114 1.00 0.00 N flip ATOM 0 H GLN A1014 4.703 23.526 1.666 1.00 0.00 H new ATOM 0 HA GLN A1014 3.279 21.154 1.679 1.00 0.00 H new ATOM 0 HB2 GLN A1014 2.091 23.183 1.574 1.00 0.00 H new ATOM 0 HB3 GLN A1014 3.021 23.774 0.211 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.757 21.335 -0.597 1.00 0.00 H new ATOM 0 HG3 GLN A1014 0.549 22.316 0.208 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -0.559 22.909 -1.723 1.00 0.00 H new ATOM 0 HE22 GLN A1014 0.199 23.915 -2.961 1.00 0.00 H new ATOM 1630 N GLN A1015 4.753 21.782 -1.200 1.00 0.00 N ATOM 1631 CA GLN A1015 5.116 21.201 -2.485 1.00 0.00 C ATOM 1632 C GLN A1015 6.232 20.168 -2.339 1.00 0.00 C ATOM 1633 O GLN A1015 6.178 19.101 -2.950 1.00 0.00 O ATOM 1634 CB GLN A1015 5.523 22.292 -3.476 1.00 0.00 C ATOM 1635 CG GLN A1015 6.604 23.218 -2.957 1.00 0.00 C ATOM 1636 CD GLN A1015 7.105 24.183 -4.014 1.00 0.00 C ATOM 1637 OE1 GLN A1015 7.091 23.752 -5.265 1.00 0.00 O flip ATOM 1638 NE2 GLN A1015 7.509 25.303 -3.706 1.00 0.00 N flip ATOM 0 H GLN A1015 5.096 22.731 -1.051 1.00 0.00 H new ATOM 0 HA GLN A1015 4.236 20.688 -2.873 1.00 0.00 H new ATOM 0 HB2 GLN A1015 5.871 21.822 -4.396 1.00 0.00 H new ATOM 0 HB3 GLN A1015 4.644 22.883 -3.732 1.00 0.00 H new ATOM 0 HG2 GLN A1015 6.216 23.783 -2.109 1.00 0.00 H new ATOM 0 HG3 GLN A1015 7.440 22.623 -2.588 1.00 0.00 H new ATOM 0 HE21 GLN A1015 7.503 25.597 -2.729 1.00 0.00 H new ATOM 0 HE22 GLN A1015 7.850 25.938 -4.427 1.00 0.00 H new ATOM 1647 N GLU A1016 7.219 20.464 -1.505 1.00 0.00 N ATOM 1648 CA GLU A1016 8.370 19.578 -1.354 1.00 0.00 C ATOM 1649 C GLU A1016 7.992 18.315 -0.587 1.00 0.00 C ATOM 1650 O GLU A1016 8.314 17.199 -0.997 1.00 0.00 O ATOM 1651 CB GLU A1016 9.502 20.301 -0.628 1.00 0.00 C ATOM 1652 CG GLU A1016 10.705 19.414 -0.388 1.00 0.00 C ATOM 1653 CD GLU A1016 11.875 20.158 0.211 1.00 0.00 C ATOM 1654 OE1 GLU A1016 11.780 20.590 1.381 1.00 0.00 O ATOM 1655 OE2 GLU A1016 12.903 20.298 -0.482 1.00 0.00 O ATOM 0 H GLU A1016 7.249 21.303 -0.926 1.00 0.00 H new ATOM 0 HA GLU A1016 8.706 19.291 -2.351 1.00 0.00 H new ATOM 0 HB2 GLU A1016 9.807 21.169 -1.213 1.00 0.00 H new ATOM 0 HB3 GLU A1016 9.135 20.674 0.328 1.00 0.00 H new ATOM 0 HG2 GLU A1016 10.421 18.598 0.277 1.00 0.00 H new ATOM 0 HG3 GLU A1016 11.012 18.964 -1.332 1.00 0.00 H new ATOM 1662 N TYR A1017 7.290 18.502 0.510 1.00 0.00 N ATOM 1663 CA TYR A1017 6.903 17.420 1.390 1.00 0.00 C ATOM 1664 C TYR A1017 5.897 16.487 0.752 1.00 0.00 C ATOM 1665 O TYR A1017 5.930 15.282 0.955 1.00 0.00 O ATOM 1666 CB TYR A1017 6.322 18.021 2.655 1.00 0.00 C ATOM 1667 CG TYR A1017 7.405 18.176 3.698 1.00 0.00 C ATOM 1668 CD1 TYR A1017 7.773 17.104 4.498 1.00 0.00 C ATOM 1669 CD2 TYR A1017 8.094 19.370 3.847 1.00 0.00 C ATOM 1670 CE1 TYR A1017 8.787 17.219 5.426 1.00 0.00 C ATOM 1671 CE2 TYR A1017 9.116 19.494 4.769 1.00 0.00 C ATOM 1672 CZ TYR A1017 9.458 18.416 5.557 1.00 0.00 C ATOM 1673 OH TYR A1017 10.475 18.531 6.476 1.00 0.00 O ATOM 0 H TYR A1017 6.968 19.419 0.819 1.00 0.00 H new ATOM 0 HA TYR A1017 7.787 16.823 1.611 1.00 0.00 H new ATOM 0 HB2 TYR A1017 5.876 18.991 2.435 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.525 17.383 3.038 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.256 16.162 4.392 1.00 0.00 H new ATOM 0 HD2 TYR A1017 7.828 20.217 3.232 1.00 0.00 H new ATOM 0 HE1 TYR A1017 9.054 16.376 6.046 1.00 0.00 H new ATOM 0 HE2 TYR A1017 9.644 20.431 4.872 1.00 0.00 H new ATOM 0 HH TYR A1017 10.845 19.438 6.442 1.00 0.00 H new ATOM 1683 N LYS A1018 5.000 17.078 -0.035 1.00 0.00 N ATOM 1684 CA LYS A1018 3.907 16.359 -0.659 1.00 0.00 C ATOM 1685 C LYS A1018 4.390 15.622 -1.897 1.00 0.00 C ATOM 1686 O LYS A1018 3.809 14.618 -2.302 1.00 0.00 O ATOM 1687 CB LYS A1018 2.785 17.315 -1.044 1.00 0.00 C ATOM 1688 CG LYS A1018 1.522 16.611 -1.479 1.00 0.00 C ATOM 1689 CD LYS A1018 0.848 15.915 -0.309 1.00 0.00 C ATOM 1690 CE LYS A1018 -0.323 15.073 -0.777 1.00 0.00 C ATOM 1691 NZ LYS A1018 -0.948 15.622 -2.006 1.00 0.00 N ATOM 0 H LYS A1018 5.017 18.074 -0.255 1.00 0.00 H new ATOM 0 HA LYS A1018 3.527 15.636 0.062 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.559 17.960 -0.195 1.00 0.00 H new ATOM 0 HB3 LYS A1018 3.129 17.961 -1.852 1.00 0.00 H new ATOM 0 HG2 LYS A1018 0.835 17.332 -1.921 1.00 0.00 H new ATOM 0 HG3 LYS A1018 1.758 15.880 -2.253 1.00 0.00 H new ATOM 0 HD2 LYS A1018 1.571 15.284 0.208 1.00 0.00 H new ATOM 0 HD3 LYS A1018 0.502 16.658 0.410 1.00 0.00 H new ATOM 0 HE2 LYS A1018 0.016 14.055 -0.967 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -1.069 15.018 0.015 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -1.906 