USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=37 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: A1000 ASN : amide:sc= -4.08! C(o=-3!,f=-7.1!) USER MOD Set 1.2: A1001 LYS NZ :NH3+ 167:sc= 1.09 (180deg=0.677) USER MOD Set 2.1: A 979 SER OG : rot 180:sc=0.000694 USER MOD Set 2.2: A 980 THR OG1 : rot 60:sc= -0.435 USER MOD Set 3.1: A 928 ASN : amide:sc= -3.65! C(o=-2.7!,f=-14!) USER MOD Set 3.2: A 968 THR OG1 : rot -128:sc= 0.913 USER MOD Set 4.1: A 954 MET CE :methyl 171:sc= -1.95 (180deg=-1.96) USER MOD Set 4.2: A1002 MET CE :methyl -133:sc= -8.76! (180deg=-11.4!) USER MOD Set 4.3: A1018 LYS NZ :NH3+ 145:sc= 0.813 (180deg=0.846) USER MOD Set 4.4: A1021 MET CE :methyl 171:sc= -4.21! (180deg=-3.99!) USER MOD Single : A 909 SER OG : rot 180:sc= 0 USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 921 SER OG : rot -129:sc= 0.351 USER MOD Single : A 922 ASN : amide:sc= -2.14! C(o=-2.1!,f=-7.2!) USER MOD Single : A 924 LYS NZ :NH3+ 162:sc= 1.23 (180deg=0.934) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 180:sc= 0 USER MOD Single : A 934 LYS NZ :NH3+ 165:sc= 1.25 (180deg=1.15) USER MOD Single : A 939 MET CE :methyl -142:sc= -0.059 (180deg=-0.643) USER MOD Single : A 940 SER OG : rot -120:sc= -0.1 USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -113:sc= 0.0138 (180deg=0) USER MOD Single : A 944 GLN : amide:sc= -2.64! C(o=-2.6!,f=-5.6!) USER MOD Single : A 951 TYR OH : rot 64:sc= 0.294 USER MOD Single : A 956 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.107) USER MOD Single : A 964 THR OG1 : rot 91:sc= 1.25 USER MOD Single : A 972 SER OG : rot 77:sc= 2.35 USER MOD Single : A 981 HIS : no HD1:sc= -1.31 K(o=-1.3,f=0.052) USER MOD Single : A 986 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 988 GLN : amide:sc= -6.64! K(o=-6.6!,f=-1.3) USER MOD Single : A 989 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000655) USER MOD Single : A 992 ASN : amide:sc= -0.433 K(o=-0.43,f=-2.9!) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1003 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0938) USER MOD Single : A1006 GLN : amide:sc= -1.5! K(o=-1.5!,f=-0.39) USER MOD Single : A1007 GLN : amide:sc= -3.55! C(o=-3.6!,f=-2.7!) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1010 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1011 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 SER OG : rot 180:sc= 0.0244 USER MOD Single : A1014 GLN : amide:sc= -1.53! K(o=-1.5!,f=-0.33) USER MOD Single : A1015 GLN : amide:sc= -1.08 K(o=-1.1,f=-2.1) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1019 LYS NZ :NH3+ 166:sc= -0.0119 (180deg=-0.159) USER MOD Single : A1020 GLN : amide:sc= -2.17! K(o=-2.2!,f=-0.76) USER MOD Single : A1023 THR OG1 : rot 100:sc= 1.23 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1033 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0183) USER MOD Single : A1034 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A1041 GLN : amide:sc= -0.172 X(o=-0.17,f=-0.25) USER MOD Single : A1045 LYS NZ :NH3+ -152:sc= 0.661 (180deg=-0.52!) USER MOD Single : A1046 MET CE :methyl 170:sc= -2.66! (180deg=-2.84!) USER MOD Single : A1048 SER OG : rot 180:sc= 0 USER MOD Single : A1049 GLN : amide:sc= -0.412 K(o=-0.41,f=-1.4) USER MOD Single : A1050 SER OG : rot 180:sc= 0 USER MOD Single : A1053 HIS : no HD1:sc= -2.72! K(o=-2.7!,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 908 -12.712 -31.507 0.138 1.00 0.00 N ATOM 2 CA GLY A 908 -13.439 -30.669 -0.844 1.00 0.00 C ATOM 3 C GLY A 908 -12.824 -30.742 -2.226 1.00 0.00 C ATOM 4 O GLY A 908 -11.909 -29.985 -2.552 1.00 0.00 O ATOM 0 HA2 GLY A 908 -14.479 -30.991 -0.894 1.00 0.00 H new ATOM 0 HA3 GLY A 908 -13.442 -29.633 -0.504 1.00 0.00 H new ATOM 9 N SER A 909 -13.313 -31.670 -3.036 1.00 0.00 N ATOM 10 CA SER A 909 -12.860 -31.796 -4.411 1.00 0.00 C ATOM 11 C SER A 909 -13.925 -31.252 -5.378 1.00 0.00 C ATOM 12 O SER A 909 -13.640 -30.331 -6.144 1.00 0.00 O ATOM 13 CB SER A 909 -12.505 -33.254 -4.729 1.00 0.00 C ATOM 14 OG SER A 909 -11.785 -33.370 -5.948 1.00 0.00 O ATOM 0 H SER A 909 -14.025 -32.347 -2.763 1.00 0.00 H new ATOM 0 HA SER A 909 -11.957 -31.200 -4.540 1.00 0.00 H new ATOM 0 HB2 SER A 909 -11.910 -33.669 -3.915 1.00 0.00 H new ATOM 0 HB3 SER A 909 -13.419 -33.845 -4.789 1.00 0.00 H new ATOM 0 HG SER A 909 -11.575 -34.313 -6.116 1.00 0.00 H new ATOM 20 N PRO A 910 -15.182 -31.775 -5.342 1.00 0.00 N ATOM 21 CA PRO A 910 -16.273 -31.283 -6.197 1.00 0.00 C ATOM 22 C PRO A 910 -16.855 -29.970 -5.676 1.00 0.00 C ATOM 23 O PRO A 910 -18.018 -29.641 -5.922 1.00 0.00 O ATOM 24 CB PRO A 910 -17.330 -32.398 -6.134 1.00 0.00 C ATOM 25 CG PRO A 910 -16.720 -33.507 -5.338 1.00 0.00 C ATOM 26 CD PRO A 910 -15.650 -32.883 -4.497 1.00 0.00 C ATOM 0 HA PRO A 910 -15.930 -31.072 -7.210 1.00 0.00 H new ATOM 0 HB2 PRO A 910 -18.246 -32.040 -5.664 1.00 0.00 H new ATOM 0 HB3 PRO A 910 -17.597 -32.738 -7.135 1.00 0.00 H new ATOM 0 HG2 PRO A 910 -17.469 -33.995 -4.715 1.00 0.00 H new ATOM 0 HG3 PRO A 910 -16.303 -34.272 -5.993 1.00 0.00 H new ATOM 0 HD2 PRO A 910 -16.040 -32.528 -3.543 1.00 0.00 H new ATOM 0 HD3 PRO A 910 -14.849 -33.587 -4.272 1.00 0.00 H new ATOM 34 N GLY A 911 -16.037 -29.237 -4.947 1.00 0.00 N ATOM 35 CA GLY A 911 -16.428 -27.951 -4.429 1.00 0.00 C ATOM 36 C GLY A 911 -15.252 -27.004 -4.425 1.00 0.00 C ATOM 37 O GLY A 911 -14.114 -27.440 -4.237 1.00 0.00 O ATOM 0 H GLY A 911 -15.088 -29.519 -4.701 1.00 0.00 H new ATOM 0 HA2 GLY A 911 -17.234 -27.537 -5.036 1.00 0.00 H new ATOM 0 HA3 GLY A 911 -16.816 -28.063 -3.417 1.00 0.00 H new ATOM 40 N ILE A 912 -15.510 -25.728 -4.643 1.00 0.00 N ATOM 41 CA ILE A 912 -14.441 -24.747 -4.739 1.00 0.00 C ATOM 42 C ILE A 912 -13.924 -24.359 -3.350 1.00 0.00 C ATOM 43 O ILE A 912 -14.634 -23.757 -2.545 1.00 0.00 O ATOM 44 CB ILE A 912 -14.892 -23.492 -5.534 1.00 0.00 C ATOM 45 CG1 ILE A 912 -13.733 -22.504 -5.694 1.00 0.00 C ATOM 46 CG2 ILE A 912 -16.093 -22.814 -4.883 1.00 0.00 C ATOM 47 CD1 ILE A 912 -12.595 -23.042 -6.532 1.00 0.00 C ATOM 0 H ILE A 912 -16.449 -25.345 -4.757 1.00 0.00 H new ATOM 0 HA ILE A 912 -13.620 -25.208 -5.288 1.00 0.00 H new ATOM 0 HB ILE A 912 -15.200 -23.826 -6.525 1.00 0.00 H new ATOM 0 HG12 ILE A 912 -14.107 -21.587 -6.149 1.00 0.00 H new ATOM 0 HG13 ILE A 912 -13.353 -22.238 -4.707 1.00 0.00 H new ATOM 0 HG21 ILE A 912 -16.379 -21.940 -5.468 1.00 0.00 H new ATOM 0 HG22 ILE A 912 -16.928 -23.513 -4.843 1.00 0.00 H new ATOM 0 HG23 ILE A 912 -15.831 -22.503 -3.871 1.00 0.00 H new ATOM 0 HD11 ILE A 912 -11.809 -22.290 -6.604 1.00 0.00 H new ATOM 0 HD12 ILE A 912 -12.195 -23.943 -6.067 1.00 0.00 H new ATOM 0 HD13 ILE A 912 -12.960 -23.281 -7.531 1.00 0.00 H new ATOM 59 N SER A 913 -12.686 -24.735 -3.069 1.00 0.00 N ATOM 60 CA SER A 913 -12.061 -24.432 -1.789 1.00 0.00 C ATOM 61 C SER A 913 -11.168 -23.201 -1.903 1.00 0.00 C ATOM 62 O SER A 913 -10.311 -22.952 -1.056 1.00 0.00 O ATOM 63 CB SER A 913 -11.240 -25.633 -1.314 1.00 0.00 C ATOM 64 OG SER A 913 -12.051 -26.789 -1.181 1.00 0.00 O ATOM 0 H SER A 913 -12.090 -25.254 -3.714 1.00 0.00 H new ATOM 0 HA SER A 913 -12.845 -24.222 -1.061 1.00 0.00 H new ATOM 0 HB2 SER A 913 -10.435 -25.830 -2.022 1.00 0.00 H new ATOM 0 HB3 SER A 913 -10.773 -25.402 -0.357 1.00 0.00 H new ATOM 0 HG SER A 913 -11.501 -27.541 -0.878 1.00 0.00 H new ATOM 70 N GLY A 914 -11.392 -22.426 -2.952 1.00 0.00 N ATOM 71 CA GLY A 914 -10.574 -21.263 -3.209 1.00 0.00 C ATOM 72 C GLY A 914 -9.787 -21.413 -4.491 1.00 0.00 C ATOM 73 O GLY A 914 -8.921 -22.283 -4.594 1.00 0.00 O ATOM 0 H GLY A 914 -12.133 -22.585 -3.635 1.00 0.00 H new ATOM 0 HA2 GLY A 914 -11.207 -20.378 -3.271 1.00 0.00 H new ATOM 0 HA3 GLY A 914 -9.889 -21.107 -2.376 1.00 0.00 H new ATOM 75 N GLY A 915 -10.101 -20.583 -5.472 1.00 0.00 N ATOM 76 CA GLY A 915 -9.445 -20.672 -6.760 1.00 0.00 C ATOM 77 C GLY A 915 -8.350 -19.643 -6.912 1.00 0.00 C ATOM 78 O GLY A 915 -8.236 -18.729 -6.096 1.00 0.00 O ATOM 0 H GLY A 915 -10.802 -19.845 -5.399 1.00 0.00 H new ATOM 0 HA2 GLY A 915 -9.024 -21.670 -6.884 1.00 0.00 H new ATOM 0 HA3 GLY A 915 -10.182 -20.536 -7.552 1.00 0.00 H new ATOM 81 N GLY A 916 -7.551 -19.785 -7.958 1.00 0.00 N ATOM 82 CA GLY A 916 -6.475 -18.849 -8.198 1.00 0.00 C ATOM 83 C GLY A 916 -5.543 -19.322 -9.291 1.00 0.00 C ATOM 84 O GLY A 916 -5.412 -18.666 -10.328 1.00 0.00 O ATOM 0 H GLY A 916 -7.629 -20.534 -8.646 1.00 0.00 H new ATOM 0 HA2 GLY A 916 -6.892 -17.880 -8.472 1.00 0.00 H new ATOM 0 HA3 GLY A 916 -5.909 -18.704 -7.278 1.00 0.00 H new ATOM 87 N GLY A 917 -4.920 -20.478 -9.075 1.00 0.00 N ATOM 88 CA GLY A 917 -3.940 -20.989 -10.015 1.00 0.00 C ATOM 89 C GLY A 917 -2.695 -20.127 -10.038 1.00 0.00 C ATOM 90 O GLY A 917 -2.640 -19.128 -10.759 1.00 0.00 O ATOM 0 H GLY A 917 -5.079 -21.072 -8.261 1.00 0.00 H new ATOM 0 HA2 GLY A 917 -3.672 -22.010 -9.745 1.00 0.00 H new ATOM 0 HA3 GLY A 917 -4.376 -21.027 -11.013 1.00 0.00 H new ATOM 93 N GLY A 918 -1.685 -20.511 -9.268 1.00 0.00 N ATOM 94 CA GLY A 918 -0.553 -19.638 -9.079 1.00 0.00 C ATOM 95 C GLY A 918 -0.824 -18.621 -7.993 1.00 0.00 C ATOM 96 O GLY A 918 -0.654 -18.920 -6.823 1.00 0.00 O ATOM 0 H GLY A 918 -1.633 -21.404 -8.777 1.00 0.00 H new ATOM 0 HA2 GLY A 918 0.325 -20.228 -8.818 1.00 0.00 H new ATOM 0 HA3 GLY A 918 -0.326 -19.125 -10.013 1.00 0.00 H new ATOM 99 N ILE A 919 -1.248 -17.428 -8.392 1.00 0.00 N ATOM 100 CA ILE A 919 -1.573 -16.347 -7.497 1.00 0.00 C ATOM 101 C ILE A 919 -2.718 -16.694 -6.534 1.00 0.00 C ATOM 102 O ILE A 919 -3.297 -17.782 -6.588 1.00 0.00 O ATOM 103 CB ILE A 919 -1.931 -15.090 -8.310 1.00 0.00 C ATOM 104 CG1 ILE A 919 -3.248 -15.292 -9.068 1.00 0.00 C ATOM 105 CG2 ILE A 919 -0.802 -14.754 -9.277 1.00 0.00 C ATOM 106 CD1 ILE A 919 -3.715 -14.068 -9.827 1.00 0.00 C ATOM 0 H ILE A 919 -1.376 -17.189 -9.375 1.00 0.00 H new ATOM 0 HA ILE A 919 -0.691 -16.160 -6.885 1.00 0.00 H new ATOM 0 HB ILE A 919 -2.062 -14.255 -7.621 1.00 0.00 H new ATOM 0 HG12 ILE A 919 -3.129 -16.118 -9.769 1.00 0.00 H new ATOM 0 HG13 ILE A 919 -4.022 -15.585 -8.359 1.00 0.00 H new ATOM 0 HG21 ILE A 919 -1.065 -13.863 -9.848 1.00 0.00 H new ATOM 0 HG22 ILE A 919 0.114 -14.569 -8.716 1.00 0.00 H new ATOM 0 HG23 ILE A 919 -0.647 -15.589 -9.960 1.00 0.00 H new ATOM 0 HD11 ILE A 919 -4.652 -14.291 -10.336 1.00 0.00 H new ATOM 0 HD12 ILE A 919 -3.868 -13.244 -9.130 1.00 0.00 H new ATOM 0 HD13 ILE A 919 -2.961 -13.786 -10.562 1.00 0.00 H new ATOM 118 N ARG A 920 -3.054 -15.727 -5.693 1.00 0.00 N ATOM 119 CA ARG A 920 -3.841 -15.946 -4.486 1.00 0.00 C ATOM 120 C ARG A 920 -5.286 -16.343 -4.776 1.00 0.00 C ATOM 121 O ARG A 920 -5.717 -17.430 -4.391 1.00 0.00 O ATOM 122 CB ARG A 920 -3.730 -14.675 -3.632 1.00 0.00 C ATOM 123 CG ARG A 920 -4.949 -14.296 -2.798 1.00 0.00 C ATOM 124 CD ARG A 920 -5.238 -15.279 -1.677 1.00 0.00 C ATOM 125 NE ARG A 920 -5.714 -14.587 -0.479 1.00 0.00 N ATOM 126 CZ ARG A 920 -6.976 -14.580 -0.041 1.00 0.00 C ATOM 127 NH1 ARG A 920 -7.942 -15.199 -0.718 1.00 0.00 N ATOM 128 NH2 ARG A 920 -7.271 -13.921 1.075 1.00 0.00 N ATOM 0 H ARG A 920 -2.784 -14.753 -5.831 1.00 0.00 H new ATOM 0 HA ARG A 920 -3.443 -16.800 -3.937 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -2.881 -14.792 -2.958 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -3.499 -13.840 -4.294 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -4.795 -13.305 -2.372 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -5.821 -14.232 -3.449 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -5.986 -16.000 -2.006 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -4.335 -15.842 -1.441 1.00 0.00 H new ATOM 0 HE ARG A 920 -5.026 -14.068 0.066 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -7.723 -15.689 -1.586 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -8.900 -15.183 -0.369 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -6.538 -13.429 1.586 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -8.231 -13.907 1.421 1.00 0.00 H new ATOM 142 N SER A 921 -6.031 -15.479 -5.433 1.00 0.00 N ATOM 143 CA SER A 921 -7.434 -15.755 -5.705 1.00 0.00 C ATOM 144 C SER A 921 -7.873 -15.007 -6.935 1.00 0.00 C ATOM 145 O SER A 921 -8.351 -15.595 -7.904 1.00 0.00 O ATOM 146 CB SER A 921 -8.303 -15.384 -4.498 1.00 0.00 C ATOM 147 OG SER A 921 -7.906 -16.114 -3.346 1.00 0.00 O ATOM 0 H SER A 921 -5.695 -14.584 -5.788 1.00 0.00 H new ATOM 0 HA SER A 921 -7.555 -16.823 -5.886 1.00 0.00 H new ATOM 0 HB2 SER A 921 -8.223 -14.315 -4.302 1.00 0.00 H new ATOM 0 HB3 SER A 921 -9.350 -15.590 -4.721 1.00 0.00 H new ATOM 0 HG SER A 921 -8.691 -16.539 -2.941 1.00 0.00 H new ATOM 153 N ASN A 922 -7.697 -13.708 -6.897 1.00 0.00 N ATOM 154 CA ASN A 922 -7.936 -12.898 -8.069 1.00 0.00 C ATOM 155 C ASN A 922 -7.070 -11.644 -8.033 1.00 0.00 C ATOM 156 O ASN A 922 -6.028 -11.595 -8.679 1.00 0.00 O ATOM 157 CB ASN A 922 -9.435 -12.558 -8.231 1.00 0.00 C ATOM 158 CG ASN A 922 -10.021 -11.792 -7.048 1.00 0.00 C ATOM 159 OD1 ASN A 922 -9.585 -11.947 -5.905 1.00 0.00 O ATOM 160 ND2 ASN A 922 -10.994 -10.939 -7.316 1.00 0.00 N ATOM 0 H ASN A 922 -7.391 -13.191 -6.073 1.00 0.00 H new ATOM 0 HA ASN A 922 -7.652 -13.478 -8.947 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -9.569 -11.967 -9.137 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -9.996 -13.483 -8.368 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -11.407 -10.385 -6.566 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -11.332 -10.835 -8.273 1.00 0.00 H new ATOM 167 N ASP A 923 -7.466 -10.671 -7.218 1.00 0.00 N ATOM 168 CA ASP A 923 -6.841 -9.351 -7.212 1.00 0.00 C ATOM 169 C ASP A 923 -7.287 -8.536 -5.994 1.00 0.00 C ATOM 170 O ASP A 923 -7.089 -7.343 -5.949 1.00 0.00 O ATOM 171 CB ASP A 923 -7.234 -8.555 -8.470 1.00 0.00 C ATOM 172 CG ASP A 923 -6.494 -8.949 -9.734 1.00 0.00 C ATOM 173 OD1 ASP A 923 -5.312 -8.585 -9.878 1.00 0.00 O ATOM 174 OD2 ASP A 923 -7.107 -9.595 -10.611 1.00 0.00 O ATOM 0 H ASP A 923 -8.226 -10.774 -6.545 1.00 0.00 H new ATOM 0 HA ASP A 923 -5.763 -9.512 -7.183 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -8.304 -8.678 -8.640 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -7.061 -7.496 -8.280 1.00 0.00 H new ATOM 179 N LYS A 924 -7.842 -9.170 -4.979 1.00 0.00 N ATOM 180 CA LYS A 924 -8.573 -8.430 -3.940 1.00 0.00 C ATOM 181 C LYS A 924 -7.710 -7.372 -3.244 1.00 0.00 C ATOM 182 O LYS A 924 -8.161 -6.254 -2.993 1.00 0.00 O ATOM 183 CB LYS A 924 -9.117 -9.408 -2.920 1.00 0.00 C ATOM 184 CG LYS A 924 -10.550 -9.121 -2.510 1.00 0.00 C ATOM 185 CD LYS A 924 -11.426 -8.937 -3.738 1.00 0.00 C ATOM 186 CE LYS A 924 -12.905 -8.989 -3.410 1.00 0.00 C ATOM 187 NZ LYS A 924 -13.298 -7.981 -2.392 1.00 0.00 N ATOM 0 H LYS A 924 -7.808 -10.180 -4.842 1.00 0.00 H new ATOM 0 HA LYS A 924 -9.388 -7.897 -4.429 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -9.060 -10.417 -3.329 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -8.483 -9.387 -2.034 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -10.932 -9.941 -1.902 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -10.585 -8.224 -1.892 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -11.194 -7.980 -4.205 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -11.191 -9.713 -4.467 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -13.482 -8.825 -4.320 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -13.159 -9.985 -3.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -14.328 -7.842 -2.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -13.020 -8.315 -1.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -12.821 -7.079 -2.594 1.00 0.00 H new ATOM 201 N VAL A 925 -6.469 -7.715 -2.956 1.00 0.00 N ATOM 202 CA VAL A 925 -5.541 -6.777 -2.336 1.00 0.00 C ATOM 203 C VAL A 925 -5.290 -5.563 -3.257 1.00 0.00 C ATOM 204 O VAL A 925 -5.070 -4.444 -2.794 1.00 0.00 O ATOM 205 CB VAL A 925 -4.226 -7.497 -1.964 1.00 0.00 C ATOM 206 CG1 VAL A 925 -3.789 -8.422 -3.092 1.00 0.00 C ATOM 207 CG2 VAL A 925 -3.140 -6.498 -1.608 1.00 0.00 C ATOM 0 H VAL A 925 -6.076 -8.638 -3.140 1.00 0.00 H new ATOM 0 HA VAL A 925 -5.985 -6.396 -1.416 1.00 0.00 H new ATOM 0 HB VAL A 925 -4.405 -8.109 -1.080 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -2.861 -8.922 -2.814 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -4.563 -9.168 -3.271 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -3.630 -7.839 -3.999 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -2.225 -7.032 -1.350 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -2.952 -5.846 -2.461 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -3.462 -5.898 -0.757 1.00 0.00 H new ATOM 217 N TYR A 926 -5.402 -5.792 -4.562 1.00 0.00 N ATOM 218 CA TYR A 926 -5.304 -4.738 -5.582 1.00 0.00 C ATOM 219 C TYR A 926 -6.483 -3.785 -5.514 1.00 0.00 C ATOM 220 O TYR A 926 -6.326 -2.620 -5.849 1.00 0.00 O ATOM 221 CB TYR A 926 -5.226 -5.336 -7.007 1.00 0.00 C ATOM 222 CG TYR A 926 -6.374 -4.913 -7.919 1.00 0.00 C ATOM 223 CD1 TYR A 926 -7.615 -5.520 -7.814 1.00 0.00 C ATOM 224 CD2 TYR A 926 -6.223 -3.903 -8.858 1.00 0.00 C ATOM 225 CE1 TYR A 926 -8.673 -5.155 -8.595 1.00 0.00 C ATOM 226 CE2 TYR A 926 -7.283 -3.521 -9.658 1.00 0.00 C ATOM 227 CZ TYR A 926 -8.509 -4.149 -9.525 1.00 0.00 C ATOM 228 OH TYR A 926 -9.563 -3.766 -10.320 1.00 0.00 O ATOM 0 H TYR A 926 -5.565 -6.721 -4.951 1.00 0.00 H new ATOM 0 HA TYR A 926 -4.387 -4.188 -5.371 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -4.283 -5.038 -7.464 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -5.215 -6.423 -6.934 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -7.750 -6.309 -7.089 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -5.268 -3.411 -8.965 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -9.628 -5.648 -8.486 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -7.155 -2.734 -10.386 1.00 0.00 H new ATOM 0 HH TYR A 926 -9.276 -3.045 -10.918 1.00 0.00 H new ATOM 238 N GLU A 927 -7.649 -4.226 -5.097 1.00 0.00 N ATOM 239 CA GLU A 927 -8.769 -3.299 -5.049 1.00 0.00 C ATOM 240 C GLU A 927 -8.607 -2.362 -3.860 1.00 0.00 C ATOM 241 O GLU A 927 -9.154 -1.259 -3.851 1.00 0.00 O ATOM 242 CB GLU A 927 -10.126 -3.968 -5.039 1.00 0.00 C ATOM 243 CG GLU A 927 -10.472 -4.503 -3.685 1.00 0.00 C ATOM 244 CD GLU A 927 -11.961 -4.627 -3.470 1.00 0.00 C ATOM 245 OE1 GLU A 927 -12.627 -3.582 -3.328 1.00 0.00 O ATOM 246 OE2 GLU A 927 -12.476 -5.759 -3.450 1.00 0.00 O ATOM 0 H GLU A 927 -7.848 -5.180 -4.796 1.00 0.00 H new ATOM 0 HA GLU A 927 -8.744 -2.728 -5.977 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -10.886 -3.252 -5.352 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -10.136 -4.781 -5.765 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -10.008 -5.481 -3.556 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -10.052 -3.848 -2.922 1.00 0.00 H new ATOM 253 N ASN A 928 -7.856 -2.778 -2.860 1.00 0.00 N ATOM 254 CA ASN A 928 -7.508 -1.883 -1.764 1.00 0.00 C ATOM 255 C ASN A 928 -6.431 -0.910 -2.246 1.00 0.00 C ATOM 256 O ASN A 928 -6.360 0.235 -1.811 1.00 0.00 O ATOM 257 CB ASN A 928 -7.009 -2.682 -0.559 1.00 0.00 C ATOM 258 CG ASN A 928 -7.779 -3.979 -0.363 1.00 0.00 C ATOM 259 OD1 ASN A 928 -7.207 -4.984 0.026 1.00 0.00 O ATOM 260 ND2 ASN A 928 -9.082 -3.964 -0.616 1.00 0.00 N ATOM 0 H ASN A 928 -7.476 -3.721 -2.779 1.00 0.00 H new ATOM 0 HA ASN A 928 -8.391 -1.325 -1.452 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.951 -2.907 -0.689 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -7.097 -2.071 0.340 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -9.636 -4.810 -0.486 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -9.529 -3.106 -0.940 1.00 0.00 H new ATOM 267 N VAL A 929 -5.606 -1.390 -3.170 1.00 0.00 N ATOM 268 CA VAL A 929 -4.537 -0.595 -3.778 1.00 0.00 C ATOM 269 C VAL A 929 -5.063 0.293 -4.906 1.00 0.00 C ATOM 270 O VAL A 929 -4.533 1.388 -5.102 1.00 0.00 O ATOM 271 CB VAL A 929 -3.358 -1.455 -4.286 1.00 0.00 C ATOM 272 CG1 VAL A 929 -2.297 -0.577 -4.925 1.00 0.00 C ATOM 273 CG2 VAL A 929 -2.772 -2.287 -3.158 1.00 0.00 C ATOM 0 H VAL A 929 -5.657 -2.346 -3.522 1.00 0.00 H new ATOM 0 HA VAL A 929 -4.156 0.041 -2.979 1.00 0.00 H new ATOM 0 HB VAL A 929 -3.734 -2.141 -5.045 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -1.474 -1.199 -5.277 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -2.730 -0.037 -5.767 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -1.924 0.136 -4.190 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -1.944 -2.884 -3.539 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -2.411 -1.627 -2.369 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -3.540 -2.947 -2.756 1.00 0.00 H new ATOM 283 N THR A 930 -6.097 -0.096 -5.619 1.00 0.00 N ATOM 284 CA THR A 930 -6.713 0.842 -6.532 1.00 0.00 C ATOM 285 C THR A 930 -7.322 1.967 -5.692 1.00 0.00 C ATOM 286 O THR A 930 -7.448 3.100 -6.137 1.00 0.00 O ATOM 287 CB THR A 930 -7.776 0.176 -7.446 1.00 0.00 C ATOM 288 OG1 THR A 930 -8.001 0.983 -8.613 1.00 0.00 O ATOM 289 CG2 THR A 930 -9.098 -0.027 -6.723 1.00 0.00 C ATOM 0 H THR A 930 -6.519 -1.024 -5.588 1.00 0.00 H new ATOM 0 HA THR A 930 -5.957 1.236 -7.212 1.00 0.00 H new ATOM 0 HB THR A 930 -7.387 -0.801 -7.733 1.00 0.00 H new ATOM 0 HG1 THR A 930 -8.672 0.553 -9.184 1.00 0.00 H new ATOM 0 HG21 THR A 930 -9.814 -0.496 -7.398 1.00 0.00 H new ATOM 0 HG22 THR A 930 -8.944 -0.669 -5.856 1.00 0.00 H new ATOM 0 HG23 THR A 930 -9.486 0.938 -6.396 1.00 0.00 H new ATOM 297 N GLY A 931 -7.666 1.622 -4.451 1.00 0.00 N ATOM 298 CA GLY A 931 -8.108 2.608 -3.487 1.00 0.00 C ATOM 299 C GLY A 931 -6.980 3.510 -2.980 1.00 0.00 C ATOM 300 O GLY A 931 -7.094 4.734 -3.046 1.00 0.00 O ATOM 0 H GLY A 931 -7.644 0.665 -4.098 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.882 3.227 -3.940 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -8.564 2.097 -2.639 1.00 0.00 H new ATOM 304 N LEU A 932 -5.885 2.917 -2.489 1.00 0.00 N ATOM 305 CA LEU A 932 -4.778 3.712 -1.934 1.00 0.00 C ATOM 306 C LEU A 932 -4.071 4.570 -2.988 1.00 0.00 C ATOM 307 O LEU A 932 -3.833 5.756 -2.766 1.00 0.00 O ATOM 308 CB LEU A 932 -3.765 2.820 -1.184 1.00 0.00 C ATOM 309 CG LEU A 932 -2.895 1.871 -2.002 1.00 0.00 C ATOM 310 CD1 LEU A 932 -1.560 2.521 -2.340 1.00 0.00 C ATOM 311 CD2 LEU A 932 -2.676 0.585 -1.221 1.00 0.00 C ATOM 0 H LEU A 932 -5.740 1.908 -2.463 1.00 0.00 H new ATOM 0 HA LEU A 932 -5.229 4.400 -1.219 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -3.102 3.474 -0.617 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -4.320 2.223 -0.460 1.00 0.00 H new ATOM 0 HG LEU A 932 -3.404 1.641 -2.938 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -0.955 1.827 -2.924 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -1.733 3.428 -2.920 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -1.035 2.774 -1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -2.054 -0.094 -1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -2.179 0.812 -0.278 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -3.638 0.113 -1.019 1.00 0.00 H new ATOM 323 N VAL A 933 -3.736 3.970 -4.135 1.00 0.00 N ATOM 324 CA VAL A 933 -3.016 4.682 -5.193 1.00 0.00 C ATOM 325 C VAL A 933 -3.870 5.809 -5.742 1.00 0.00 C ATOM 326 O VAL A 933 -3.367 6.878 -6.110 1.00 0.00 O ATOM 327 CB VAL A 933 -2.605 3.739 -6.349 1.00 0.00 C ATOM 328 CG1 VAL A 933 -1.946 4.508 -7.485 1.00 0.00 C ATOM 329 CG2 VAL A 933 -1.672 2.653 -5.847 1.00 0.00 C ATOM 0 H VAL A 933 -3.951 2.997 -4.353 1.00 0.00 H new ATOM 0 HA VAL A 933 -2.108 5.088 -4.748 1.00 0.00 H new ATOM 0 HB VAL A 933 -3.513 3.276 -6.734 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -1.670 3.816 -8.281 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -2.643 5.249 -7.875 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -1.052 5.010 -7.114 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -1.395 2.000 -6.675 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -0.775 3.109 -5.428 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -2.175 2.068 -5.077 1.00 0.00 H new ATOM 339 N LYS A 934 -5.169 5.566 -5.778 1.00 0.00 N ATOM 340 CA LYS A 934 -6.113 6.569 -6.196 1.00 0.00 C ATOM 341 C LYS A 934 -6.076 7.769 -5.247 1.00 0.00 C ATOM 342 O LYS A 934 -6.221 8.901 -5.685 1.00 0.00 O ATOM 343 CB LYS A 934 -7.496 5.935 -6.279 1.00 0.00 C ATOM 344 CG LYS A 934 -8.649 6.903 -6.255 1.00 0.00 C ATOM 345 CD LYS A 934 -8.753 7.660 -7.551 1.00 0.00 C ATOM 346 CE LYS A 934 -9.994 8.509 -7.540 1.00 0.00 C ATOM 347 NZ LYS A 934 -10.336 9.018 -8.891 1.00 0.00 N ATOM 0 H LYS A 934 -5.589 4.673 -5.519 1.00 0.00 H new ATOM 0 HA LYS A 934 -5.850 6.948 -7.184 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -7.554 5.348 -7.196 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -7.609 5.239 -5.448 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -9.577 6.362 -6.072 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -8.521 7.605 -5.431 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -7.872 8.287 -7.689 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -8.784 6.964 -8.389 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -10.828 7.925 -7.152 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -9.851 9.350 -6.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -11.313 9.376 -8.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -9.685 9.788 -9.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -10.250 8.248 -9.584 1.00 0.00 H new ATOM 361 N ALA A 935 -5.835 7.541 -3.967 1.00 0.00 N ATOM 362 CA ALA A 935 -5.673 8.655 -3.038 1.00 0.00 C ATOM 363 C ALA A 935 -4.379 9.417 -3.330 1.00 0.00 C ATOM 364 O ALA A 935 -4.360 10.644 -3.304 1.00 0.00 O ATOM 365 CB ALA A 935 -5.694 8.168 -1.596 1.00 0.00 C ATOM 0 H ALA A 935 -5.748 6.614 -3.550 1.00 0.00 H new ATOM 0 HA ALA A 935 -6.512 9.336 -3.178 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.571 9.017 -0.923 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -6.646 7.677 -1.391 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -4.880 7.460 -1.439 1.00 0.00 H new ATOM 371 N VAL A 936 -3.318 8.670 -3.640 1.00 0.00 N ATOM 372 CA VAL A 936 -1.986 9.230 -3.918 1.00 0.00 C ATOM 373 C VAL A 936 -2.038 10.410 -4.890 1.00 0.00 C ATOM 374 O VAL A 936 -1.969 11.561 -4.472 1.00 0.00 O ATOM 375 CB VAL A 936 -1.039 8.148 -4.484 1.00 0.00 C ATOM 376 CG1 VAL A 936 0.326 8.731 -4.826 1.00 0.00 C ATOM 377 CG2 VAL A 936 -0.903 6.987 -3.508 1.00 0.00 C ATOM 0 H VAL A 936 -3.355 7.653 -3.707 1.00 0.00 H new ATOM 0 HA VAL A 936 -1.603 9.593 -2.964 1.00 0.00 H new ATOM 0 HB VAL A 936 -1.478 7.770 -5.407 1.00 0.00 H new ATOM 0 HG11 VAL A 936 0.969 7.945 -5.222 1.00 0.00 H new ATOM 0 HG12 VAL A 936 0.210 9.515 -5.574 1.00 0.00 H new ATOM 0 HG13 VAL A 936 0.778 9.151 -3.927 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -0.232 6.237 -3.926 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -0.497 7.351 -2.564 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -1.882 6.541 -3.334 1.00 0.00 H new ATOM 387 N ILE A 937 -2.163 10.123 -6.173 1.00 0.00 N ATOM 388 CA ILE A 937 -2.135 11.161 -7.205 1.00 0.00 C ATOM 389 C ILE A 937 -3.388 12.033 -7.179 1.00 0.00 C ATOM 390 O ILE A 937 -3.306 13.276 -7.263 1.00 0.00 O ATOM 391 CB ILE A 937 -1.975 10.539 -8.613 1.00 0.00 C ATOM 392 CG1 ILE A 937 -3.012 9.431 -8.835 1.00 0.00 C ATOM 393 CG2 ILE A 937 -0.561 10.000 -8.795 1.00 0.00 C ATOM 394 CD1 ILE A 937 -2.955 8.802 -10.210 1.00 0.00 C ATOM 0 H ILE A 937 -2.286 9.177 -6.533 1.00 0.00 H new ATOM 0 HA ILE A 937 -1.274 11.792 -6.985 1.00 0.00 H new ATOM 0 HB ILE A 937 -2.146 11.316 -9.358 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -2.865 8.654 -8.085 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -4.009 9.843 -8.676 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -0.463 9.565 -9.790 1.00 0.00 H new ATOM 0 HG22 ILE A 937 0.156 10.813 -8.682 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -0.364 9.235 -8.044 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -3.719 8.028 -10.288 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -3.133 9.566 -10.967 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -1.972 8.358 -10.367 1.00 0.00 H new ATOM 406 N GLU A 938 -4.532 11.401 -6.999 1.00 0.00 N ATOM 407 CA GLU A 938 -5.800 12.088 -7.193 1.00 0.00 C ATOM 408 C GLU A 938 -6.027 13.101 -6.089 1.00 0.00 C ATOM 409 O GLU A 938 -6.359 14.242 -6.344 1.00 0.00 O ATOM 410 CB GLU A 938 -6.970 11.109 -7.248 1.00 0.00 C ATOM 411 CG GLU A 938 -8.274 11.739 -7.703 1.00 0.00 C ATOM 412 CD GLU A 938 -8.330 11.938 -9.202 1.00 0.00 C ATOM 413 OE1 GLU A 938 -7.759 12.926 -9.705 1.00 0.00 O ATOM 414 OE2 GLU A 938 -8.943 11.096 -9.888 1.00 0.00 O ATOM 0 H GLU A 938 -4.613 10.423 -6.722 1.00 0.00 H new ATOM 0 HA GLU A 938 -5.748 12.604 -8.151 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.717 10.292 -7.924 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.113 10.673 -6.260 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -9.106 11.108 -7.392 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -8.401 12.701 -7.207 1.00 0.00 H new ATOM 421 N MET A 939 -5.839 12.704 -4.857 1.00 0.00 N ATOM 422 CA MET A 939 -6.078 13.627 -3.774 1.00 0.00 C ATOM 423 C MET A 939 -4.949 14.650 -3.700 1.00 0.00 C ATOM 424 O MET A 939 -5.173 15.801 -3.319 1.00 0.00 O ATOM 425 CB MET A 939 -6.251 12.880 -2.452 1.00 0.00 C ATOM 426 CG MET A 939 -6.749 13.748 -1.313 1.00 0.00 C ATOM 427 SD MET A 939 -7.580 12.789 -0.031 1.00 0.00 S ATOM 428 CE MET A 939 -8.103 14.096 1.074 1.00 0.00 C ATOM 0 H MET A 939 -5.529 11.772 -4.581 1.00 0.00 H new ATOM 0 HA MET A 939 -7.007 14.164 -3.965 1.00 0.00 H new ATOM 0 HB2 MET A 939 -6.950 12.057 -2.600 1.00 0.00 H new ATOM 0 HB3 MET A 939 -5.295 12.439 -2.168 1.00 0.00 H new ATOM 0 HG2 MET A 939 -5.908 14.285 -0.874 1.00 0.00 H new ATOM 0 HG3 MET A 939 -7.436 14.498 -1.705 1.00 0.00 H new ATOM 0 HE1 MET A 939 -7.999 13.763 2.107 1.00 0.00 H new ATOM 0 HE2 MET A 939 -7.483 14.978 0.913 1.00 0.00 H new ATOM 0 HE3 MET A 939 -9.146 14.344 0.876 1.00 0.00 H new ATOM 438 N SER A 940 -3.765 14.232 -4.168 1.00 0.00 N ATOM 439 CA SER A 940 -2.533 15.002 -4.016 1.00 0.00 C ATOM 440 C SER A 940 -2.682 16.437 -4.490 1.00 0.00 C ATOM 441 O SER A 940 -2.421 17.388 -3.755 1.00 0.00 O ATOM 442 CB SER A 940 -1.421 14.360 -4.847 1.00 0.00 C ATOM 443 OG SER A 940 -0.175 15.003 -4.624 1.00 0.00 O ATOM 0 H SER A 940 -3.639 13.349 -4.663 1.00 0.00 H new ATOM 0 HA SER A 940 -2.295 15.004 -2.952 1.00 0.00 H new ATOM 0 HB2 SER A 940 -1.338 13.303 -4.593 1.00 0.00 H new ATOM 0 HB3 SER A 940 -1.677 14.415 -5.905 1.00 0.00 H new ATOM 0 HG SER A 940 0.161 15.368 -5.469 1.00 0.00 H new ATOM 449 N SER A 941 -3.097 16.577 -5.730 1.00 0.00 N ATOM 450 CA SER A 941 -3.205 17.876 -6.374 1.00 0.00 C ATOM 451 C SER A 941 -4.649 18.336 -6.454 1.00 0.00 C ATOM 452 O SER A 941 -4.922 19.527 -6.597 1.00 0.00 O ATOM 453 CB SER A 941 -2.639 17.769 -7.788 1.00 0.00 C ATOM 454 OG SER A 941 -1.283 17.347 -7.766 1.00 0.00 O ATOM 0 H SER A 941 -3.370 15.795 -6.325 1.00 0.00 H new ATOM 0 HA SER A 941 -2.647 18.603 -5.784 1.00 0.00 H new ATOM 0 HB2 SER A 941 -3.233 17.063 -8.368 1.00 0.00 H new ATOM 0 HB3 SER A 941 -2.714 18.735 -8.287 1.00 0.00 H new ATOM 0 HG SER A 941 -0.945 17.285 -8.684 1.00 0.00 H new ATOM 460 N LYS A 942 -5.573 17.402 -6.362 1.00 0.00 N ATOM 461 CA LYS A 942 -6.951 17.730 -6.692 1.00 0.00 C ATOM 462 C LYS A 942 -7.690 18.327 -5.510 1.00 0.00 C ATOM 463 O LYS A 942 -8.204 19.441 -5.601 1.00 0.00 O ATOM 464 CB LYS A 942 -7.704 16.553 -7.299 1.00 0.00 C ATOM 465 CG LYS A 942 -7.278 16.228 -8.726 1.00 0.00 C ATOM 466 CD LYS A 942 -5.919 15.547 -8.776 1.00 0.00 C ATOM 467 CE LYS A 942 -5.481 15.289 -10.208 1.00 0.00 C ATOM 468 NZ LYS A 942 -4.250 14.461 -10.281 1.00 0.00 N ATOM 0 H LYS A 942 -5.408 16.438 -6.071 1.00 0.00 H new ATOM 0 HA LYS A 942 -6.908 18.498 -7.464 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -7.552 15.673 -6.674 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -8.772 16.771 -7.288 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -8.024 15.582 -9.188 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -7.245 17.146 -9.312 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -5.179 16.171 -8.274 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -5.963 14.604 -8.232 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -6.285 14.788 -10.747 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -5.306 16.241 -10.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -3.469 15.033 -10.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -4.001 14.124 -9.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -4.417 13.645 -10.904 1.00 0.00 H new ATOM 482 N ILE A 943 -7.769 17.574 -4.419 1.00 0.00 N ATOM 483 CA ILE A 943 -8.497 18.026 -3.238 1.00 0.00 C ATOM 484 C ILE A 943 -7.978 19.371 -2.735 1.00 0.00 C ATOM 485 O ILE A 943 -8.692 20.374 -2.801 1.00 0.00 O ATOM 486 CB ILE A 943 -8.451 16.975 -2.105 1.00 0.00 C ATOM 487 CG1 ILE A 943 -9.126 15.678 -2.562 1.00 0.00 C ATOM 488 CG2 ILE A 943 -9.118 17.504 -0.840 1.00 0.00 C ATOM 489 CD1 ILE A 943 -10.580 15.843 -2.951 1.00 0.00 C ATOM 0 H ILE A 943 -7.341 16.653 -4.327 1.00 0.00 H new ATOM 0 HA ILE A 943 -9.536 18.156 -3.540 1.00 0.00 H new ATOM 0 HB ILE A 943 -7.406 16.768 -1.873 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -8.577 15.275 -3.413 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -9.056 14.943 -1.760 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -9.071 16.745 -0.059 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -8.600 18.402 -0.504 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -10.160 17.744 -1.051 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -10.985 14.880 -3.262 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -11.145 16.215 -2.097 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -10.658 16.553 -3.775 1.00 0.00 H new ATOM 501 N GLN A 944 -6.742 19.403 -2.258 1.00 0.00 N ATOM 502 CA GLN A 944 -6.163 20.631 -1.721 1.00 0.00 C ATOM 503 C GLN A 944 -4.641 20.606 -1.804 1.00 0.00 C ATOM 504 O GLN A 944 -3.973 19.950 -1.001 1.00 0.00 O ATOM 505 CB GLN A 944 -6.613 20.839 -0.272 1.00 0.00 C ATOM 506 CG GLN A 944 -7.951 21.547 -0.134 1.00 0.00 C ATOM 507 CD GLN A 944 -8.589 21.341 1.226 1.00 0.00 C ATOM 508 OE1 GLN A 944 -8.446 20.286 1.845 1.00 0.00 O ATOM 509 NE2 GLN A 944 -9.287 22.354 1.707 1.00 0.00 N ATOM 0 H GLN A 944 -6.120 18.595 -2.231 1.00 0.00 H new ATOM 0 HA GLN A 944 -6.519 21.465 -2.326 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -6.675 19.869 0.221 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -5.853 21.416 0.254 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -7.811 22.614 -0.307 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -8.629 21.185 -0.907 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -9.382 23.212 1.163 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -9.731 22.279 2.622 1.00 0.00 H new ATOM 518 N PRO A 945 -4.073 21.297 -2.803 1.00 0.00 N ATOM 519 CA PRO A 945 -2.632 21.414 -2.953 1.00 0.00 C ATOM 520 C PRO A 945 -2.046 22.562 -2.124 1.00 0.00 C ATOM 521 O PRO A 945 -1.470 22.329 -1.060 1.00 0.00 O ATOM 522 CB PRO A 945 -2.449 21.664 -4.450 1.00 0.00 C ATOM 523 CG PRO A 945 -3.746 22.238 -4.940 1.00 0.00 C ATOM 524 CD PRO A 945 -4.794 21.999 -3.876 1.00 0.00 C ATOM 0 HA PRO A 945 -2.110 20.526 -2.596 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -1.625 22.354 -4.632 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -2.211 20.738 -4.973 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -3.640 23.305 -5.138 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -4.041 21.767 -5.878 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -5.220 22.937 -3.520 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -5.619 21.399 -4.259 1.00 0.00 H new ATOM 532 N ALA A 946 -2.207 23.798 -2.608 1.00 0.00 N ATOM 533 CA ALA A 946 -1.694 24.975 -1.908 1.00 0.00 C ATOM 534 C ALA A 946 -2.474 25.246 -0.617 1.00 0.00 C ATOM 535 O ALA A 946 -1.868 25.461 0.434 1.00 0.00 O ATOM 536 CB ALA A 946 -1.707 26.192 -2.823 1.00 0.00 C ATOM 0 H ALA A 946 -2.689 24.007 -3.482 1.00 0.00 H new ATOM 0 HA ALA A 946 -0.661 24.771 -1.626 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -1.322 27.057 -2.283 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -1.081 25.999 -3.694 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -2.728 26.392 -3.148 1.00 0.00 H new ATOM 542 N PRO A 947 -3.825 25.271 -0.658 1.00 0.00 N ATOM 543 CA PRO A 947 -4.621 25.292 0.565 1.00 0.00 C ATOM 544 C PRO A 947 -4.483 23.961 1.286 1.00 0.00 C ATOM 545 O PRO A 947 -4.492 22.911 0.645 1.00 0.00 O ATOM 546 CB PRO A 947 -6.064 25.497 0.079 1.00 0.00 C ATOM 547 CG PRO A 947 -5.945 25.922 -1.344 1.00 0.00 C ATOM 548 CD PRO A 947 -4.679 25.299 -1.857 1.00 0.00 C ATOM 0 HA PRO A 947 -4.310 26.069 1.263 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -6.643 24.578 0.167 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -6.575 26.254 0.674 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -6.806 25.590 -1.924 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -5.906 27.008 -1.425 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -4.852 24.299 -2.255 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -4.233 25.888 -2.658 1.00 0.00 H new ATOM 556 N PRO A 948 -4.327 23.973 2.615 1.00 0.00 N ATOM 557 CA PRO A 948 -4.088 22.753 3.368 1.00 0.00 C ATOM 558 C PRO A 948 -5.176 21.722 3.193 1.00 0.00 C ATOM 559 O PRO A 948 -6.306 21.896 3.648 1.00 0.00 O ATOM 560 CB PRO A 948 -4.015 23.190 4.831 1.00 0.00 C ATOM 561 CG PRO A 948 -4.539 24.590 4.864 1.00 0.00 C ATOM 562 CD PRO A 948 -4.366 25.159 3.480 1.00 0.00 C ATOM 0 HA PRO A 948 -3.176 22.271 3.016 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -4.611 22.534 5.465 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -2.991 23.147 5.201 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -5.589 24.602 5.157 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -3.997 25.187 5.597 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -5.190 25.821 3.214 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -3.449 25.743 3.399 1.00 0.00 H new ATOM 570 N GLU A 949 -4.807 20.648 2.518 1.00 0.00 N ATOM 571 CA GLU A 949 -5.586 19.425 2.511 1.00 0.00 C ATOM 572 C GLU A 949 -5.719 18.926 3.946 1.00 0.00 C ATOM 573 O GLU A 949 -6.562 18.079 4.251 1.00 0.00 O ATOM 574 CB GLU A 949 -4.854 18.372 1.664 1.00 0.00 C ATOM 575 CG GLU A 949 -5.618 17.095 1.415 1.00 0.00 C ATOM 576 CD GLU A 949 -4.700 16.029 0.863 1.00 0.00 C ATOM 577 OE1 GLU A 949 -4.004 15.381 1.667 1.00 0.00 O ATOM 578 OE2 GLU A 949 -4.623 15.873 -0.369 1.00 0.00 O ATOM 0 H GLU A 949 -3.956 20.600 1.958 1.00 0.00 H new ATOM 0 HA GLU A 949 -6.575 19.605 2.090 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -4.600 18.817 0.702 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -3.915 18.123 2.157 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -6.071 16.748 2.344 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -6.431 17.282 0.714 1.00 0.00 H new ATOM 585 N GLU A 950 -4.849 19.480 4.814 1.00 0.00 N ATOM 586 CA GLU A 950 -4.607 18.970 6.155 1.00 0.00 C ATOM 587 C GLU A 950 -3.765 17.712 6.049 1.00 0.00 C ATOM 588 O GLU A 950 -3.167 17.289 7.030 1.00 0.00 O ATOM 589 CB GLU A 950 -5.910 18.734 6.930 1.00 0.00 C ATOM 590 CG GLU A 950 -5.693 18.522 8.423 1.00 0.00 C ATOM 591 CD GLU A 950 -6.988 18.341 9.187 1.00 0.00 C ATOM 592 OE1 GLU A 950 -7.668 19.351 9.461 1.00 0.00 O ATOM 593 OE2 GLU A 950 -7.327 17.189 9.529 1.00 0.00 O ATOM 0 H GLU A 950 -4.293 20.305 4.589 1.00 0.00 H new ATOM 0 HA GLU A 950 -4.062 19.718 6.731 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -6.571 19.588 6.784 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -6.418 17.863 6.516 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -5.063 17.645 8.573 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -5.152 19.376 8.831 1.00 0.00 H new ATOM 600 N TYR A 951 -3.654 17.207 4.811 1.00 0.00 N ATOM 601 CA TYR A 951 -2.858 16.033 4.439 1.00 0.00 C ATOM 602 C TYR A 951 -3.177 14.768 5.256 1.00 0.00 C ATOM 603 O TYR A 951 -3.414 13.711 4.680 1.00 0.00 O ATOM 604 CB TYR A 951 -1.370 16.403 4.436 1.00 0.00 C ATOM 605 CG TYR A 951 -1.038 17.401 3.336 1.00 0.00 C ATOM 606 CD1 TYR A 951 -1.773 17.424 2.160 1.00 0.00 C ATOM 607 CD2 TYR A 951 -0.032 18.344 3.483 1.00 0.00 C ATOM 608 CE1 TYR A 951 -1.512 18.344 1.164 1.00 0.00 C ATOM 609 CE2 TYR A 951 0.231 19.275 2.492 1.00 0.00 C ATOM 610 CZ TYR A 951 -0.514 19.269 1.337 1.00 0.00 C ATOM 611 OH TYR A 951 -0.257 20.190 0.349 1.00 0.00 O ATOM 0 H TYR A 951 -4.135 17.622 4.013 1.00 0.00 H new ATOM 0 HA TYR A 951 -3.143 15.748 3.426 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -1.098 16.825 5.404 1.00 0.00 H new ATOM 0 HB3 TYR A 951 -0.772 15.502 4.302 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -2.568 16.706 2.020 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.558 18.353 4.388 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -2.091 18.335 0.253 1.00 0.00 H new ATOM 0 HE2 TYR A 951 1.018 20.002 2.626 1.00 0.00 H new ATOM 0 HH TYR A 951 -1.038 20.771 0.232 1.00 0.00 H new ATOM 621 N VAL A 952 -3.198 14.876 6.574 1.00 0.00 N ATOM 622 CA VAL A 952 -3.644 13.798 7.449 1.00 0.00 C ATOM 623 C VAL A 952 -4.985 13.196 6.988 1.00 0.00 C ATOM 624 O VAL A 952 -5.142 11.982 7.009 1.00 0.00 O ATOM 625 CB VAL A 952 -3.780 14.288 8.908 1.00 0.00 C ATOM 626 CG1 VAL A 952 -4.160 13.141 9.835 1.00 0.00 C ATOM 627 CG2 VAL A 952 -2.491 14.948 9.369 1.00 0.00 C ATOM 0 H VAL A 952 -2.905 15.717 7.072 1.00 0.00 H new ATOM 0 HA VAL A 952 -2.882 13.021 7.396 1.00 0.00 H new ATOM 0 HB VAL A 952 -4.579 15.028 8.946 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -4.249 13.513 10.856 1.00 0.00 H new ATOM 0 HG12 VAL A 952 -5.113 12.718 9.518 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -3.390 12.371 9.795 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -2.604 15.287 10.399 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -1.673 14.229 9.311 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -2.270 15.801 8.728 1.00 0.00 H new ATOM 637 N PRO A 953 -5.992 14.021 6.613 1.00 0.00 N ATOM 638 CA PRO A 953 -7.249 13.524 6.039 1.00 0.00 C ATOM 639 C PRO A 953 -7.037 12.492 4.921 1.00 0.00 C ATOM 640 O PRO A 953 -7.707 11.464 4.876 1.00 0.00 O ATOM 641 CB PRO A 953 -7.887 14.805 5.507 1.00 0.00 C ATOM 642 CG PRO A 953 -7.494 15.807 6.514 1.00 0.00 C ATOM 643 CD PRO A 953 -6.062 15.476 6.837 1.00 0.00 C ATOM 0 HA PRO A 953 -7.860 12.988 6.766 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -7.515 15.061 4.515 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -8.970 14.715 5.427 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -7.589 16.820 6.124 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -8.125 15.747 7.401 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -5.369 16.016 6.192 1.00 0.00 H new ATOM 0 HD3 PRO A 953 -5.811 15.737 7.865 1.00 0.00 H new ATOM 651 N MET A 954 -6.091 12.774 4.023 1.00 0.00 N ATOM 652 CA MET A 954 -5.732 11.830 2.965 1.00 0.00 C ATOM 653 C MET A 954 -4.976 10.654 3.547 1.00 0.00 C ATOM 654 O MET A 954 -5.146 9.518 3.113 1.00 0.00 O ATOM 655 CB MET A 954 -4.886 12.498 1.888 1.00 0.00 C ATOM 656 CG MET A 954 -4.104 11.507 1.037 1.00 0.00 C ATOM 657 SD MET A 954 -3.209 12.283 -0.325 1.00 0.00 S ATOM 658 CE MET A 954 -2.254 10.889 -0.905 1.00 0.00 C ATOM 0 H MET A 954 -5.562 13.646 4.008 1.00 0.00 H new ATOM 0 HA MET A 954 -6.657 11.479 2.507 1.00 0.00 H new ATOM 0 HB2 MET A 954 -5.534 13.090 1.241 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.189 13.190 2.360 1.00 0.00 H new ATOM 0 HG2 MET A 954 -3.395 10.975 1.671 1.00 0.00 H new ATOM 0 HG3 MET A 954 -4.792 10.764 0.634 1.00 0.00 H new ATOM 0 HE1 MET A 954 -1.764 11.149 -1.843 1.00 0.00 H new ATOM 0 HE2 MET A 954 -1.501 10.629 -0.161 1.00 0.00 H new ATOM 0 HE3 MET A 954 -2.914 10.037 -1.065 1.00 0.00 H new ATOM 668 N VAL A 955 -4.135 10.940 4.529 1.00 0.00 N ATOM 669 CA VAL A 955 -3.494 9.880 5.310 1.00 0.00 C ATOM 670 C VAL A 955 -4.557 8.925 5.859 1.00 0.00 C ATOM 671 O VAL A 955 -4.373 7.711 5.870 1.00 0.00 O ATOM 672 CB VAL A 955 -2.677 10.435 6.497 1.00 0.00 C ATOM 673 CG1 VAL A 955 -2.059 9.301 7.284 1.00 0.00 C ATOM 674 CG2 VAL A 955 -1.599 11.393 6.023 1.00 0.00 C ATOM 0 H VAL A 955 -3.878 11.887 4.807 1.00 0.00 H new ATOM 0 HA VAL A 955 -2.811 9.360 4.638 1.00 0.00 H new ATOM 0 HB VAL A 955 -3.358 10.987 7.144 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -1.486 9.707 8.118 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -2.847 8.652 7.667 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -1.398 8.726 6.635 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -1.041 11.767 6.882 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.920 10.872 5.348 1.00 0.00 H new ATOM 0 HG23 VAL A 955 -2.061 12.229 5.498 1.00 0.00 H new ATOM 684 N LYS A 956 -5.664 9.484 6.310 1.00 0.00 N ATOM 685 CA LYS A 956 -6.809 8.700 6.750 1.00 0.00 C ATOM 686 C LYS A 956 -7.401 7.866 5.607 1.00 0.00 C ATOM 687 O LYS A 956 -7.853 6.746 5.837 1.00 0.00 O ATOM 688 CB LYS A 956 -7.847 9.641 7.393 1.00 0.00 C ATOM 689 CG LYS A 956 -9.287 9.132 7.417 1.00 0.00 C ATOM 690 CD LYS A 956 -10.015 9.460 6.119 1.00 0.00 C ATOM 691 CE LYS A 956 -11.485 9.077 6.176 1.00 0.00 C ATOM 692 NZ LYS A 956 -12.247 9.925 7.129 1.00 0.00 N ATOM 0 H LYS A 956 -5.798 10.493 6.383 1.00 0.00 H new ATOM 0 HA LYS A 956 -6.484 7.979 7.501 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -7.537 9.845 8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -7.827 10.591 6.859 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -9.291 8.054 7.575 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -9.819 9.579 8.257 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -9.926 10.527 5.914 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -9.536 8.935 5.292 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -11.922 9.168 5.181 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -11.576 8.031 6.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -13.266 9.760 7.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -11.975 9.683 8.