15.232 -2.112 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -1.002 16.658 -1.935 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -0.374 15.361 -2.833 1.00 0.00 H new ATOM 1705 N LYS A1019 5.446 16.129 -2.512 1.00 0.00 N ATOM 1706 CA LYS A1019 6.039 15.424 -3.640 1.00 0.00 C ATOM 1707 C LYS A1019 6.802 14.221 -3.123 1.00 0.00 C ATOM 1708 O LYS A1019 6.718 13.133 -3.684 1.00 0.00 O ATOM 1709 CB LYS A1019 6.925 16.342 -4.484 1.00 0.00 C ATOM 1710 CG LYS A1019 6.209 16.913 -5.703 1.00 0.00 C ATOM 1711 CD LYS A1019 4.864 17.526 -5.338 1.00 0.00 C ATOM 1712 CE LYS A1019 4.159 18.112 -6.550 1.00 0.00 C ATOM 1713 NZ LYS A1019 4.966 19.166 -7.217 1.00 0.00 N ATOM 0 H LYS A1019 5.903 17.005 -2.259 1.00 0.00 H new ATOM 0 HA LYS A1019 5.244 15.082 -4.303 1.00 0.00 H new ATOM 0 HB2 LYS A1019 7.282 17.163 -3.863 1.00 0.00 H new ATOM 0 HB3 LYS A1019 7.803 15.786 -4.814 1.00 0.00 H new ATOM 0 HG2 LYS A1019 6.838 17.670 -6.171 1.00 0.00 H new ATOM 0 HG3 LYS A1019 6.060 16.123 -6.439 1.00 0.00 H new ATOM 0 HD2 LYS A1019 4.230 16.765 -4.882 1.00 0.00 H new ATOM 0 HD3 LYS A1019 5.012 18.307 -4.592 1.00 0.00 H new ATOM 0 HE2 LYS A1019 3.945 17.316 -7.263 1.00 0.00 H new ATOM 0 HE3 LYS A1019 3.201 18.531 -6.243 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 4.365 19.696 -7.879 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 5.349 19.816 -6.501 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 5.750 18.725 -7.738 1.00 0.00 H new ATOM 1727 N GLN A1020 7.525 14.420 -2.032 1.00 0.00 N ATOM 1728 CA GLN A1020 8.014 13.317 -1.221 1.00 0.00 C ATOM 1729 C GLN A1020 6.850 12.455 -0.749 1.00 0.00 C ATOM 1730 O GLN A1020 6.980 11.235 -0.668 1.00 0.00 O ATOM 1731 CB GLN A1020 8.774 13.853 -0.007 1.00 0.00 C ATOM 1732 CG GLN A1020 10.043 14.606 -0.362 1.00 0.00 C ATOM 1733 CD GLN A1020 10.717 15.210 0.851 1.00 0.00 C ATOM 1734 OE1 GLN A1020 11.556 14.576 1.491 1.00 0.00 O ATOM 1735 NE2 GLN A1020 10.356 16.439 1.173 1.00 0.00 N ATOM 0 H GLN A1020 7.788 15.343 -1.686 1.00 0.00 H new ATOM 0 HA GLN A1020 8.686 12.712 -1.829 1.00 0.00 H new ATOM 0 HB2 GLN A1020 8.117 14.514 0.559 1.00 0.00 H new ATOM 0 HB3 GLN A1020 9.028 13.019 0.648 1.00 0.00 H new ATOM 0 HG2 GLN A1020 10.737 13.928 -0.859 1.00 0.00 H new ATOM 0 HG3 GLN A1020 9.805 15.397 -1.073 1.00 0.00 H new ATOM 0 HE21 GLN A1020 9.656 16.928 0.614 1.00 0.00 H new ATOM 0 HE22 GLN A1020 10.777 16.899 1.980 1.00 0.00 H new ATOM 1744 N MET A1021 5.710 13.074 -0.469 1.00 0.00 N ATOM 1745 CA MET A1021 4.559 12.332 0.006 1.00 0.00 C ATOM 1746 C MET A1021 4.055 11.413 -1.084 1.00 0.00 C ATOM 1747 O MET A1021 3.967 10.214 -0.880 1.00 0.00 O ATOM 1748 CB MET A1021 3.430 13.272 0.453 1.00 0.00 C ATOM 1749 CG MET A1021 2.299 12.598 1.230 1.00 0.00 C ATOM 1750 SD MET A1021 1.458 11.259 0.340 1.00 0.00 S ATOM 1751 CE MET A1021 0.703 12.098 -1.044 1.00 0.00 C ATOM 0 H MET A1021 5.562 14.079 -0.563 1.00 0.00 H new ATOM 0 HA MET A1021 4.872 11.744 0.869 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.858 14.060 1.073 1.00 0.00 H new ATOM 0 HB3 MET A1021 3.008 13.754 -0.429 1.00 0.00 H new ATOM 0 HG2 MET A1021 2.703 12.199 2.160 1.00 0.00 H new ATOM 0 HG3 MET A1021 1.562 13.354 1.501 1.00 0.00 H new ATOM 0 HE1 MET A1021 0.573 11.396 -1.868 1.00 0.00 H new ATOM 0 HE2 MET A1021 -0.269 12.491 -0.745 1.00 0.00 H new ATOM 0 HE3 MET A1021 1.344 12.919 -1.365 1.00 0.00 H new ATOM 1761 N LEU A1022 3.782 11.952 -2.271 1.00 0.00 N ATOM 1762 CA LEU A1022 3.123 11.147 -3.284 1.00 0.00 C ATOM 1763 C LEU A1022 4.134 10.227 -3.951 1.00 0.00 C ATOM 1764 O LEU A1022 3.774 9.364 -4.735 1.00 0.00 O ATOM 1765 CB LEU A1022 2.374 12.016 -4.313 1.00 0.00 C ATOM 1766 CG LEU A1022 2.950 12.001 -5.732 1.00 0.00 C ATOM 1767 CD1 LEU A1022 1.894 12.436 -6.734 1.00 0.00 C ATOM 1768 CD2 LEU A1022 4.166 12.909 -5.831 1.00 0.00 C ATOM 0 H LEU A1022 4.000 12.910 -2.545 1.00 0.00 H new ATOM 0 HA LEU A1022 2.367 10.533 -2.795 1.00 0.00 H new ATOM 0 HB2 LEU A1022 1.337 11.684 -4.357 1.00 0.00 H new ATOM 0 HB3 LEU A1022 2.364 13.045 -3.955 1.00 0.00 H new ATOM 0 HG LEU A1022 3.260 10.982 -5.962 1.00 0.00 H new ATOM 0 HD11 LEU A1022 2.317 12.421 -7.738 1.00 0.00 H new ATOM 0 HD12 LEU A1022 1.045 11.754 -6.687 1.00 0.00 H new ATOM 0 HD13 LEU A1022 1.561 13.446 -6.496 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.558 12.882 -6.848 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.879 13.930 -5.579 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.933 12.566 -5.137 1.00 0.00 H new ATOM 1780 N THR A1023 5.409 10.437 -3.639 1.00 0.00 N ATOM 1781 CA THR A1023 6.466 9.559 -4.107 1.00 0.00 C ATOM 1782 C THR