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -12.034 10.927 6.949 1.00 0.00 H new ATOM 706 N GLU A 957 -7.366 8.381 4.380 1.00 0.00 N ATOM 707 CA GLU A 957 -7.924 7.658 3.236 1.00 0.00 C ATOM 708 C GLU A 957 -6.976 6.553 2.767 1.00 0.00 C ATOM 709 O GLU A 957 -7.391 5.422 2.513 1.00 0.00 O ATOM 710 CB GLU A 957 -8.203 8.617 2.074 1.00 0.00 C ATOM 711 CG GLU A 957 -9.427 9.497 2.267 1.00 0.00 C ATOM 712 CD GLU A 957 -10.720 8.706 2.280 1.00 0.00 C ATOM 713 OE1 GLU A 957 -10.913 7.860 1.383 1.00 0.00 O ATOM 714 OE2 GLU A 957 -11.556 8.946 3.174 1.00 0.00 O ATOM 0 H GLU A 957 -6.961 9.289 4.152 1.00 0.00 H new ATOM 0 HA GLU A 957 -8.860 7.204 3.560 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -7.331 9.255 1.928 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -8.329 8.035 1.161 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -9.331 10.045 3.205 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -9.467 10.237 1.468 1.00 0.00 H new ATOM 721 N VAL A 958 -5.693 6.881 2.671 1.00 0.00 N ATOM 722 CA VAL A 958 -4.698 5.935 2.182 1.00 0.00 C ATOM 723 C VAL A 958 -4.310 4.937 3.274 1.00 0.00 C ATOM 724 O VAL A 958 -3.971 3.791 2.978 1.00 0.00 O ATOM 725 CB VAL A 958 -3.444 6.657 1.627 1.00 0.00 C ATOM 726 CG1 VAL A 958 -2.714 7.426 2.720 1.00 0.00 C ATOM 727 CG2 VAL A 958 -2.506 5.674 0.941 1.00 0.00 C ATOM 0 H VAL A 958 -5.318 7.795 2.925 1.00 0.00 H new ATOM 0 HA VAL A 958 -5.151 5.384 1.358 1.00 0.00 H new ATOM 0 HB VAL A 958 -3.785 7.378 0.884 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -1.840 7.920 2.296 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -3.382 8.174 3.147 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.397 6.735 3.501 1.00 0.00 H new ATOM 0 HG21 VAL A 958 -1.635 6.207 0.561 1.00 0.00 H new ATOM 0 HG22 VAL A 958 -2.185 4.918 1.657 1.00 0.00 H new ATOM 0 HG23 VAL A 958 -3.026 5.192 0.113 1.00 0.00 H new ATOM 737 N GLY A 959 -4.388 5.362 4.528 1.00 0.00 N ATOM 738 CA GLY A 959 -4.190 4.439 5.627 1.00 0.00 C ATOM 739 C GLY A 959 -5.344 3.467 5.718 1.00 0.00 C ATOM 740 O GLY A 959 -5.163 2.291 6.039 1.00 0.00 O ATOM 0 H GLY A 959 -4.584 6.325 4.803 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -3.257 3.893 5.487 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -4.098 4.992 6.562 1.00 0.00 H new ATOM 744 N LEU A 960 -6.535 3.970 5.410 1.00 0.00 N ATOM 745 CA LEU A 960 -7.733 3.149 5.323 1.00 0.00 C ATOM 746 C LEU A 960 -7.570 2.122 4.212 1.00 0.00 C ATOM 747 O LEU A 960 -7.936 0.961 4.371 1.00 0.00 O ATOM 748 CB LEU A 960 -8.956 4.044 5.065 1.00 0.00 C ATOM 749 CG LEU A 960 -10.334 3.383 5.193 1.00 0.00 C ATOM 750 CD1 LEU A 960 -11.389 4.440 5.485 1.00 0.00 C ATOM 751 CD2 LEU A 960 -10.703 2.630 3.923 1.00 0.00 C ATOM 0 H LEU A 960 -6.695 4.958 5.214 1.00 0.00 H new ATOM 0 HA LEU A 960 -7.885 2.620 6.264 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -8.916 4.883 5.759 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -8.869 4.457 4.060 1.00 0.00 H new ATOM 0 HG LEU A 960 -10.292 2.669 6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -12.366 3.964 5.575 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -11.146 4.949 6.418 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -11.412 5.165 4.672 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -11.685 2.172 4.044 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -10.727 3.324 3.083 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -9.962 1.854 3.732 1.00 0.00 H new ATOM 763 N ALA A 961 -7.003 2.541 3.094 1.00 0.00 N ATOM 764 CA ALA A 961 -6.808 1.643 1.968 1.00 0.00 C ATOM 765 C ALA A 961 -5.749 0.590 2.286 1.00 0.00 C ATOM 766 O ALA A 961 -6.025 -0.601 2.206 1.00 0.00 O ATOM 767 CB ALA A 961 -6.441 2.432 0.732 1.00 0.00 C ATOM 0 H ALA A 961 -6.671 3.493 2.941 1.00 0.00 H new ATOM 0 HA ALA A 961 -7.744 1.118 1.775 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -6.297 1.750 -0.106 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -7.242 3.132 0.496 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -5.519 2.984 0.913 1.00 0.00 H new ATOM 773 N LEU A 962 -4.538 1.035 2.622 1.00 0.00 N ATOM 774 CA LEU A 962 -3.498 0.150 3.161 1.00 0.00 C ATOM 775 C LEU A 962 -4.034 -0.838 4.203 1.00 0.00 C ATOM 776 O LEU A 962 -3.736 -2.014 4.109 1.00 0.00 O ATOM 777 CB LEU A 962 -2.341 0.956 3.761 1.00 0.00 C ATOM 778 CG LEU A 962 -1.781 0.378 5.066 1.00 0.00 C ATOM 779 CD1 LEU A 962 -0.768 -0.727 4.793 1.00 0.00 C ATOM 780 CD2 LEU A 962 -1.170 1.468 5.928 1.00 0.00 C ATOM 0 H LEU A 962 -4.249 2.009 2.531 1.00 0.00 H new ATOM 0 HA LEU A 962 -3.134 -0.432 2.314 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -1.536 1.015 3.028 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -2.680 1.975 3.945 1.00 0.00 H new ATOM 0 HG LEU A 962 -2.614 -0.061 5.615 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -0.390 -1.116 5.739 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -1.248 -1.531 4.236 1.00 0.00 H new ATOM 0 HD13 LEU A 962 0.060 -0.325 4.209 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -0.781 1.030 6.847 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -0.358 1.950 5.384 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -1.932 2.208 6.173 1.00 0.00 H new ATOM 792 N ARG A 963 -4.790 -0.406 5.201 1.00 0.00 N ATOM 793 CA ARG A 963 -5.280 -1.373 6.189 1.00 0.00 C ATOM 794 C ARG A 963 -6.291 -2.328 5.566 1.00 0.00 C ATOM 795 O ARG A 963 -6.429 -3.467 6.006 1.00 0.00 O ATOM 796 CB ARG A 963 -5.914 -0.699 7.390 1.00 0.00 C ATOM 797 CG ARG A 963 -7.255 -0.082 7.060 1.00 0.00 C ATOM 798 CD ARG A 963 -7.903 0.549 8.272 1.00 0.00 C ATOM 799 NE ARG A 963 -8.067 -0.407 9.370 1.00 0.00 N ATOM 800 CZ ARG A 963 -8.864 -0.220 10.423 1.00 0.00 C ATOM 801 NH1 ARG A 963 -9.588 0.892 10.532 1.00 0.00 N ATOM 802 NH2 ARG A 963 -8.933 -1.148 11.371 1.00 0.00 N ATOM 0 H ARG A 963 -5.072 0.563 5.352 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.407 -1.930 6.528 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -6.039 -1.429 8.190 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -5.244 0.074 7.766 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -7.126 0.673 6.284 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -7.916 -0.847 6.653 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -7.296 1.389 8.611 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -8.877 0.951 7.994 1.00 0.00 H new ATOM 0 HE ARG A 963 -7.535 -1.276 9.326 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -9.535 1.608 9.807 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -10.195 1.028 11.340 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -8.378 -2.000 11.292 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -9.541 -1.009 12.178 1.00 0.00 H new ATOM 816 N THR A 964 -7.001 -1.865 4.552 1.00 0.00 N ATOM 817 CA THR A 964 -7.888 -2.746 3.810 1.00 0.00 C ATOM 818 C THR A 964 -7.038 -3.748 3.039 1.00 0.00 C ATOM 819 O THR A 964 -7.382 -4.925 2.913 1.00 0.00 O ATOM 820 CB THR A 964 -8.807 -1.971 2.843 1.00 0.00 C ATOM 821 OG1 THR A 964 -9.486 -0.925 3.550 1.00 0.00 O ATOM 822 CG2 THR A 964 -9.836 -2.905 2.233 1.00 0.00 C ATOM 0 H THR A 964 -6.983 -0.899 4.226 1.00 0.00 H new ATOM 0 HA THR A 964 -8.539 -3.259 4.518 1.00 0.00 H new ATOM 0 HB THR A 964 -8.193 -1.543 2.051 1.00 0.00 H new ATOM 0 HG1 THR A 964 -8.952 -0.104 3.512 1.00 0.00 H new ATOM 0 HG21 THR A 964 -10.478 -2.345 1.553 1.00 0.00 H new ATOM 0 HG22 THR A 964 -9.328 -3.697 1.683 1.00 0.00 H new ATOM 0 HG23 THR A 964 -10.443 -3.345 3.025 1.00 0.00 H new ATOM 830 N LEU A 965 -5.894 -3.259 2.576 1.00 0.00 N ATOM 831 CA LEU A 965 -4.898 -4.094 1.913 1.00 0.00 C ATOM 832 C LEU A 965 -4.318 -5.074 2.909 1.00 0.00 C ATOM 833 O LEU A 965 -4.068 -6.239 2.606 1.00 0.00 O ATOM 834 CB LEU A 965 -3.769 -3.232 1.327 1.00 0.00 C ATOM 835 CG LEU A 965 -2.393 -3.914 1.275 1.00 0.00 C ATOM 836 CD1 LEU A 965 -1.755 -3.738 -0.091 1.00 0.00 C ATOM 837 CD2 LEU A 965 -1.479 -3.358 2.354 1.00 0.00 C ATOM 0 H LEU A 965 -5.630 -2.276 2.649 1.00 0.00 H new ATOM 0 HA LEU A 965 -5.382 -4.634 1.099 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -4.048 -2.932 0.317 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -3.684 -2.320 1.918 1.00 0.00 H new ATOM 0 HG LEU A 965 -2.538 -4.979 1.454 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -0.782 -4.229 -0.104 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -2.396 -4.183 -0.852 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -1.628 -2.676 -0.299 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.510 -3.854 2.301 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -1.348 -2.287 2.203 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -1.923 -3.534 3.334 1.00 0.00 H new ATOM 849 N LEU A 966 -4.128 -4.574 4.116 1.00 0.00 N ATOM 850 CA LEU A 966 -3.529 -5.339 5.173 1.00 0.00 C ATOM 851 C LEU A 966 -4.464 -6.477 5.524 1.00 0.00 C ATOM 852 O LEU A 966 -4.035 -7.588 5.747 1.00 0.00 O ATOM 853 CB LEU A 966 -3.269 -4.432 6.390 1.00 0.00 C ATOM 854 CG LEU A 966 -2.472 -5.053 7.545 1.00 0.00 C ATOM 855 CD1 LEU A 966 -1.744 -3.967 8.324 1.00 0.00 C ATOM 856 CD2 LEU A 966 -3.388 -5.830 8.481 1.00 0.00 C ATOM 0 H LEU A 966 -4.388 -3.624 4.383 1.00 0.00 H new ATOM 0 HA LEU A 966 -2.570 -5.749 4.856 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -2.738 -3.544 6.047 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -4.231 -4.098 6.779 1.00 0.00 H new ATOM 0 HG LEU A 966 -1.743 -5.743 7.121 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -1.182 -4.420 9.141 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -1.058 -3.440 7.660 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -2.469 -3.262 8.730 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -2.800 -6.261 9.291 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -4.139 -5.158 8.896 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -3.882 -6.629 7.927 1.00 0.00 H new ATOM 868 N ALA A 967 -5.755 -6.168 5.543 1.00 0.00 N ATOM 869 CA ALA A 967 -6.796 -7.147 5.822 1.00 0.00 C ATOM 870 C ALA A 967 -6.881 -8.225 4.742 1.00 0.00 C ATOM 871 O ALA A 967 -6.960 -9.400 5.076 1.00 0.00 O ATOM 872 CB ALA A 967 -8.139 -6.460 6.005 1.00 0.00 C ATOM 0 H ALA A 967 -6.109 -5.228 5.365 1.00 0.00 H new ATOM 0 HA ALA A 967 -6.528 -7.648 6.752 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -8.905 -7.207 6.213 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -8.079 -5.760 6.839 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -8.398 -5.919 5.095 1.00 0.00 H new ATOM 878 N THR A 968 -6.836 -7.859 3.466 1.00 0.00 N ATOM 879 CA THR A 968 -6.901 -8.864 2.406 1.00 0.00 C ATOM 880 C THR A 968 -5.672 -9.772 2.456 1.00 0.00 C ATOM 881 O THR A 968 -5.768 -10.990 2.299 1.00 0.00 O ATOM 882 CB THR A 968 -7.022 -8.219 1.009 1.00 0.00 C ATOM 883 OG1 THR A 968 -6.086 -7.147 0.884 1.00 0.00 O ATOM 884 CG2 THR A 968 -8.437 -7.710 0.772 1.00 0.00 C ATOM 0 H THR A 968 -6.756 -6.895 3.142 1.00 0.00 H new ATOM 0 HA THR A 968 -7.798 -9.459 2.578 1.00 0.00 H new ATOM 0 HB THR A 968 -6.800 -8.976 0.257 1.00 0.00 H new ATOM 0 HG1 THR A 968 -6.553 -6.338 0.587 1.00 0.00 H new ATOM 0 HG21 THR A 968 -8.500 -7.259 -0.218 1.00 0.00 H new ATOM 0 HG22 THR A 968 -9.139 -8.542 0.838 1.00 0.00 H new ATOM 0 HG23 THR A 968 -8.687 -6.964 1.527 1.00 0.00 H new ATOM 892 N VAL A 969 -4.524 -9.164 2.698 1.00 0.00 N ATOM 893 CA VAL A 969 -3.265 -9.894 2.846 1.00 0.00 C ATOM 894 C VAL A 969 -3.193 -10.655 4.181 1.00 0.00 C ATOM 895 O VAL A 969 -2.785 -11.815 4.218 1.00 0.00 O ATOM 896 CB VAL A 969 -2.053 -8.943 2.718 1.00 0.00 C ATOM 897 CG1 VAL A 969 -0.748 -9.685 2.937 1.00 0.00 C ATOM 898 CG2 VAL A 969 -2.049 -8.268 1.357 1.00 0.00 C ATOM 0 H VAL A 969 -4.432 -8.153 2.798 1.00 0.00 H new ATOM 0 HA VAL A 969 -3.230 -10.625 2.039 1.00 0.00 H new ATOM 0 HB VAL A 969 -2.144 -8.180 3.491 1.00 0.00 H new ATOM 0 HG11 VAL A 969 0.086 -8.990 2.841 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -0.742 -10.123 3.935 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -0.650 -10.475 2.193 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -1.189 -7.602 1.284 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -1.989 -9.025 0.575 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -2.966 -7.692 1.234 1.00 0.00 H new ATOM 908 N ASP A 970 -3.634 -10.040 5.263 1.00 0.00 N ATOM 909 CA ASP A 970 -3.548 -10.682 6.576 1.00 0.00 C ATOM 910 C ASP A 970 -4.477 -11.877 6.589 1.00 0.00 C ATOM 911 O ASP A 970 -4.150 -12.940 7.119 1.00 0.00 O ATOM 912 CB ASP A 970 -3.920 -9.711 7.705 1.00 0.00 C ATOM 913 CG ASP A 970 -3.703 -10.292 9.089 1.00 0.00 C ATOM 914 OD1 ASP A 970 -4.575 -11.045 9.570 1.00 0.00 O ATOM 915 OD2 ASP A 970 -2.665 -9.981 9.713 1.00 0.00 O ATOM 0 H ASP A 970 -4.051 -9.109 5.268 1.00 0.00 H new ATOM 0 HA ASP A 970 -2.519 -10.999 6.748 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -3.328 -8.802 7.603 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -4.966 -9.424 7.599 1.00 0.00 H new ATOM 920 N GLU A 971 -5.629 -11.697 5.963 1.00 0.00 N ATOM 921 CA GLU A 971 -6.576 -12.775 5.777 1.00 0.00 C ATOM 922 C GLU A 971 -5.935 -13.889 4.955 1.00 0.00 C ATOM 923 O GLU A 971 -6.203 -15.065 5.164 1.00 0.00 O ATOM 924 CB GLU A 971 -7.813 -12.248 5.071 1.00 0.00 C ATOM 925 CG GLU A 971 -8.866 -13.311 4.803 1.00 0.00 C ATOM 926 CD GLU A 971 -9.791 -12.952 3.658 1.00 0.00 C ATOM 927 OE1 GLU A 971 -9.445 -13.251 2.494 1.00 0.00 O ATOM 928 OE2 GLU A 971 -10.874 -12.388 3.914 1.00 0.00 O ATOM 0 H GLU A 971 -5.929 -10.804 5.573 1.00 0.00 H new ATOM 0 HA GLU A 971 -6.865 -13.177 6.748 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -8.255 -11.456 5.675 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -7.515 -11.798 4.124 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -8.371 -14.257 4.581 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -9.457 -13.465 5.706 1.00 0.00 H new ATOM 935 N SER A 972 -5.069 -13.496 4.027 1.00 0.00 N ATOM 936 CA SER A 972 -4.337 -14.442 3.193 1.00 0.00 C ATOM 937 C SER A 972 -3.375 -15.279 4.028 1.00 0.00 C ATOM 938 O SER A 972 -2.940 -16.346 3.595 1.00 0.00 O ATOM 939 CB SER A 972 -3.567 -13.704 2.095 1.00 0.00 C ATOM 940 OG SER A 972 -4.449 -12.993 1.242 1.00 0.00 O ATOM 0 H SER A 972 -4.856 -12.518 3.832 1.00 0.00 H new ATOM 0 HA SER A 972 -5.063 -15.110 2.731 1.00 0.00 H new ATOM 0 HB2 SER A 972 -2.857 -13.012 2.547 1.00 0.00 H new ATOM 0 HB3 SER A 972 -2.988 -14.418 1.510 1.00 0.00 H new ATOM 0 HG SER A 972 -4.748 -12.174 1.690 1.00 0.00 H new ATOM 946 N LEU A 973 -3.061 -14.809 5.233 1.00 0.00 N ATOM 947 CA LEU A 973 -2.125 -15.523 6.090 1.00 0.00 C ATOM 948 C LEU A 973 -2.763 -16.822 6.609 1.00 0.00 C ATOM 949 O LEU A 973 -2.160 -17.885 6.484 1.00 0.00 O ATOM 950 CB LEU A 973 -1.638 -14.628 7.246 1.00 0.00 C ATOM 951 CG LEU A 973 -0.538 -15.220 8.140 1.00 0.00 C ATOM 952 CD1 LEU A 973 0.299 -14.109 8.745 1.00 0.00 C ATOM 953 CD2 LEU A 973 -1.134 -16.072 9.251 1.00 0.00 C ATOM 0 H LEU A 973 -3.436 -13.949 5.632 1.00 0.00 H new ATOM 0 HA LEU A 973 -1.248 -15.790 5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -1.271 -13.692 6.825 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -2.494 -14.381 7.873 1.00 0.00 H new ATOM 0 HG LEU A 973 0.094 -15.854 7.518 1.00 0.00 H new ATOM 0 HD11 LEU A 973 1.075 -14.541 9.377 1.00 0.00 H new ATOM 0 HD12 LEU A 973 0.762 -13.527 7.948 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -0.338 -13.460 9.346 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -0.332 -16.478 9.868 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -1.791 -15.458 9.867 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -1.706 -16.891 8.815 1.00 0.00 H new ATOM 965 N PRO A 974 -3.979 -16.782 7.211 1.00 0.00 N ATOM 966 CA PRO A 974 -4.685 -18.000 7.599 1.00 0.00 C ATOM 967 C PRO A 974 -5.572 -18.585 6.492 1.00 0.00 C ATOM 968 O PRO A 974 -6.148 -19.658 6.673 1.00 0.00 O ATOM 969 CB PRO A 974 -5.535 -17.576 8.802 1.00 0.00 C ATOM 970 CG PRO A 974 -5.356 -16.093 8.936 1.00 0.00 C ATOM 971 CD PRO A 974 -4.718 -15.611 7.662 1.00 0.00 C ATOM 0 HA PRO A 974 -3.975 -18.797 7.820 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -6.584 -17.829 8.647 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -5.213 -18.091 9.707 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -6.316 -15.602 9.097 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -4.729 -15.856 9.795 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -5.462 -15.295 6.931 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.060 -14.759 7.836 1.00 0.00 H new ATOM 979 N VAL A 975 -5.692 -17.905 5.356 1.00 0.00 N ATOM 980 CA VAL A 975 -6.365 -18.509 4.205 1.00 0.00 C ATOM 981 C VAL A 975 -5.456 -19.551 3.565 1.00 0.00 C ATOM 982 O VAL A 975 -5.902 -20.632 3.178 1.00 0.00 O ATOM 983 CB VAL A 975 -6.814 -17.462 3.152 1.00 0.00 C ATOM 984 CG1 VAL A 975 -7.095 -18.113 1.802 1.00 0.00 C ATOM 985 CG2 VAL A 975 -8.061 -16.739 3.630 1.00 0.00 C ATOM 0 H VAL A 975 -5.343 -16.959 5.206 1.00 0.00 H new ATOM 0 HA VAL A 975 -7.272 -18.987 4.575 1.00 0.00 H new ATOM 0 HB VAL A 975 -5.999 -16.749 3.029 1.00 0.00 H new ATOM 0 HG11 VAL A 975 -7.407 -17.351 1.088 1.00 0.00 H new ATOM 0 HG12 VAL A 975 -6.191 -18.602 1.439 1.00 0.00 H new ATOM 0 HG13 VAL A 975 -7.888 -18.853 1.913 1.00 0.00 H new ATOM 0 HG21 VAL A 975 -8.366 -16.007 2.882 1.00 0.00 H new ATOM 0 HG22 VAL A 975 -8.864 -17.460 3.781 1.00 0.00 H new ATOM 0 HG23 VAL A 975 -7.849 -16.230 4.570 1.00 0.00 H new ATOM 995 N LEU A 976 -4.173 -19.223 3.470 1.00 0.00 N ATOM 996 CA LEU A 976 -3.175 -20.182 3.022 1.00 0.00 C ATOM 997 C LEU A 976 -2.532 -20.835 4.238 1.00 0.00 C ATOM 998 O LEU A 976 -1.765 -20.197 4.954 1.00 0.00 O ATOM 999 CB LEU A 976 -2.104 -19.515 2.148 1.00 0.00 C ATOM 1000 CG LEU A 976 -2.540 -19.127 0.729 1.00 0.00 C ATOM 1001 CD1 LEU A 976 -3.230 -20.293 0.041 1.00 0.00 C ATOM 1002 CD2 LEU A 976 -3.438 -17.899 0.743 1.00 0.00 C ATOM 0 H LEU A 976 -3.801 -18.301 3.697 1.00 0.00 H new ATOM 0 HA LEU A 976 -3.669 -20.938 2.411 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -1.755 -18.617 2.658 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -1.252 -20.191 2.073 1.00 0.00 H new ATOM 0 HG LEU A 976 -1.644 -18.876 0.162 1.00 0.00 H new ATOM 0 HD11 LEU A 976 -3.531 -19.996 -0.964 1.00 0.00 H new ATOM 0 HD12 LEU A 976 -2.543 -21.137 -0.020 1.00 0.00 H new ATOM 0 HD13 LEU A 976 -4.111 -20.583 0.613 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -3.730 -17.650 -0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -4.329 -18.107 1.335 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -2.899 -17.059 1.182 1.00 0.00 H new ATOM 1014 N PRO A 977 -2.853 -22.116 4.480 1.00 0.00 N ATOM 1015 CA PRO A 977 -2.473 -22.831 5.707 1.00 0.00 C ATOM 1016 C PRO A 977 -0.988 -22.733 6.062 1.00 0.00 C ATOM 1017 O PRO A 977 -0.149 -23.425 5.474 1.00 0.00 O ATOM 1018 CB PRO A 977 -2.856 -24.281 5.405 1.00 0.00 C ATOM 1019 CG PRO A 977 -3.955 -24.175 4.407 1.00 0.00 C ATOM 1020 CD PRO A 977 -3.624 -22.977 3.562 1.00 0.00 C ATOM 0 HA PRO A 977 -2.974 -22.400 6.574 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -2.010 -24.840 5.006 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -3.186 -24.800 6.305 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -4.020 -25.077 3.799 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -4.920 -24.052 4.899 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -3.040 -23.253 2.684 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -4.524 -22.478 3.202 1.00 0.00 H new ATOM 1028 N ALA A 978 -0.693 -21.850 7.019 1.00 0.00 N ATOM 1029 CA ALA A 978 0.633 -21.711 7.627 1.00 0.00 C ATOM 1030 C ALA A 978 1.682 -21.124 6.680 1.00 0.00 C ATOM 1031 O ALA A 978 2.125 -19.997 6.870 1.00 0.00 O ATOM 1032 CB ALA A 978 1.107 -23.047 8.186 1.00 0.00 C ATOM 0 H ALA A 978 -1.381 -21.200 7.400 1.00 0.00 H new ATOM 0 HA ALA A 978 0.521 -20.994 8.440 1.00 0.00 H new ATOM 0 HB1 ALA A 978 2.093 -22.925 8.634 1.00 0.00 H new ATOM 0 HB2 ALA A 978 0.405 -23.394 8.944 1.00 0.00 H new ATOM 0 HB3 ALA A 978 1.162 -23.779 7.381 1.00 0.00 H new ATOM 1038 N SER A 979 2.039 -21.879 5.655 1.00 0.00 N ATOM 1039 CA SER A 979 3.216 -21.612 4.824 1.00 0.00 C ATOM 1040 C SER A 979 3.330 -20.165 4.331 1.00 0.00 C ATOM 1041 O SER A 979 4.375 -19.532 4.492 1.00 0.00 O ATOM 1042 CB SER A 979 3.209 -22.573 3.640 1.00 0.00 C ATOM 1043 OG SER A 979 1.911 -22.679 3.076 1.00 0.00 O ATOM 0 H SER A 979 1.517 -22.707 5.367 1.00 0.00 H new ATOM 0 HA SER A 979 4.090 -21.769 5.456 1.00 0.00 H new ATOM 0 HB2 SER A 979 3.911 -22.226 2.882 1.00 0.00 H new ATOM 0 HB3 SER A 979 3.550 -23.556 3.964 1.00 0.00 H new ATOM 0 HG SER A 979 1.933 -23.300 2.318 1.00 0.00 H new ATOM 1049 N THR A 980 2.266 -19.641 3.749 1.00 0.00 N ATOM 1050 CA THR A 980 2.313 -18.339 3.093 1.00 0.00 C ATOM 1051 C THR A 980 2.450 -17.179 4.100 1.00 0.00 C ATOM 1052 O THR A 980 2.667 -16.033 3.709 1.00 0.00 O ATOM 1053 CB THR A 980 1.063 -18.158 2.201 1.00 0.00 C ATOM 1054 OG1 THR A 980 0.947 -19.275 1.309 1.00 0.00 O ATOM 1055 CG2 THR A 980 1.139 -16.895 1.367 1.00 0.00 C ATOM 0 H THR A 980 1.354 -20.096 3.715 1.00 0.00 H new ATOM 0 HA THR A 980 3.206 -18.311 2.468 1.00 0.00 H new ATOM 0 HB THR A 980 0.199 -18.089 2.862 1.00 0.00 H new ATOM 0 HG1 THR A 980 0.862 -20.101 1.829 1.00 0.00 H new ATOM 0 HG21 THR A 980 0.241 -16.808 0.756 1.00 0.00 H new ATOM 0 HG22 THR A 980 1.216 -16.029 2.024 1.00 0.00 H new ATOM 0 HG23 THR A 980 2.015 -16.938 0.720 1.00 0.00 H new ATOM 1063 N HIS A 981 2.400 -17.497 5.394 1.00 0.00 N ATOM 1064 CA HIS A 981 2.417 -16.482 6.462 1.00 0.00 C ATOM 1065 C HIS A 981 3.550 -15.463 6.307 1.00 0.00 C ATOM 1066 O HIS A 981 3.363 -14.289 6.601 1.00 0.00 O ATOM 1067 CB HIS A 981 2.524 -17.140 7.850 1.00 0.00 C ATOM 1068 CG HIS A 981 3.875 -17.729 8.156 1.00 0.00 C ATOM 1069 ND1 HIS A 981 4.626 -17.389 9.261 1.00 0.00 N ATOM 1070 CD2 HIS A 981 4.604 -18.643 7.483 1.00 0.00 C ATOM 1071 CE1 HIS A 981 5.755 -18.073 9.250 1.00 0.00 C ATOM 1072 NE2 HIS A 981 5.767 -18.842 8.180 1.00 0.00 N ATOM 0 H HIS A 981 2.347 -18.457 5.736 1.00 0.00 H new ATOM 0 HA HIS A 981 1.471 -15.947 6.373 1.00 0.00 H new ATOM 0 HB2 HIS A 981 2.284 -16.397 8.610 1.00 0.00 H new ATOM 0 HB3 HIS A 981 1.773 -17.926 7.925 1.00 0.00 H new ATOM 0 HD2 HIS A 981 4.322 -19.130 6.561 1.00 0.00 H new ATOM 0 HE1 HIS A 981 6.537 -18.013 9.993 1.00 0.00 H new ATOM 0 HE2 HIS A 981 6.518 -19.480 7.915 1.00 0.00 H new ATOM 1081 N ARG A 982 4.698 -15.899 5.802 1.00 0.00 N ATOM 1082 CA ARG A 982 5.912 -15.079 5.851 1.00 0.00 C ATOM 1083 C ARG A 982 5.966 -14.063 4.716 1.00 0.00 C ATOM 1084 O ARG A 982 6.667 -13.058 4.826 1.00 0.00 O ATOM 1085 CB ARG A 982 7.177 -15.940 5.886 1.00 0.00 C ATOM 1086 CG ARG A 982 7.219 -16.989 4.780 1.00 0.00 C ATOM 1087 CD ARG A 982 8.570 -17.683 4.697 1.00 0.00 C ATOM 1088 NE ARG A 982 9.605 -16.803 4.155 1.00 0.00 N ATOM 1089 CZ ARG A 982 10.865 -17.172 3.930 1.00 0.00 C ATOM 1090 NH1 ARG A 982 11.258 -18.417 4.172 1.00 0.00 N ATOM 1091 NH2 ARG A 982 11.730 -16.294 3.438 1.00 0.00 N ATOM 0 H ARG A 982 4.818 -16.808 5.356 1.00 0.00 H new ATOM 0 HA ARG A 982 5.870 -14.517 6.784 1.00 0.00 H new ATOM 0 HB2 ARG A 982 8.051 -15.294 5.799 1.00 0.00 H new ATOM 0 HB3 ARG A 982 7.243 -16.438 6.853 1.00 0.00 H new ATOM 0 HG2 ARG A 982 6.441 -17.732 4.957 1.00 0.00 H new ATOM 0 HG3 ARG A 982 6.996 -16.515 3.824 1.00 0.00 H new ATOM 0 HD2 ARG A 982 8.865 -18.022 5.690 1.00 0.00 H new ATOM 0 HD3 ARG A 982 8.484 -18.571 4.070 1.00 0.00 H new ATOM 0 HE ARG A 982 9.344 -15.842 3.934 1.00 0.00 H new ATOM 0 HH11 ARG A 982 10.593 -19.101 4.533 1.00 0.00 H new ATOM 0 HH12 ARG A 982 12.225 -18.690 3.996 1.00 0.00 H new ATOM 0 HH21 ARG A 982 11.429 -15.341 3.234 1.00 0.00 H new ATOM 0 HH22 ARG A 982 12.696 -16.572 3.264 1.00 0.00 H new ATOM 1105 N GLU A 983 5.230 -14.283 3.649 1.00 0.00 N ATOM 1106 CA GLU A 983 5.117 -13.273 2.607 1.00 0.00 C ATOM 1107 C GLU A 983 