A1023 6.660 8.408 -3.124 1.00 0.00 C ATOM 1783 O THR A1023 6.940 7.286 -3.528 1.00 0.00 O ATOM 1784 CB THR A1023 7.791 10.322 -4.309 1.00 0.00 C ATOM 1785 OG1 THR A1023 7.618 11.319 -5.325 1.00 0.00 O ATOM 1786 CG2 THR A1023 8.923 9.383 -4.706 1.00 0.00 C ATOM 0 H THR A1023 5.732 11.213 -3.061 1.00 0.00 H new ATOM 0 HA THR A1023 6.167 9.159 -5.076 1.00 0.00 H new ATOM 0 HB THR A1023 8.058 10.792 -3.362 1.00 0.00 H new ATOM 0 HG1 THR A1023 7.040 12.034 -4.986 1.00 0.00 H new ATOM 0 HG21 THR A1023 9.841 9.956 -4.840 1.00 0.00 H new ATOM 0 HG22 THR A1023 9.070 8.639 -3.923 1.00 0.00 H new ATOM 0 HG23 THR A1023 8.669 8.881 -5.640 1.00 0.00 H new ATOM 1794 N ALA A1024 6.492 8.684 -1.834 1.00 0.00 N ATOM 1795 CA ALA A1024 6.479 7.631 -0.828 1.00 0.00 C ATOM 1796 C ALA A1024 5.122 6.946 -0.825 1.00 0.00 C ATOM 1797 O ALA A1024 4.982 5.821 -0.372 1.00 0.00 O ATOM 1798 CB ALA A1024 6.812 8.188 0.549 1.00 0.00 C ATOM 0 H ALA A1024 6.363 9.625 -1.463 1.00 0.00 H new ATOM 0 HA ALA A1024 7.245 6.896 -1.076 1.00 0.00 H new ATOM 0 HB1 ALA A1024 6.795 7.381 1.282 1.00 0.00 H new ATOM 0 HB2 ALA A1024 7.804 8.639 0.529 1.00 0.00 H new ATOM 0 HB3 ALA A1024 6.075 8.943 0.824 1.00 0.00 H new ATOM 1804 N ALA A1025 4.123 7.656 -1.315 1.00 0.00 N ATOM 1805 CA ALA A1025 2.813 7.088 -1.578 1.00 0.00 C ATOM 1806 C ALA A1025 2.787 6.462 -2.972 1.00 0.00 C ATOM 1807 O ALA A1025 1.972 5.592 -3.237 1.00 0.00 O ATOM 1808 CB ALA A1025 1.707 8.112 -1.387 1.00 0.00 C ATOM 0 H ALA A1025 4.197 8.647 -1.543 1.00 0.00 H new ATOM 0 HA ALA A1025 2.624 6.299 -0.850 1.00 0.00 H new ATOM 0 HB1 ALA A1025 0.742 7.648 -1.593 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.722 8.477 -0.360 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.862 8.947 -2.071 1.00 0.00 H new ATOM 1814 N HIS A1026 3.656 6.910 -3.869 1.00 0.00 N ATOM 1815 CA HIS A1026 3.918 6.149 -5.094 1.00 0.00 C ATOM 1816 C HIS A1026 4.804 4.960 -4.748 1.00 0.00 C ATOM 1817 O HIS A1026 4.811 3.970 -5.451 1.00 0.00 O ATOM 1818 CB HIS A1026 4.544 7.013 -6.200 1.00 0.00 C ATOM 1819 CG HIS A1026 4.771 6.295 -7.502 1.00 0.00 C ATOM 1820 ND1 HIS A1026 3.816 6.203 -8.495 1.00 0.00 N ATOM 1821 CD2 HIS A1026 5.859 5.639 -7.974 1.00 0.00 C ATOM 1822 CE1 HIS A1026 4.309 5.526 -9.516 1.00 0.00 C ATOM 1823 NE2 HIS A1026 5.544 5.174 -9.226 1.00 0.00 N ATOM 0 H HIS A1026 4.184 7.778 -3.780 1.00 0.00 H new ATOM 0 HA HIS A1026 2.968 5.797 -5.496 1.00 0.00 H new ATOM 0 HB2 HIS A1026 3.898 7.872 -6.382 1.00 0.00 H new ATOM 0 HB3 HIS A1026 5.498 7.402 -5.843 1.00 0.00 H new ATOM 0 HD2 HIS A1026 6.800 5.507 -7.460 1.00 0.00 H new ATOM 0 HE1 HIS A1026 3.787 5.299 -10.434 1.00 0.00 H new ATOM 0 HE2 HIS A1026 6.166 4.642 -9.834 1.00 0.00 H new ATOM 1832 N ALA A1027 5.521 5.070 -3.645 1.00 0.00 N ATOM 1833 CA ALA A1027 6.176 3.932 -2.995 1.00 0.00 C ATOM 1834 C ALA A1027 5.134 3.075 -2.315 1.00 0.00 C ATOM 1835 O ALA A1027 5.216 1.853 -2.363 1.00 0.00 O ATOM 1836 CB ALA A1027 7.200 4.419 -1.980 1.00 0.00 C ATOM 0 H ALA A1027 5.671 5.957 -3.164 1.00 0.00 H new ATOM 0 HA ALA A1027 6.695 3.340 -3.748 1.00 0.00 H new ATOM 0 HB1 ALA A1027 7.678 3.562 -1.506 1.00 0.00 H new ATOM 0 HB2 ALA A1027 7.955 5.022 -2.485 1.00 0.00 H new ATOM 0 HB3 ALA A1027 6.702 5.022 -1.221 1.00 0.00 H new ATOM 1842 N LEU A1028 4.144 3.690 -1.709 1.00 0.00 N ATOM 1843 CA LEU A1028 2.994 2.943 -1.251 1.00 0.00 C ATOM 1844 C LEU A1028 2.333 2.260 -2.438 1.00 0.00 C ATOM 1845 O LEU A1028 2.055 1.075 -2.391 1.00 0.00 O ATOM 1846 CB LEU A1028 1.997 3.841 -0.523 1.00 0.00 C ATOM 1847 CG LEU A1028 2.507 4.481 0.766 1.00 0.00 C ATOM 1848 CD1 LEU A1028 1.335 4.973 1.579 1.00 0.00 C ATOM 1849 CD2 LEU A1028 3.335 3.488 1.553 1.00 0.00 C ATOM 0 H LEU A1028 4.110 4.692 -1.523 1.00 0.00 H new ATOM 0 HA LEU A1028 3.330 2.190 -0.538 1.00 0.00 H new ATOM 0 HB2 LEU A1028 1.685 4.634 -1.203 1.00 0.00 H new ATOM 0 HB3 LEU A1028 1.109 3.254 -0.290 1.00 0.00 H new ATOM 0 HG LEU A1028 3.146 5.330 0.523 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.697 5.430 2.500 1.00 0.00 H new ATOM 0 HD12 LEU A1028 0.777 5.711 1.003 1.00 0.00 H new ATOM 0 HD13 LEU A1028 0.683 4.134 1.823 1.00 0.00 H new ATOM 0 HD21 LEU A1028 3.692 3.958 2.469 1.00 0.00 H new ATOM 0 HD22 LEU A1028 2.723 2.622 1.804 1.00 0.00 H new ATOM 0 HD23 LEU A1028 4.187 3.169 0.953 1.00 0.00 H new ATOM 1861 N ALA A1029 2.109 3.004 -3.506 1.00 0.00 N ATOM 1862 CA ALA A1029 1.577 2.435 -4.734 1.00 0.00 C ATOM 1863 C ALA A1029 2.472 1.317 -5.262 1.00 0.00 C ATOM 1864 O ALA A1029 1.979 0.271 -5.680 1.00 0.00 O ATOM 1865 CB ALA A1029 1.411 3.521 -5.790 1.00 0.00 C ATOM 0 H ALA A1029 2.288 4.007 -3.549 1.00 0.00 H new ATOM 0 HA ALA A1029 0.601 2.005 -4.509 1.00 0.00 H new ATOM 0 HB1 ALA A1029 1.012 3.082 -6.704 1.00 0.00 H new ATOM 0 HB2 ALA A1029 0.723 4.283 -5.423 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.379 3.976 -5.999 1.00 0.00 H new ATOM 1871 N VAL A1030 3.784 1.529 -5.228 1.00 0.00 N ATOM 1872 CA VAL A1030 4.717 0.557 -5.774 1.00 0.00 C ATOM 1873 C VAL A1030 4.745 -0.706 -4.923 1.00 0.00 C ATOM 1874 O VAL A1030 4.588 -1.820 -5.425 1.00 0.00 O ATOM 1875 CB VAL A1030 6.148 1.146 -5.867 1.00 0.00 C ATOM 1876 CG1 VAL A1030 7.196 0.046 -5.951 1.00 0.00 C ATOM 1877 CG2 VAL A1030 6.271 2.054 -7.080 1.00 0.00 C ATOM 0 H VAL A1030 4.220 2.361 -4.830 1.00 0.00 H new ATOM 0 HA VAL A1030 4.373 0.305 -6.777 1.00 0.00 H new ATOM 0 HB VAL A1030 6.323 1.724 -4.960 1.00 0.00 H new ATOM 0 HG11 VAL A1030 8.188 0.493 -6.015 1.00 0.00 H new ATOM 0 HG12 VAL A1030 7.137 -0.581 -5.061 1.00 0.00 H new ATOM 0 HG13 VAL A1030 7.014 -0.563 -6.837 1.00 0.00 H new ATOM 0 HG21 VAL A1030 7.282 2.459 -7.130 1.00 0.00 H new ATOM 0 HG22 VAL A1030 6.064 1.483 -7.985 1.00 0.00 H new ATOM 0 HG23 VAL A1030 5.556 2.872 -6.996 1.00 0.00 H new ATOM 1887 N ASP A1031 4.942 -0.512 -3.625 1.00 0.00 N ATOM 1888 CA ASP A1031 5.101 -1.617 -2.699 1.00 0.00 C ATOM 1889 C ASP A1031 3.779 -2.286 -2.352 1.00 0.00 C ATOM 1890 O ASP A1031 3.759 -3.459 -2.039 1.00 0.00 O ATOM 1891 CB ASP A1031 5.862 -1.187 -1.447 1.00 0.00 C ATOM 1892 CG ASP A1031 7.356 -1.118 -1.704 1.00 0.00 C ATOM 1893 OD1 ASP A1031 7.976 -2.188 -1.904 1.00 0.00 O ATOM 1894 OD2 ASP A1031 7.913 -0.004 -1.732 1.00 0.00 O ATOM 0 H ASP A1031 4.995 0.409 -3.191 1.00 0.00 H new ATOM 0 HA ASP A1031 5.700 -2.371 -3.210 1.00 0.00 H new ATOM 0 HB2 ASP A1031 5.502 -0.212 -1.118 1.00 0.00 H new ATOM 0 HB3 ASP A1031 5.662 -1.890 -0.638 1.00 0.00 H new ATOM 1899 N ALA A1032 2.679 -1.546 -2.376 1.00 0.00 N ATOM 1900 CA ALA A1032 1.355 -2.160 -2.219 1.00 0.00 C ATOM 1901 C ALA A1032 1.017 -2.975 -3.462 1.00 0.00 C ATOM 1902 O ALA A1032 0.348 -4.010 -3.367 1.00 0.00 O ATOM 1903 CB ALA A1032 0.274 -1.131 -1.933 1.00 0.00 C ATOM 0 H ALA A1032 2.669 -0.534 -2.500 1.00 0.00 H new ATOM 0 HA ALA A1032 1.392 -2.821 -1.353 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -0.687 -1.634 -1.825 1.00 0.00 H new ATOM 0 HB2 ALA A1032 0.512 -0.600 -1.011 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.221 -0.420 -2.758 1.00 0.00 H new ATOM 1909 N LYS A1033 1.514 -2.543 -4.611 1.00 0.00 N ATOM 1910 CA LYS A1033 1.461 -3.359 -5.814 1.00 0.00 C ATOM 1911 C LYS A1033 2.300 -4.609 -5.579 1.00 0.00 C ATOM 1912 O LYS A1033 1.855 -5.740 -5.779 1.00 0.00 O ATOM 1913 CB LYS A1033 2.030 -2.567 -7.001 1.00 0.00 C ATOM 1914 CG LYS A1033 1.637 -3.098 -8.382 1.00 0.00 C ATOM 1915 CD LYS A1033 2.727 -3.955 -9.021 1.00 0.00 C ATOM 1916 CE LYS A1033 2.539 -5.437 -8.733 1.00 0.00 C ATOM 1917 NZ LYS A1033 3.569 -6.274 -9.403 1.00 0.00 N ATOM 0 H LYS A1033 1.958 -1.633 -4.736 1.00 0.00 H new ATOM 0 HA LYS A1033 0.431 -3.635 -6.038 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.700 -1.532 -6.919 1.00 0.00 H new ATOM 0 HB3 LYS A1033 3.117 -2.561 -6.927 1.00 0.00 H new ATOM 0 HG2 LYS A1033 0.724 -3.687 -8.293 1.00 0.00 H new ATOM 0 HG3 LYS A1033 1.411 -2.257 -9.038 1.00 0.00 H new ATOM 0 HD2 LYS A1033 2.728 -3.794 -10.099 1.00 0.00 H new ATOM 0 HD3 LYS A1033 3.701 -3.636 -8.650 1.00 0.00 H new ATOM 0 HE2 LYS A1033 2.581 -5.604 -7.657 1.00 0.00 H new ATOM 0 HE3 LYS A1033 1.548 -5.747 -9.066 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 3.274 -7.271 -9.381 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 3.677 -5.967 -10.391 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 4.477 -6.171 -8.907 1.00 0.00 H new ATOM 1931 N ASN A1034 3.518 -4.360 -5.107 1.00 0.00 N ATOM 1932 CA ASN A1034 4.528 -5.387 -4.888 1.00 0.00 C ATOM 1933 C ASN A1034 4.115 -6.392 -3.818 1.00 0.00 C ATOM 1934 O ASN A1034 4.122 -7.585 -4.062 1.00 0.00 O ATOM 1935 CB ASN A1034 5.839 -4.719 -4.473 1.00 0.00 C ATOM 1936 CG ASN A1034 6.968 -5.701 -4.212 1.00 0.00 C ATOM 1937 OD1 ASN A1034 7.069 -6.747 -4.850 1.00 0.00 O ATOM 1938 ND2 ASN A1034 7.826 -5.365 -3.258 1.00 0.00 N ATOM 0 H ASN A1034 3.835 -3.422 -4.862 1.00 0.00 H new ATOM 0 HA ASN A1034 4.649 -5.935 -5.822 1.00 0.00 H new ATOM 0 HB2 ASN A1034 6.146 -4.025 -5.255 1.00 0.00 H new ATOM 0 HB3 ASN A1034 5.667 -4.129 -3.573 1.00 0.00 H new ATOM 0 HD21 ASN A1034 8.604 -5.984 -3.031 1.00 0.00 H new ATOM 0 HD22 ASN A1034 7.707 -4.488 -2.751 1.00 0.00 H new ATOM 1945 N LEU A1035 3.760 -5.904 -2.634 1.00 0.00 N ATOM 1946 CA LEU A1035 3.509 -6.772 -1.494 1.00 0.00 C ATOM 1947 C LEU A1035 2.367 -7.735 -1.796 1.00 0.00 C ATOM 1948 O LEU A1035 2.450 -8.909 -1.437 1.00 0.00 O ATOM 1949 CB LEU A1035 3.251 -5.964 -0.214 1.00 0.00 C ATOM 1950 CG LEU A1035 1.865 -5.323 -0.081 1.00 0.00 C ATOM 1951 CD1 LEU A1035 0.885 -6.266 0.608 1.00 0.00 C ATOM 1952 CD2 LEU A1035 1.960 -4.024 0.685 1.00 0.00 C ATOM 0 H LEU A1035 3.640 -4.910 -2.441 1.00 0.00 H new ATOM 0 HA LEU A1035 4.407 -7.364 -1.315 1.00 0.00 H new ATOM 0 HB2 LEU A1035 3.407 -6.621 0.642 1.00 0.00 H new ATOM 0 HB3 LEU A1035 4.000 -5.175 -0.151 1.00 0.00 H new ATOM 0 HG LEU A1035 1.492 -5.119 -1.085 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -0.089 -5.784 0.688 1.00 0.00 H new ATOM 0 HD12 LEU A1035 0.790 -7.182 0.024 1.00 0.00 H new ATOM 0 HD13 LEU A1035 1.253 -6.508 1.605 1.00 0.00 H new ATOM 0 HD21 LEU A1035 0.969 -3.580 0.772 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.360 -4.217 1.681 1.00 0.00 H new ATOM 0 HD23 LEU A1035 2.620 -3.337 0.156 1.00 0.00 H new ATOM 1964 N LEU A1036 1.299 -7.273 -2.445 1.00 0.00 N ATOM 1965 CA LEU A1036 0.228 -8.205 -2.743 1.00 0.00 C ATOM 1966 C LEU A1036 0.716 -9.214 -3.796 1.00 0.00 C ATOM 1967 O LEU A1036 0.493 -10.419 -3.680 1.00 0.00 O ATOM 1968 CB LEU A1036 -1.048 -7.440 -3.150 1.00 0.00 C ATOM 1969 CG LEU A1036 -2.191 -8.248 -3.781 1.00 0.00 C ATOM 1970 CD1 LEU A1036 -1.904 -8.516 -5.248 1.00 0.00 C ATOM 1971 CD2 LEU A1036 -2.434 -9.550 -3.023 1.00 0.00 C ATOM 0 H LEU A1036 1.159 -6.312 -2.758 1.00 0.00 H new ATOM 0 HA LEU A1036 -0.044 -8.780 -1.858 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -1.439 -6.942 -2.262 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -0.761 -6.658 -3.853 1.00 0.00 H new ATOM 0 HG LEU A1036 -3.103 -7.655 -3.712 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -2.724 -9.090 -5.680 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -1.805 -7.569 -5.778 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -0.977 -9.082 -5.340 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -3.249 -10.099 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -1.529 -10.157 -3.043 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -2.698 -9.326 -1.990 1.00 0.00 H new ATOM 1983 N ASP A1037 1.402 -8.677 -4.813 1.00 0.00 N ATOM 1984 CA ASP A1037 2.072 -9.467 -5.858 1.00 0.00 C ATOM 1985 C ASP A1037 2.927 -10.562 -5.225 1.00 0.00 C ATOM 1986 O ASP A1037 2.956 -11.710 -5.665 1.00 0.00 O ATOM 1987 CB ASP A1037 2.969 -8.519 -6.668 1.00 0.00 C ATOM 1988 CG ASP A1037 3.682 -9.179 -7.831 1.00 0.00 C ATOM 1989 OD1 ASP A1037 4.701 -9.857 -7.601 1.00 0.00 O ATOM 1990 OD2 ASP A1037 3.258 -8.965 -8.988 1.00 0.00 O ATOM 0 H ASP A1037 1.510 -7.670 -4.936 1.00 0.00 H new ATOM 0 HA ASP A1037 1.330 -9.938 -6.502 1.00 0.00 H new ATOM 0 HB2 ASP A1037 2.361 -7.698 -7.048 1.00 0.00 H new ATOM 0 HB3 ASP A1037 3.713 -8.083 -6.001 1.00 0.00 H new ATOM 1995 N VAL A1038 3.619 -10.150 -4.175 1.00 0.00 N ATOM 1996 CA VAL A1038 4.445 -11.009 -3.344 1.00 0.00 C ATOM 1997 C VAL A1038 3.651 -12.172 -2.760 1.00 0.00 C ATOM 1998 O VAL A1038 4.097 -13.305 -2.859 1.00 0.00 O ATOM 1999 CB VAL A1038 5.130 -10.185 -2.221 1.00 0.00 C ATOM 2000 CG1 VAL A1038 5.650 -11.077 -1.109 1.00 0.00 C ATOM 2001 CG2 VAL A1038 6.270 -9.357 -2.791 1.00 0.00 C ATOM 0 H VAL A1038 3.621 -9.177 -3.868 1.00 0.00 H new ATOM 0 HA VAL A1038 5.218 -11.438 -3.982 1.00 0.00 H new ATOM 0 HB VAL A1038 4.376 -9.521 -1.798 1.00 0.00 H new ATOM 0 HG11 VAL A1038 6.123 -10.464 -0.342 1.00 0.00 H new ATOM 0 HG12 VAL A1038 4.821 -11.632 -0.670 1.00 0.00 H new ATOM 0 HG13 VAL A1038 6.380 -11.777 -1.515 1.00 0.00 H new ATOM 0 HG21 VAL A1038 6.740 -8.785 -1.991 1.00 0.00 H new ATOM 0 HG22 VAL A1038 7.008 -10.018 -3.246 1.00 0.00 H new ATOM 0 HG23 VAL A1038 5.881 -8.673 -3.546 1.00 0.00 H new ATOM 2011 N ILE A1039 2.494 -11.921 -2.174 1.00 0.00 N ATOM 2012 CA ILE A1039 1.679 -13.021 -1.662 1.00 0.00 C ATOM 2013 C ILE A1039 1.073 -13.839 -2.795 1.00 0.00 C ATOM 2014 O ILE A1039 0.915 -15.050 -2.653 1.00 0.00 O ATOM 2015 CB ILE A1039 0.589 -12.569 -0.660 1.00 0.00 C ATOM 2016 CG1 ILE A1039 1.213 -12.343 0.706 1.00 0.00 C ATOM 2017 CG2 ILE A1039 -0.543 -13.580 -0.548 1.00 0.00 C ATOM 2018 CD1 ILE A1039 1.831 -10.981 0.868 1.00 0.00 C ATOM 0 H ILE A1039 2.100 -10.990 -2.040 1.00 0.00 H new ATOM 0 HA ILE A1039 2.363 -13.658 -1.101 1.00 0.00 H new ATOM 0 HB ILE A1039 0.162 -11.639 -1.035 1.00 0.00 H new ATOM 0 HG12 ILE A1039 0.450 -12.480 1.472 1.00 0.00 H new ATOM 0 HG13 ILE A1039 1.976 -13.102 0.878 1.00 0.00 H new ATOM 0 HG21 ILE A1039 -1.283 -13.220 0.166 1.00 0.00 H new ATOM 0 HG22 ILE A1039 -1.013 -13.710 -1.523 1.00 0.00 H new ATOM 0 HG23 ILE A1039 -0.145 -14.536 -0.207 1.00 0.00 H new ATOM 0 HD11 ILE A1039 2.257 -10.891 1.867 1.00 0.00 H new ATOM 0 HD12 ILE A1039 2.617 -10.848 0.125 1.00 0.00 H new ATOM 0 HD13 ILE A1039 1.067 -10.216 0.729 1.00 0.00 H new ATOM 2030 N ASP A1040 0.779 -13.216 -3.916 1.00 0.00 N ATOM 2031 CA ASP A1040 0.315 -13.961 -5.080 1.00 0.00 C ATOM 2032 C ASP A1040 1.398 -14.919 -5.570 1.00 0.00 C ATOM 2033 O ASP A1040 1.140 -16.109 -5.801 1.00 0.00 O ATOM 2034 CB ASP A1040 -0.116 -13.011 -6.184 1.00 0.00 C ATOM 2035 CG ASP A1040 -1.552 -13.274 -6.612 1.00 0.00 C ATOM 2036 OD1 ASP A1040 -2.458 -13.146 -5.761 1.00 0.00 O ATOM 2037 OD2 ASP A1040 -1.776 -13.645 -7.788 1.00 0.00 O ATOM 0 H ASP A1040 0.850 -12.208 -4.052 1.00 0.00 H new ATOM 0 HA ASP A1040 -0.552 -14.554 -4.789 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -0.020 -11.982 -5.839 1.00 0.00 H new ATOM 0 HB3 ASP A1040 0.547 -13.122 -7.042 1.00 0.00 H new ATOM 2042 N GLN A1041 2.616 -14.418 -5.696 1.00 0.00 N ATOM 2043 CA GLN A1041 3.753 -15.270 -5.991 1.00 0.00 C ATOM 2044 C GLN A1041 3.944 -16.283 -4.872 1.00 0.00 C ATOM 2045 O GLN A1041 4.127 -17.465 -5.118 1.00 0.00 O ATOM 2046 CB GLN A1041 5.021 -14.438 -6.154 1.00 0.00 C ATOM 2047 CG GLN A1041 5.140 -13.774 -7.510 1.00 0.00 C ATOM 2048 CD GLN A1041 6.478 -13.095 -7.715 1.00 0.00 C ATOM 2049 OE1 GLN A1041 7.441 -13.717 -8.159 1.00 0.00 O ATOM 2050 NE2 GLN A1041 6.543 -11.812 -7.422 1.00 0.00 N ATOM 0 H GLN A1041 2.841 -13.428 -5.599 1.00 0.00 H new ATOM 0 HA GLN A1041 3.558 -15.795 -6.926 1.00 0.00 H new ATOM 0 HB2 GLN A1041 5.044 -13.671 -5.380 1.00 0.00 H new ATOM 0 HB3 GLN A1041 5.889 -15.078 -5.995 1.00 0.00 H new ATOM 0 HG2 GLN A1041 4.994 -14.522 -8.290 1.00 0.00 H new ATOM 0 HG3 GLN A1041 4.343 -13.038 -7.620 1.00 0.00 H new ATOM 0 HE21 GLN A1041 5.722 -11.330 -7.055 1.00 0.00 H new ATOM 0 HE22 GLN A1041 7.414 -11.300 -7.562 1.00 0.00 H new ATOM 2059 N ALA A1042 3.835 -15.795 -3.642 1.00 0.00 N ATOM 2060 CA ALA A1042 4.056 -16.575 -2.431 1.00 0.00 C ATOM 2061 C ALA A1042 3.225 -17.838 -2.364 1.00 0.00 C ATOM 2062 O ALA A1042 3.748 -18.919 -2.103 1.00 0.00 O ATOM 2063 CB ALA A1042 3.687 -15.722 -1.247 1.00 0.00 C ATOM 0 H ALA A1042 3.585 -14.824 -3.455 1.00 0.00 H new ATOM 0 HA ALA A1042 5.105 -16.871 -2.431 1.00 0.00 H new ATOM 0 HB1 ALA A1042 3.845 -16.287 -0.328 1.00 0.00 H new ATOM 0 HB2 ALA A1042 4.310 -14.828 -1.235 1.00 0.00 H new ATOM 0 HB3 ALA A1042 2.639 -15.433 -1.319 1.00 0.00 H new ATOM 2069 N ARG A1043 1.931 -17.692 -2.578 1.00 0.00 N ATOM 2070 CA ARG A1043 1.004 -18.802 -2.437 1.00 0.00 C ATOM 2071 C ARG A1043 1.314 -19.889 -3.460 1.00 0.00 C ATOM 2072 O ARG A1043 1.408 -21.062 -3.112 1.00 0.00 O ATOM 2073 CB ARG A1043 -0.434 -18.304 -2.593 1.00 0.00 C ATOM 2074 CG ARG A1043 -0.554 -17.274 -3.695 1.00 0.00 C ATOM 2075 CD ARG A1043 -1.938 -16.645 -3.773 1.00 0.00 C ATOM 2076 NE ARG A1043 -2.367 -16.078 -2.496 1.00 0.00 N ATOM 2077 CZ ARG A1043 -3.197 -15.039 -2.383 1.00 0.00 C ATOM 2078 NH1 ARG A1043 -3.536 -14.323 -3.451 1.00 0.00 N ATOM 2079 NH2 ARG A1043 -3.638 -14.673 -1.186 1.00 0.00 N ATOM 0 H ARG A1043 1.495 -16.811 -2.852 1.00 0.00 H new ATOM 0 HA ARG A1043 1.117 -19.233 -1.442 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -1.089 -19.147 -2.810 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -0.773 -17.871 -1.652 1.00 0.00 H new ATOM 0 HG2 ARG A1043 0.187 -16.490 -3.535 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -0.320 -17.743 -4.651 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -1.936 -15.863 -4.532 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -2.658 -17.398 -4.093 1.00 0.00 H new ATOM 0 HE ARG A1043 -2.011 -16.502 -1.640 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -3.161 -14.566 -4.368 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -4.171 -13.531 -3.353 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -3.343 -15.185 -0.355 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -4.272 -13.879 -1.097 1.00 0.00 H new ATOM 2093 N LEU A1044 1.511 -19.493 -4.716 1.00 0.00 N ATOM 2094 CA LEU A1044 1.820 -20.459 -5.770 1.00 0.00 C ATOM 2095 C LEU A1044 3.261 -20.949 -5.658 1.00 0.00 C ATOM 2096 O LEU A1044 3.602 -22.017 -6.159 1.00 0.00 O ATOM 2097 CB LEU A1044 1.578 -19.861 -7.163 1.00 0.00 C ATOM 2098 CG LEU A1044 0.119 -19.837 -7.640 1.00 0.00 C ATOM 2099 CD1 LEU A1044 -0.505 -21.218 -7.518 1.00 0.00 C ATOM 2100 CD2 LEU A1044 -0.699 -18.812 -6.872 1.00 0.00 C ATOM 0 H LEU A1044 1.463 -18.523 -5.027 1.00 0.00 H new ATOM 0 HA LEU A1044 1.150 -21.308 -5.638 1.00 0.00 H new ATOM 0 HB2 LEU A1044 1.959 -18.840 -7.169 1.00 0.00 H new ATOM 0 HB3 LEU A1044 