4.137 -12.198 3.041 1.00 0.00 C ATOM 1108 O GLU A 983 4.344 -11.008 2.800 1.00 0.00 O ATOM 1109 CB GLU A 983 4.641 -13.896 1.322 1.00 0.00 C ATOM 1110 CG GLU A 983 5.670 -13.872 0.201 1.00 0.00 C ATOM 1111 CD GLU A 983 6.941 -14.629 0.530 1.00 0.00 C ATOM 1112 OE1 GLU A 983 6.928 -15.463 1.455 1.00 0.00 O ATOM 1113 OE2 GLU A 983 7.964 -14.395 -0.147 1.00 0.00 O ATOM 0 H GLU A 983 4.705 -15.140 3.476 1.00 0.00 H new ATOM 0 HA GLU A 983 6.099 -12.829 2.442 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.355 -14.930 1.516 1.00 0.00 H new ATOM 0 HB3 GLU A 983 3.744 -13.374 0.988 1.00 0.00 H new ATOM 0 HG2 GLU A 983 5.225 -14.298 -0.698 1.00 0.00 H new ATOM 0 HG3 GLU A 983 5.922 -12.837 -0.028 1.00 0.00 H new ATOM 1120 N ILE A 984 3.081 -12.636 3.717 1.00 0.00 N ATOM 1121 CA ILE A 984 2.091 -11.730 4.279 1.00 0.00 C ATOM 1122 C ILE A 984 2.756 -10.912 5.362 1.00 0.00 C ATOM 1123 O ILE A 984 2.420 -9.748 5.566 1.00 0.00 O ATOM 1124 CB ILE A 984 0.855 -12.478 4.851 1.00 0.00 C ATOM 1125 CG1 ILE A 984 -0.073 -12.951 3.735 1.00 0.00 C ATOM 1126 CG2 ILE A 984 0.084 -11.619 5.841 1.00 0.00 C ATOM 1127 CD1 ILE A 984 0.334 -14.256 3.111 1.00 0.00 C ATOM 0 H ILE A 984 2.889 -13.623 3.889 1.00 0.00 H new ATOM 0 HA ILE A 984 1.720 -11.087 3.481 1.00 0.00 H new ATOM 0 HB ILE A 984 1.234 -13.351 5.382 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -1.082 -13.051 4.134 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -0.111 -12.186 2.960 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -0.772 -12.178 6.218 1.00 0.00 H new ATOM 0 HG22 ILE A 984 0.735 -11.349 6.672 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -0.264 -10.714 5.343 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -0.376 -14.522 2.328 1.00 0.00 H new ATOM 0 HD12 ILE A 984 1.330 -14.158 2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 984 0.343 -15.036 3.872 1.00 0.00 H new ATOM 1139 N GLU A 985 3.748 -11.496 5.997 1.00 0.00 N ATOM 1140 CA GLU A 985 4.507 -10.783 6.990 1.00 0.00 C ATOM 1141 C GLU A 985 5.244 -9.615 6.361 1.00 0.00 C ATOM 1142 O GLU A 985 5.116 -8.471 6.792 1.00 0.00 O ATOM 1143 CB GLU A 985 5.527 -11.706 7.657 1.00 0.00 C ATOM 1144 CG GLU A 985 4.911 -12.748 8.572 1.00 0.00 C ATOM 1145 CD GLU A 985 5.958 -13.552 9.313 1.00 0.00 C ATOM 1146 OE1 GLU A 985 6.582 -13.000 10.245 1.00 0.00 O ATOM 1147 OE2 GLU A 985 6.164 -14.733 8.975 1.00 0.00 O ATOM 0 H GLU A 985 4.044 -12.460 5.842 1.00 0.00 H new ATOM 0 HA GLU A 985 3.806 -10.414 7.739 1.00 0.00 H new ATOM 0 HB2 GLU A 985 6.104 -12.212 6.883 1.00 0.00 H new ATOM 0 HB3 GLU A 985 6.228 -11.101 8.232 1.00 0.00 H new ATOM 0 HG2 GLU A 985 4.257 -12.255 9.292 1.00 0.00 H new ATOM 0 HG3 GLU A 985 4.287 -13.422 7.984 1.00 0.00 H new ATOM 1154 N MET A 986 5.987 -9.924 5.306 1.00 0.00 N ATOM 1155 CA MET A 986 6.915 -8.974 4.724 1.00 0.00 C ATOM 1156 C MET A 986 6.183 -7.839 4.026 1.00 0.00 C ATOM 1157 O MET A 986 6.495 -6.665 4.201 1.00 0.00 O ATOM 1158 CB MET A 986 7.832 -9.685 3.727 1.00 0.00 C ATOM 1159 CG MET A 986 8.885 -10.562 4.382 1.00 0.00 C ATOM 1160 SD MET A 986 10.024 -11.280 3.182 1.00 0.00 S ATOM 1161 CE MET A 986 11.136 -12.166 4.268 1.00 0.00 C ATOM 0 H MET A 986 5.962 -10.830 4.837 1.00 0.00 H new ATOM 0 HA MET A 986 7.510 -8.549 5.532 1.00 0.00 H new ATOM 0 HB2 MET A 986 7.224 -10.298 3.062 1.00 0.00 H new ATOM 0 HB3 MET A 986 8.328 -8.938 3.107 1.00 0.00 H new ATOM 0 HG2 MET A 986 9.448 -9.971 5.105 1.00 0.00 H new ATOM 0 HG3 MET A 986 8.394 -11.362 4.937 1.00 0.00 H new ATOM 0 HE1 MET A 986 11.902 -12.666 3.675 1.00 0.00 H new ATOM 0 HE2 MET A 986 11.609 -11.465 4.955 1.00 0.00 H new ATOM 0 HE3 MET A 986 10.575 -12.908 4.837 1.00 0.00 H new ATOM 1171 N ALA A 987 5.190 -8.222 3.239 1.00 0.00 N ATOM 1172 CA ALA A 987 4.519 -7.311 2.332 1.00 0.00 C ATOM 1173 C ALA A 987 3.571 -6.362 3.046 1.00 0.00 C ATOM 1174 O ALA A 987 3.640 -5.154 2.836 1.00 0.00 O ATOM 1175 CB ALA A 987 3.782 -8.089 1.264 1.00 0.00 C ATOM 0 H ALA A 987 4.828 -9.175 3.213 1.00 0.00 H new ATOM 0 HA ALA A 987 5.290 -6.695 1.869 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.282 -7.395 0.588 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.491 -8.696 0.701 1.00 0.00 H new ATOM 0 HB3 ALA A 987 3.041 -8.737 1.732 1.00 0.00 H new ATOM 1181 N GLN A 988 2.674 -6.885 3.887 1.00 0.00 N ATOM 1182 CA GLN A 988 1.754 -6.001 4.593 1.00 0.00 C ATOM 1183 C GLN A 988 2.548 -5.080 5.509 1.00 0.00 C ATOM 1184 O GLN A 988 2.081 -4.014 5.893 1.00 0.00 O ATOM 1185 CB GLN A 988 0.650 -6.771 5.338 1.00 0.00 C ATOM 1186 CG GLN A 988 1.043 -7.365 6.680 1.00 0.00 C ATOM 1187 CD GLN A 988 -0.020 -8.315 7.212 1.00 0.00 C ATOM 1188 OE1 GLN A 988 0.279 -9.249 7.956 1.00 0.00 O ATOM 1189 NE2 GLN A 988 -1.269 -8.089 6.818 1.00 0.00 N ATOM 0 H GLN A 988 2.569 -7.879 4.089 1.00 0.00 H new ATOM 0 HA GLN A 988 1.225 -5.391 3.861 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -0.193 -6.098 5.494 1.00 0.00 H new ATOM 0 HB3 GLN A 988 0.299 -7.578 4.694 1.00 0.00 H new ATOM 0 HG2 GLN A 988 1.988 -7.898 6.578 1.00 0.00 H new ATOM 0 HG3 GLN A 988 1.205 -6.562 7.399 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -1.475 -7.304 6.201 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -2.022 -8.701 7.133 1.00 0.00 H new ATOM 1198 N LYS A 989 3.765 -5.513 5.825 1.00 0.00 N ATOM 1199 CA LYS A 989 4.746 -4.699 6.527 1.00 0.00 C ATOM 1200 C LYS A 989 5.362 -3.611 5.630 1.00 0.00 C ATOM 1201 O LYS A 989 5.586 -2.488 6.078 1.00 0.00 O ATOM 1202 CB LYS A 989 5.841 -5.621 7.048 1.00 0.00 C ATOM 1203 CG LYS A 989 7.205 -4.973 7.201 1.00 0.00 C ATOM 1204 CD LYS A 989 8.299 -6.007 7.443 1.00 0.00 C ATOM 1205 CE LYS A 989 7.992 -6.910 8.628 1.00 0.00 C ATOM 1206 NZ LYS A 989 7.955 -6.160 9.910 1.00 0.00 N ATOM 0 H LYS A 989 4.099 -6.449 5.597 1.00 0.00 H new ATOM 0 HA LYS A 989 4.243 -4.182 7.344 1.00 0.00 H new ATOM 0 HB2 LYS A 989 5.532 -6.016 8.016 1.00 0.00 H new ATOM 0 HB3 LYS A 989 5.933 -6.470 6.371 1.00 0.00 H new ATOM 0 HG2 LYS A 989 7.438 -4.400 6.303 1.00 0.00 H new ATOM 0 HG3 LYS A 989 7.181 -4.268 8.032 1.00 0.00 H new ATOM 0 HD2 LYS A 989 8.423 -6.617 6.548 1.00 0.00 H new ATOM 0 HD3 LYS A 989 9.246 -5.496 7.615 1.00 0.00 H new ATOM 0 HE2 LYS A 989 7.032 -7.402 8.469 1.00 0.00 H new ATOM 0 HE3 LYS A 989 8.746 -7.695 8.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 7.760 -6.818 10.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 8.873 -5.697 10.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 7.207 -5.439 9.869 1.00 0.00 H new ATOM 1220 N LEU A 990 5.691 -3.959 4.387 1.00 0.00 N ATOM 1221 CA LEU A 990 6.303 -2.997 3.473 1.00 0.00 C ATOM 1222 C LEU A 990 5.458 -1.751 3.297 1.00 0.00 C ATOM 1223 O LEU A 990 5.939 -0.638 3.520 1.00 0.00 O ATOM 1224 CB LEU A 990 6.618 -3.651 2.138 1.00 0.00 C ATOM 1225 CG LEU A 990 7.952 -4.372 2.147 1.00 0.00 C ATOM 1226 CD1 LEU A 990 7.871 -5.695 1.403 1.00 0.00 C ATOM 1227 CD2 LEU A 990 9.031 -3.488 1.540 1.00 0.00 C ATOM 0 H LEU A 990 5.546 -4.889 3.993 1.00 0.00 H new ATOM 0 HA LEU A 990 7.241 -2.672 3.923 1.00 0.00 H new ATOM 0 HB2 LEU A 990 5.828 -4.359 1.888 1.00 0.00 H new ATOM 0 HB3 LEU A 990 6.624 -2.891 1.357 1.00 0.00 H new ATOM 0 HG LEU A 990 8.211 -4.588 3.184 1.00 0.00 H new ATOM 0 HD11 LEU A 990 8.844 -6.187 1.428 1.00 0.00 H new ATOM 0 HD12 LEU A 990 7.128 -6.335 1.879 1.00 0.00 H new ATOM 0 HD13 LEU A 990 7.583 -5.513 0.368 1.00 0.00 H new ATOM 0 HD21 LEU A 990 9.984 -4.017 1.552 1.00 0.00 H new ATOM 0 HD22 LEU A 990 8.765 -3.243 0.512 1.00 0.00 H new ATOM 0 HD23 LEU A 990 9.118 -2.570 2.121 1.00 0.00 H new ATOM 1239 N LEU A 991 4.202 -1.926 2.929 1.00 0.00 N ATOM 1240 CA LEU A 991 3.298 -0.795 2.826 1.00 0.00 C ATOM 1241 C LEU A 991 3.094 -0.203 4.216 1.00 0.00 C ATOM 1242 O LEU A 991 2.929 1.000 4.369 1.00 0.00 O ATOM 1243 CB LEU A 991 1.958 -1.228 2.226 1.00 0.00 C ATOM 1244 CG LEU A 991 1.289 -0.206 1.295 1.00 0.00 C ATOM 1245 CD1 LEU A 991 0.087 -0.827 0.612 1.00 0.00 C ATOM 1246 CD2 LEU A 991 0.865 1.042 2.052 1.00 0.00 C ATOM 0 H LEU A 991 3.788 -2.829 2.699 1.00 0.00 H new ATOM 0 HA LEU A 991 3.730 -0.042 2.166 1.00 0.00 H new ATOM 0 HB2 LEU A 991 2.111 -2.154 1.671 1.00 0.00 H new ATOM 0 HB3 LEU A 991 1.271 -1.455 3.041 1.00 0.00 H new ATOM 0 HG LEU A 991 2.022 0.086 0.543 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -0.378 -0.092 -0.045 1.00 0.00 H new ATOM 0 HD12 LEU A 991 0.407 -1.688 0.025 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -0.633 -1.148 1.364 1.00 0.00 H new ATOM 0 HD21 LEU A 991 0.395 1.744 1.363 1.00 0.00 H new ATOM 0 HD22 LEU A 991 0.155 0.770 2.833 1.00 0.00 H new ATOM 0 HD23 LEU A 991 1.740 1.508 2.504 1.00 0.00 H new ATOM 1258 N ASN A 992 3.140 -1.069 5.222 1.00 0.00 N ATOM 1259 CA ASN A 992 2.985 -0.662 6.617 1.00 0.00 C ATOM 1260 C ASN A 992 3.978 0.446 6.977 1.00 0.00 C ATOM 1261 O ASN A 992 3.588 1.545 7.381 1.00 0.00 O ATOM 1262 CB ASN A 992 3.191 -1.886 7.520 1.00 0.00 C ATOM 1263 CG ASN A 992 2.882 -1.648 8.989 1.00 0.00 C ATOM 1264 OD1 ASN A 992 3.087 -0.562 9.527 1.00 0.00 O ATOM 1265 ND2 ASN A 992 2.384 -2.679 9.654 1.00 0.00 N ATOM 0 H ASN A 992 3.285 -2.071 5.096 1.00 0.00 H new ATOM 0 HA ASN A 992 1.981 -0.264 6.765 1.00 0.00 H new ATOM 0 HB2 ASN A 992 2.562 -2.699 7.157 1.00 0.00 H new ATOM 0 HB3 ASN A 992 4.225 -2.218 7.429 1.00 0.00 H new ATOM 0 HD21 ASN A 992 2.158 -2.586 10.644 1.00 0.00 H new ATOM 0 HD22 ASN A 992 2.226 -3.566 9.176 1.00 0.00 H new ATOM 1272 N SER A 993 5.257 0.175 6.786 1.00 0.00 N ATOM 1273 CA SER A 993 6.289 1.136 7.147 1.00 0.00 C ATOM 1274 C SER A 993 6.437 2.240 6.094 1.00 0.00 C ATOM 1275 O SER A 993 6.745 3.382 6.435 1.00 0.00 O ATOM 1276 CB SER A 993 7.620 0.421 7.378 1.00 0.00 C ATOM 1277 OG SER A 993 8.590 1.302 7.916 1.00 0.00 O ATOM 0 H SER A 993 5.606 -0.696 6.386 1.00 0.00 H new ATOM 0 HA SER A 993 5.983 1.619 8.075 1.00 0.00 H new ATOM 0 HB2 SER A 993 7.471 -0.418 8.057 1.00 0.00 H new ATOM 0 HB3 SER A 993 7.982 0.009 6.436 1.00 0.00 H new ATOM 0 HG SER A 993 9.431 0.818 8.055 1.00 0.00 H new ATOM 1283 N ASP A 994 6.236 1.914 4.826 1.00 0.00 N ATOM 1284 CA ASP A 994 6.341 2.933 3.778 1.00 0.00 C ATOM 1285 C ASP A 994 5.195 3.954 3.861 1.00 0.00 C ATOM 1286 O ASP A 994 5.370 5.127 3.548 1.00 0.00 O ATOM 1287 CB ASP A 994 6.441 2.299 2.390 1.00 0.00 C ATOM 1288 CG ASP A 994 7.800 2.550 1.766 1.00 0.00 C ATOM 1289 OD1 ASP A 994 8.733 1.754 2.024 1.00 0.00 O ATOM 1290 OD2 ASP A 994 7.956 3.552 1.037 1.00 0.00 O ATOM 0 H ASP A 994 6.004 0.977 4.497 1.00 0.00 H new ATOM 0 HA ASP A 994 7.267 3.482 3.949 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.265 1.226 2.465 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.662 2.705 1.745 1.00 0.00 H new ATOM 1295 N LEU A 995 4.018 3.504 4.278 1.00 0.00 N ATOM 1296 CA LEU A 995 2.908 4.408 4.608 1.00 0.00 C ATOM 1297 C LEU A 995 3.235 5.186 5.880 1.00 0.00 C ATOM 1298 O LEU A 995 2.698 6.267 6.090 1.00 0.00 O ATOM 1299 CB LEU A 995 1.574 3.629 4.697 1.00 0.00 C ATOM 1300 CG LEU A 995 0.289 4.407 5.055 1.00 0.00 C ATOM 1301 CD1 LEU A 995 0.181 4.660 6.551 1.00 0.00 C ATOM 1302 CD2 LEU A 995 0.200 5.715 4.289 1.00 0.00 C ATOM 0 H LEU A 995 3.801 2.515 4.398 1.00 0.00 H new ATOM 0 HA LEU A 995 2.779 5.138 3.809 1.00 0.00 H new ATOM 0 HB2 LEU A 995 1.410 3.142 3.736 1.00 0.00 H new ATOM 0 HB3 LEU A 995 1.700 2.839 5.437 1.00 0.00 H new ATOM 0 HG LEU A 995 -0.552 3.780 4.759 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -0.736 5.210 6.762 1.00 0.00 H new ATOM 0 HD12 LEU A 995 0.163 3.708 7.081 1.00 0.00 H new ATOM 0 HD13 LEU A 995 1.039 5.244 6.884 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -0.716 6.237 4.565 1.00 0.00 H new ATOM 0 HD22 LEU A 995 1.060 6.339 4.533 1.00 0.00 H new ATOM 0 