2.167 -20.425 -7.886 1.00 0.00 H new ATOM 0 HG LEU A1044 0.117 -19.545 -8.690 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -1.539 -21.182 -7.861 1.00 0.00 H new ATOM 0 HD12 LEU A1044 0.055 -21.926 -8.129 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -0.479 -21.538 -6.476 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -1.727 -18.821 -7.235 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -0.687 -19.058 -5.810 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -0.271 -17.820 -7.019 1.00 0.00 H new ATOM 2112 N LYS A1045 4.094 -20.167 -4.987 1.00 0.00 N ATOM 2113 CA LYS A1045 5.483 -20.501 -4.778 1.00 0.00 C ATOM 2114 C LYS A1045 5.590 -21.483 -3.622 1.00 0.00 C ATOM 2115 O LYS A1045 6.430 -22.374 -3.649 1.00 0.00 O ATOM 2116 CB LYS A1045 6.283 -19.216 -4.518 1.00 0.00 C ATOM 2117 CG LYS A1045 7.794 -19.374 -4.528 1.00 0.00 C ATOM 2118 CD LYS A1045 8.288 -19.953 -3.226 1.00 0.00 C ATOM 2119 CE LYS A1045 9.735 -19.572 -2.944 1.00 0.00 C ATOM 2120 NZ LYS A1045 10.669 -20.010 -4.020 1.00 0.00 N ATOM 0 H LYS A1045 3.817 -19.278 -4.572 1.00 0.00 H new ATOM 0 HA LYS A1045 5.902 -20.978 -5.664 1.00 0.00 H new ATOM 0 HB2 LYS A1045 6.007 -18.478 -5.271 1.00 0.00 H new ATOM 0 HB3 LYS A1045 5.984 -18.812 -3.551 1.00 0.00 H new ATOM 0 HG2 LYS A1045 8.090 -20.022 -5.353 1.00 0.00 H new ATOM 0 HG3 LYS A1045 8.263 -18.405 -4.700 1.00 0.00 H new ATOM 0 HD2 LYS A1045 7.655 -19.603 -2.410 1.00 0.00 H new ATOM 0 HD3 LYS A1045 8.198 -21.039 -3.255 1.00 0.00 H new ATOM 0 HE2 LYS A1045 9.805 -18.491 -2.827 1.00 0.00 H new ATOM 0 HE3 LYS A1045 10.045 -20.016 -1.998 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 11.641 -20.023 -3.651 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 10.407 -20.964 -4.340 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 10.611 -19.348 -4.820 1.00 0.00 H new ATOM 2134 N MET A1046 4.725 -21.340 -2.618 1.00 0.00 N ATOM 2135 CA MET A1046 4.643 -22.348 -1.573 1.00 0.00 C ATOM 2136 C MET A1046 4.189 -23.681 -2.167 1.00 0.00 C ATOM 2137 O MET A1046 4.575 -24.748 -1.697 1.00 0.00 O ATOM 2138 CB MET A1046 3.702 -21.915 -0.444 1.00 0.00 C ATOM 2139 CG MET A1046 4.423 -21.536 0.818 1.00 0.00 C ATOM 2140 SD MET A1046 5.350 -22.913 1.525 1.00 0.00 S ATOM 2141 CE MET A1046 4.108 -24.207 1.567 1.00 0.00 C ATOM 0 H MET A1046 4.086 -20.552 -2.510 1.00 0.00 H new ATOM 0 HA MET A1046 5.637 -22.468 -1.142 1.00 0.00 H new ATOM 0 HB2 MET A1046 3.106 -21.067 -0.782 1.00 0.00 H new ATOM 0 HB3 MET A1046 3.008 -22.727 -0.228 1.00 0.00 H new ATOM 0 HG2 MET A1046 5.105 -20.712 0.609 1.00 0.00 H new ATOM 0 HG3 MET A1046 3.701 -21.174 1.550 1.00 0.00 H new ATOM 0 HE1 MET A1046 4.146 -24.716 2.530 1.00 0.00 H new ATOM 0 HE2 MET A1046 3.120 -23.768 1.427 1.00 0.00 H new ATOM 0 HE3 MET A1046 4.303 -24.924 0.769 1.00 0.00 H new ATOM 2151 N ILE A1047 3.382 -23.604 -3.218 1.00 0.00 N ATOM 2152 CA ILE A1047 2.951 -24.789 -3.950 1.00 0.00 C ATOM 2153 C ILE A1047 4.054 -25.249 -4.903 1.00 0.00 C ATOM 2154 O ILE A1047 4.109 -26.411 -5.306 1.00 0.00 O ATOM 2155 CB ILE A1047 1.668 -24.499 -4.764 1.00 0.00 C ATOM 2156 CG1 ILE A1047 0.591 -23.902 -3.855 1.00 0.00 C ATOM 2157 CG2 ILE A1047 1.152 -25.769 -5.437 1.00 0.00 C ATOM 2158 CD1 ILE A1047 -0.671 -23.493 -4.582 1.00 0.00 C ATOM 0 H ILE A1047 3.011 -22.727 -3.584 1.00 0.00 H new ATOM 0 HA ILE A1047 2.740 -25.574 -3.223 1.00 0.00 H new ATOM 0 HB ILE A1047 1.911 -23.777 -5.544 1.00 0.00 H new ATOM 0 HG12 ILE A1047 0.335 -24.630 -3.086 1.00 0.00 H new ATOM 0 HG13 ILE A1047 1.003 -23.031 -3.345 1.00 0.00 H new ATOM 0 HG21 ILE A1047 0.249 -25.540 -6.003 1.00 0.00 H new ATOM 0 HG22 ILE A1047 1.914 -26.159 -6.112 1.00 0.00 H new ATOM 0 HG23 ILE A1047 0.923 -26.516 -4.677 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -1.384 -23.080 -3.869 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -0.431 -22.740 -5.333 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -1.109 -24.364 -5.069 1.00 0.00 H new ATOM 2170 N SER A1048 4.947 -24.330 -5.240 1.00 0.00 N ATOM 2171 CA SER A1048 5.993 -24.600 -6.211 1.00 0.00 C ATOM 2172 C SER A1048 7.255 -25.138 -5.536 1.00 0.00 C ATOM 2173 O SER A1048 8.241 -25.450 -6.205 1.00 0.00 O ATOM 2174 CB SER A1048 6.319 -23.332 -7.011 1.00 0.00 C ATOM 2175 OG SER A1048 7.283 -23.593 -8.018 1.00 0.00 O ATOM 0 H SER A1048 4.966 -23.387 -4.852 1.00 0.00 H new ATOM 0 HA SER A1048 5.625 -25.366 -6.893 1.00 0.00 H new ATOM 0 HB2 SER A1048 5.409 -22.943 -7.468 1.00 0.00 H new ATOM 0 HB3 SER A1048 6.693 -22.560 -6.338 1.00 0.00 H new ATOM 0 HG SER A1048 7.856 -24.337 -7.738 1.00 0.00 H new ATOM 2181 N GLN A1049 7.221 -25.255 -4.218 1.00 0.00 N ATOM 2182 CA GLN A1049 8.376 -25.732 -3.472 1.00 0.00 C ATOM 2183 C GLN A1049 8.060 -27.039 -2.764 1.00 0.00 C ATOM 2184 O GLN A1049 6.962 -27.583 -2.893 1.00 0.00 O ATOM 2185 CB GLN A1049 8.810 -24.701 -2.427 1.00 0.00 C ATOM 2186 CG GLN A1049 9.238 -23.364 -3.001 1.00 0.00 C ATOM 2187 CD GLN A1049 10.480 -23.452 -3.865 1.00 0.00 C ATOM 2188 OE1 GLN A1049 10.645 -22.676 -4.805 1.00 0.00 O ATOM 2189 NE2 GLN A1049 11.367 -24.381 -3.544 1.00 0.00 N ATOM 0 H GLN A1049 6.409 -25.027 -3.644 1.00 0.00 H new ATOM 0 HA GLN A1049 9.183 -25.891 -4.187 1.00 0.00 H new ATOM 0 HB2 GLN A1049 7.986 -24.537 -1.733 1.00 0.00 H new ATOM 0 HB3 GLN A1049 9.636 -25.115 -1.848 1.00 0.00 H new ATOM 0 HG2 GLN A1049 8.421 -22.952 -3.593 1.00 0.00 H new ATOM 0 HG3 GLN A1049 9.422 -22.667 -2.183 1.00 0.00 H new ATOM 0 HE21 GLN A1049 11.190 -25.004 -2.756 1.00 0.00 H new ATOM 0 HE22 GLN A1049 12.227 -24.473 -4.084 1.00 0.00 H new ATOM 2198 N SER A1050 9.036 -27.540 -2.030 1.00 0.00 N ATOM 2199 CA SER A1050 8.822 -28.643 -1.116 1.00 0.00 C ATOM 2200 C SER A1050 9.305 -28.197 0.261 1.00 0.00 C ATOM 2201 O SER A1050 9.555 -29.000 1.160 1.00 0.00 O ATOM 2202 CB SER A1050 9.583 -29.883 -1.598 1.00 0.00 C ATOM 2203 OG SER A1050 9.184 -31.047 -0.891 1.00 0.00 O ATOM 0 H SER A1050 9.995 -27.194 -2.051 1.00 0.00 H new ATOM 0 HA SER A1050 7.767 -28.912 -1.069 1.00 0.00 H new ATOM 0 HB2 SER A1050 9.408 -30.026 -2.664 1.00 0.00 H new ATOM 0 HB3 SER A1050 10.654 -29.727 -1.468 1.00 0.00 H new ATOM 0 HG SER A1050 9.191 -30.864 0.072 1.00 0.00 H new ATOM 2209 N ARG A1051 9.428 -26.885 0.391 1.00 0.00 N ATOM 2210 CA ARG A1051 9.976 -26.242 1.571 1.00 0.00 C ATOM 2211 C ARG A1051 9.273 -24.900 1.736 1.00 0.00 C ATOM 2212 O ARG A1051 8.968 -24.262 0.733 1.00 0.00 O ATOM 2213 CB ARG A1051 11.486 -26.059 1.374 1.00 0.00 C ATOM 2214 CG ARG A1051 12.243 -25.535 2.584 1.00 0.00 C ATOM 2215 CD ARG A1051 13.733 -25.483 2.292 1.00 0.00 C ATOM 2216 NE ARG A1051 14.523 -25.003 3.422 1.00 0.00 N ATOM 2217 CZ ARG A1051 15.850 -25.116 3.490 1.00 0.00 C ATOM 2218 NH1 ARG A1051 16.519 -25.721 2.514 1.00 0.00 N ATOM 2219 NH2 ARG A1051 16.502 -24.628 4.533 1.00 0.00 N ATOM 0 H ARG A1051 9.144 -26.227 -0.335 1.00 0.00 H new ATOM 0 HA ARG A1051 9.819 -26.841 2.468 1.00 0.00 H new ATOM 0 HB2 ARG A1051 11.916 -27.018 1.085 1.00 0.00 H new ATOM 0 HB3 ARG A1051 11.646 -25.374 0.542 1.00 0.00 H new ATOM 0 HG2 ARG A1051 11.882 -24.540 2.845 1.00 0.00 H new ATOM 0 HG3 ARG A1051 12.056 -26.178 3.444 1.00 0.00 H new ATOM 0 HD2 ARG A1051 14.077 -26.479 2.013 1.00 0.00 H new ATOM 0 HD3 ARG A1051 13.906 -24.834 1.434 1.00 0.00 H new ATOM 0 HE ARG A1051 14.035 -24.558 4.199 1.00 0.00 H new ATOM 0 HH11 ARG A1051 16.017 -26.100 1.711 1.00 0.00 H new ATOM 0 HH12 ARG A1051 17.534 -25.806 2.568 1.00 0.00 H new ATOM 0 HH21 ARG A1051 15.990 -24.166 5.284 1.00 0.00 H new ATOM 0 HH22 ARG A1051 17.517 -24.714 4.586 1.00 0.00 H new ATOM 2233 N PRO A1052 8.968 -24.482 2.981 1.00 0.00 N ATOM 2234 CA PRO A1052 8.198 -23.254 3.256 1.00 0.00 C ATOM 2235 C PRO A1052 8.704 -22.010 2.517 1.00 0.00 C ATOM 2236 O PRO A1052 9.564 -21.283 3.019 1.00 0.00 O ATOM 2237 CB PRO A1052 8.346 -23.075 4.767 1.00 0.00 C ATOM 2238 CG PRO A1052 8.551 -24.454 5.287 1.00 0.00 C ATOM 2239 CD PRO A1052 9.335 -25.182 4.227 1.00 0.00 C ATOM 0 HA PRO A1052 7.170 -23.358 2.909 1.00 0.00 H new ATOM 0 HB2 PRO A1052 9.190 -22.430 5.009 1.00 0.00 H new ATOM 0 HB3 PRO A1052 7.458 -22.615 5.201 1.00 0.00 H new ATOM 0 HG2 PRO A1052 9.093 -24.438 6.232 1.00 0.00 H new ATOM 0 HG3 PRO A1052 7.597 -24.947 5.475 1.00 0.00 H new ATOM 0 HD2 PRO A1052 10.407 -25.130 4.415 1.00 0.00 H new ATOM 0 HD3 PRO A1052 9.069 -26.238 4.186 1.00 0.00 H new ATOM 2247 N HIS A1053 8.139 -21.799 1.325 1.00 0.00 N ATOM 2248 CA HIS A1053 8.444 -20.663 0.453 1.00 0.00 C ATOM 2249 C HIS A1053 9.954 -20.398 0.358 1.00 0.00 C ATOM 2250 CB HIS A1053 7.685 -19.401 0.910 1.00 0.00 C ATOM 2251 CG HIS A1053 7.773 -18.259 -0.064 1.00 0.00 C ATOM 2252 ND1 HIS A1053 8.951 -17.598 -0.314 1.00 0.00 N ATOM 2253 CD2 HIS A1053 6.842 -17.680 -0.878 1.00 0.00 C ATOM 2254 CE1 HIS A1053 8.759 -16.671 -1.225 1.00 0.00 C ATOM 2255 NE2 HIS A1053 7.490 -16.694 -1.591 1.00 0.00 N ATOM 0 H HIS A1053 7.440 -22.429 0.931 1.00 0.00 H new ATOM 0 HA HIS A1053 8.103 -20.923 -0.549 1.00 0.00 H new ATOM 0 HB2 HIS A1053 6.636 -19.655 1.066 1.00 0.00 H new ATOM 0 HB3 HIS A1053 8.081 -19.078 1.873 1.00 0.00 H new ATOM 0 HD2 HIS A1053 5.797 -17.944 -0.950 1.00 0.00 H new ATOM 0 HE1 HIS A1053 9.513 -16.001 -1.611 1.00 0.00 H new ATOM 0 HE2 HIS A1053 7.061 -16.083 -2.286 1.00 0.00 H new TER 2264 HIS A1053