HD23 LEU A 995 0.192 5.510 3.218 1.00 0.00 H new ATOM 1314 N ALA A 996 4.164 4.716 6.686 1.00 0.00 N ATOM 1315 CA ALA A 996 4.686 5.568 7.757 1.00 0.00 C ATOM 1316 C ALA A 996 5.659 6.616 7.184 1.00 0.00 C ATOM 1317 O ALA A 996 5.870 7.676 7.779 1.00 0.00 O ATOM 1318 CB ALA A 996 5.332 4.745 8.859 1.00 0.00 C ATOM 0 H ALA A 996 4.569 3.781 6.633 1.00 0.00 H new ATOM 0 HA ALA A 996 3.848 6.098 8.209 1.00 0.00 H new ATOM 0 HB1 ALA A 996 5.708 5.410 9.637 1.00 0.00 H new ATOM 0 HB2 ALA A 996 4.594 4.067 9.287 1.00 0.00 H new ATOM 0 HB3 ALA A 996 6.158 4.167 8.445 1.00 0.00 H new ATOM 1324 N GLU A 997 6.211 6.336 6.006 1.00 0.00 N ATOM 1325 CA GLU A 997 7.039 7.303 5.277 1.00 0.00 C ATOM 1326 C GLU A 997 6.164 8.382 4.634 1.00 0.00 C ATOM 1327 O GLU A 997 6.495 9.575 4.683 1.00 0.00 O ATOM 1328 CB GLU A 997 7.862 6.594 4.196 1.00 0.00 C ATOM 1329 CG GLU A 997 8.796 7.511 3.426 1.00 0.00 C ATOM 1330 CD GLU A 997 9.961 7.988 4.259 1.00 0.00 C ATOM 1331 OE1 GLU A 997 9.790 8.962 5.015 1.00 0.00 O ATOM 1332 OE2 GLU A 997 11.057 7.398 4.150 1.00 0.00 O ATOM 0 H GLU A 997 6.101 5.441 5.530 1.00 0.00 H new ATOM 0 HA GLU A 997 7.717 7.775 5.988 1.00 0.00 H new ATOM 0 HB2 GLU A 997 8.450 5.803 4.662 1.00 0.00 H new ATOM 0 HB3 GLU A 997 7.181 6.113 3.493 1.00 0.00 H new ATOM 0 HG2 GLU A 997 9.173 6.985 2.549 1.00 0.00 H new ATOM 0 HG3 GLU A 997 8.236 8.373 3.065 1.00 0.00 H new ATOM 1339 N LEU A 998 5.045 7.969 4.049 1.00 0.00 N ATOM 1340 CA LEU A 998 4.112 8.915 3.453 1.00 0.00 C ATOM 1341 C LEU A 998 3.668 9.940 4.483 1.00 0.00 C ATOM 1342 O LEU A 998 3.673 11.137 4.218 1.00 0.00 O ATOM 1343 CB LEU A 998 2.895 8.181 2.863 1.00 0.00 C ATOM 1344 CG LEU A 998 1.655 9.050 2.569 1.00 0.00 C ATOM 1345 CD1 LEU A 998 0.864 8.479 1.410 1.00 0.00 C ATOM 1346 CD2 LEU A 998 0.746 9.153 3.787 1.00 0.00 C ATOM 0 H LEU A 998 4.764 6.991 3.975 1.00 0.00 H new ATOM 0 HA LEU A 998 4.622 9.436 2.642 1.00 0.00 H new ATOM 0 HB2 LEU A 998 3.203 7.697 1.936 1.00 0.00 H new ATOM 0 HB3 LEU A 998 2.603 7.390 3.554 1.00 0.00 H new ATOM 0 HG LEU A 998 2.015 10.046 2.312 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -0.006 9.107 1.219 1.00 0.00 H new ATOM 0 HD12 LEU A 998 1.493 8.450 0.520 1.00 0.00 H new ATOM 0 HD13 LEU A 998 0.536 7.469 1.656 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -0.118 9.772 3.545 1.00 0.00 H new ATOM 0 HD22 LEU A 998 0.409 8.157 4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 998 1.295 9.604 4.614 1.00 0.00 H new ATOM 1358 N ILE A 999 3.354 9.459 5.682 1.00 0.00 N ATOM 1359 CA ILE A 999 2.756 10.299 6.727 1.00 0.00 C ATOM 1360 C ILE A 999 3.716 11.378 7.222 1.00 0.00 C ATOM 1361 O ILE A 999 3.334 12.537 7.336 1.00 0.00 O ATOM 1362 CB ILE A 999 2.316 9.456 7.944 1.00 0.00 C ATOM 1363 CG1 ILE A 999 1.273 8.416 7.542 1.00 0.00 C ATOM 1364 CG2 ILE A 999 1.769 10.352 9.047 1.00 0.00 C ATOM 1365 CD1 ILE A 999 0.970 7.428 8.647 1.00 0.00 C ATOM 0 H ILE A 999 3.503 8.489 5.960 1.00 0.00 H new ATOM 0 HA ILE A 999 1.890 10.773 6.265 1.00 0.00 H new ATOM 0 HB ILE A 999 3.193 8.931 8.323 1.00 0.00 H new ATOM 0 HG12 ILE A 999 0.353 8.924 7.254 1.00 0.00 H new ATOM 0 HG13 ILE A 999 1.627 7.875 6.664 1.00 0.00 H new ATOM 0 HG21 ILE A 999 1.464 9.740 9.896 1.00 0.00 H new ATOM 0 HG22 ILE A 999 2.542 11.052 9.364 1.00 0.00 H new ATOM 0 HG23 ILE A 999 0.909 10.906 8.672 1.00 0.00 H new ATOM 0 HD11 ILE A 999 0.222 6.714 8.302 1.00 0.00 H new ATOM 0 HD12 ILE A 999 1.881 6.896 8.919 1.00 0.00 H new ATOM 0 HD13 ILE A 999 0.588 7.961 9.517 1.00 0.00 H new ATOM 1377 N ASN A1000 4.961 10.999 7.509 1.00 0.00 N ATOM 1378 CA ASN A1000 5.907 11.919 8.150 1.00 0.00 C ATOM 1379 C ASN A1000 6.201 13.124 7.260 1.00 0.00 C ATOM 1380 O ASN A1000 6.318 14.259 7.731 1.00 0.00 O ATOM 1381 CB ASN A1000 7.206 11.184 8.532 1.00 0.00 C ATOM 1382 CG ASN A1000 8.122 10.857 7.381 1.00 0.00 C ATOM 1383 OD1 ASN A1000 8.885 11.695 6.903 1.00 0.00 O ATOM 1384 ND2 ASN A1000 8.099 9.604 6.988 1.00 0.00 N ATOM 0 H ASN A1000 5.338 10.072 7.311 1.00 0.00 H new ATOM 0 HA ASN A1000 5.444 12.292 9.064 1.00 0.00 H new ATOM 0 HB2 ASN A1000 7.754 11.797 9.248 1.00 0.00 H new ATOM 0 HB3 ASN A1000 6.943 10.257 9.041 1.00 0.00 H new ATOM 0 HD21 ASN A1000 8.733 9.288 6.255 1.00 0.00 H new ATOM 0 HD22 ASN A1000 7.447 8.947 7.416 1.00 0.00 H new ATOM 1391 N LYS A1001 6.280 12.867 5.971 1.00 0.00 N ATOM 1392 CA LYS A1001 6.579 13.912 4.997 1.00 0.00 C ATOM 1393 C LYS A1001 5.310 14.653 4.622 1.00 0.00 C ATOM 1394 O LYS A1001 5.307 15.868 4.425 1.00 0.00 O ATOM 1395 CB LYS A1001 7.257 13.316 3.765 1.00 0.00 C ATOM 1396 CG LYS A1001 8.699 12.918 4.029 1.00 0.00 C ATOM 1397 CD LYS A1001 9.294 12.115 2.887 1.00 0.00 C ATOM 1398 CE LYS A1001 10.767 11.828 3.134 1.00 0.00 C ATOM 1399 NZ LYS A1001 11.000 11.201 4.463 1.00 0.00 N ATOM 0 H LYS A1001 6.142 11.941 5.566 1.00 0.00 H new ATOM 0 HA LYS A1001 7.270 14.626 5.444 1.00 0.00 H new ATOM 0 HB2 LYS A1001 6.697 12.441 3.434 1.00 0.00 H new ATOM 0 HB3 LYS A1001 7.227 14.041 2.951 1.00 0.00 H new ATOM 0 HG2 LYS A1001 9.297 13.815 4.190 1.00 0.00 H new ATOM 0 HG3 LYS A1001 8.750 12.332 4.947 1.00 0.00 H new ATOM 0 HD2 LYS A1001 8.751 11.177 2.775 1.00 0.00 H new ATOM 0 HD3 LYS A1001 9.178 12.664 1.952 1.00 0.00 H new ATOM 0 HE2 LYS A1001 11.144 11.169 2.352 1.00 0.00 H new ATOM 0 HE3 LYS A1001 11.333 12.757 3.068 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 11.968 10.824 4.504 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 10.874 11.914 5.210 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 10.321 10.427 4.605 1.00 0.00 H new ATOM 1413 N MET A1002 4.218 13.917 4.597 1.00 0.00 N ATOM 1414 CA MET A1002 2.919 14.497 4.351 1.00 0.00 C ATOM 1415 C MET A1002 2.600 15.476 5.456 1.00 0.00 C ATOM 1416 O MET A1002 1.869 16.454 5.274 1.00 0.00 O ATOM 1417 CB MET A1002 1.861 13.408 4.343 1.00 0.00 C ATOM 1418 CG MET A1002 0.560 13.870 3.746 1.00 0.00 C ATOM 1419 SD MET A1002 -0.469 12.511 3.202 1.00 0.00 S ATOM 1420 CE MET A1002 -1.648 13.416 2.227 1.00 0.00 C ATOM 0 H MET A1002 4.208 12.908 4.746 1.00 0.00 H new ATOM 0 HA MET A1002 2.928 15.004 3.386 1.00 0.00 H new ATOM 0 HB2 MET A1002 2.231 12.551 3.780 1.00 0.00 H new ATOM 0 HB3 MET A1002 1.688 13.068 5.364 1.00 0.00 H new ATOM 0 HG2 MET A1002 0.016 14.460 4.483 1.00 0.00 H new ATOM 0 HG3 MET A1002 0.765 14.526 2.900 1.00 0.00 H new ATOM 0 HE1 MET A1002 -2.657 13.090 2.481 1.00 0.00 H new ATOM 0 HE2 MET A1002 -1.548 14.482 2.432 1.00 0.00 H new ATOM 0 HE3 MET A1002 -1.463 13.232 1.169 1.00 0.00 H new ATOM 1430 N LYS A1003 3.197 15.197 6.603 1.00 0.00 N ATOM 1431 CA LYS A1003 2.882 15.882 7.824 1.00 0.00 C ATOM 1432 C LYS A1003 3.443 17.294 7.794 1.00 0.00 C ATOM 1433 O LYS A1003 2.711 18.269 7.929 1.00 0.00 O ATOM 1434 CB LYS A1003 3.477 15.116 9.010 1.00 0.00 C ATOM 1435 CG LYS A1003 2.588 15.077 10.238 1.00 0.00 C ATOM 1436 CD LYS A1003 1.293 14.333 9.960 1.00 0.00 C ATOM 1437 CE LYS A1003 0.520 14.074 11.242 1.00 0.00 C ATOM 1438 NZ LYS A1003 0.263 15.323 12.007 1.00 0.00 N ATOM 0 H LYS A1003 3.918 14.482 6.703 1.00 0.00 H new ATOM 0 HA LYS A1003 1.799 15.935 7.931 1.00 0.00 H new ATOM 0 HB2 LYS A1003 3.689 14.094 8.697 1.00 0.00 H new ATOM 0 HB3 LYS A1003 4.430 15.571 9.280 1.00 0.00 H new ATOM 0 HG2 LYS A1003 3.119 14.593 11.058 1.00 0.00 H new ATOM 0 HG3 LYS A1003 2.364 16.094 10.559 1.00 0.00 H new ATOM 0 HD2 LYS A1003 0.678 14.914 9.273 1.00 0.00 H new ATOM 0 HD3 LYS A1003 1.514 13.386 9.468 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -0.430 13.596 11.001 1.00 0.00 H new ATOM 0 HE3 LYS A1003 1.079 13.377 11.866 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -0.432 15.134 12.757 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 1.151 15.658 12.433 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -0.110 16.052 11.366 1.00 0.00 H new ATOM 1452 N LEU A1004 4.744 17.401 7.559 1.00 0.00 N ATOM 1453 CA LEU A1004 5.405 18.697 7.492 1.00 0.00 C ATOM 1454 C LEU A1004 4.927 19.510 6.294 1.00 0.00 C ATOM 1455 O LEU A1004 5.148 20.717 6.243 1.00 0.00 O ATOM 1456 CB LEU A1004 6.929 18.535 7.462 1.00 0.00 C ATOM 1457 CG LEU A1004 7.536 17.849 8.697 1.00 0.00 C ATOM 1458 CD1 LEU A1004 9.025 17.606 8.515 1.00 0.00 C ATOM 1459 CD2 LEU A1004 7.298 18.685 9.943 1.00 0.00 C ATOM 0 H LEU A1004 5.363 16.604 7.411 1.00 0.00 H new ATOM 0 HA LEU A1004 5.136 19.246 8.394 1.00 0.00 H new ATOM 0 HB2 LEU A1004 7.200 17.961 6.576 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.382 19.521 7.354 1.00 0.00 H new ATOM 0 HG LEU A1004 7.042 16.885 8.816 1.00 0.00 H new ATOM 0 HD11 LEU A1004 9.426 17.120 9.405 1.00 0.00 H new ATOM 0 HD12 LEU A1004 9.186 16.965 7.648 1.00 0.00 H new ATOM 0 HD13 LEU A1004 9.533 18.558 8.362 1.00 0.00 H new ATOM 0 HD21 LEU A1004 7.735 18.183 10.807 1.00 0.00 H new ATOM 0 HD22 LEU A1004 7.762 19.663 9.819 1.00 0.00 H new ATOM 0 HD23 LEU A1004 6.226 18.809 10.099 1.00 0.00 H new ATOM 1471 N ALA A1005 4.234 18.877 5.357 1.00 0.00 N ATOM 1472 CA ALA A1005 3.736 19.616 4.209 1.00 0.00 C ATOM 1473 C ALA A1005 2.571 20.503 4.622 1.00 0.00 C ATOM 1474 O ALA A1005 2.592 21.681 4.338 1.00 0.00 O ATOM 1475 CB ALA A1005 3.360 18.699 3.059 1.00 0.00 C ATOM 0 H ALA A1005 4.009 17.882 5.367 1.00 0.00 H new ATOM 0 HA ALA A1005 4.542 20.252 3.844 1.00 0.00 H new ATOM 0 HB1 ALA A1005 2.993 19.295 2.223 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.236 18.133 2.744 1.00 0.00 H new ATOM 0 HB3 ALA A1005 2.580 18.010 3.383 1.00 0.00 H new ATOM 1481 N GLN A1006 1.566 19.952 5.287 1.00 0.00 N ATOM 1482 CA GLN A1006 0.471 20.770 5.824 1.00 0.00 C ATOM 1483 C GLN A1006 0.934 21.657 6.976 1.00 0.00 C ATOM 1484 O GLN A1006 0.443 22.783 7.109 1.00 0.00 O ATOM 1485 CB GLN A1006 -0.735 19.911 6.216 1.00 0.00 C ATOM 1486 CG GLN A1006 -0.424 18.724 7.135 1.00 0.00 C ATOM 1487 CD GLN A1006 -0.336 19.069 8.619 1.00 0.00 C ATOM 1488 OE1 GLN A1006 0.400 18.427 9.366 1.00 0.00 O ATOM 1489 NE2 GLN A1006 -1.105 20.047 9.075 1.00 0.00 N ATOM 0 H GLN A1006 1.479 18.952 5.470 1.00 0.00 H new ATOM 0 HA GLN A1006 0.146 21.435 5.024 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -1.469 20.548 6.709 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -1.201 19.532 5.306 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -1.194 17.965 6.998 1.00 0.00 H new ATOM 0 HG3 GLN A1006 0.521 18.279 6.823 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -1.706 20.564 8.434 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -1.095 20.283 10.067 1.00 0.00 H new ATOM 1498 N GLN A1007 1.902 21.194 7.764 1.00 0.00 N ATOM 1499 CA GLN A1007 2.463 22.017 8.837 1.00 0.00 C ATOM 1500 C GLN A1007 2.900 23.388 8.315 1.00 0.00 C ATOM 1501 O GLN A1007 2.703 24.412 8.970 1.00 0.00 O ATOM 1502 CB GLN A1007 3.640 21.304 9.505 1.00 0.00 C ATOM 1503 CG GLN A1007 3.197 20.098 10.322 1.00 0.00 C ATOM 1504 CD GLN A1007 4.280 19.526 11.215 1.00 0.00 C ATOM 1505 OE1 GLN A1007 4.324 18.318 11.452 1.00 0.00 O ATOM 1506 NE2 GLN A1007 5.140 20.382 11.750 1.00 0.00 N ATOM 0 H GLN A1007 2.312 20.263 7.683 1.00 0.00 H new ATOM 0 HA GLN A1007 1.680 22.172 9.580 1.00 0.00 H new ATOM 0 HB2 GLN A1007 4.348 20.982 8.741 1.00 0.00 H new ATOM 0 HB3 GLN A1007 4.167 22.005 10.153 1.00 0.00 H new ATOM 0 HG2 GLN A1007 2.345 20.383 10.939 1.00 0.00 H new ATOM 0 HG3 GLN A1007 2.852 19.319 9.642 1.00 0.00 H new ATOM 0 HE21 GLN A1007 5.073 21.376 11.531 1.00 0.00 H new ATOM 0 HE22 GLN A1007 5.868 20.046 12.381 1.00 0.00 H new ATOM 1515 N TYR A1008 3.506 23.400 7.135 1.00 0.00 N ATOM 1516 CA TYR A1008 3.836 24.653 6.471 1.00 0.00 C ATOM 1517 C TYR A1008 3.271 24.667 5.055 1.00 0.00 C ATOM 1518 O TYR A1008 3.918 25.152 4.121 1.00 0.00 O ATOM 1519 CB TYR A1008 5.346 24.883 6.443 1.00 0.00 C ATOM 1520 CG TYR A1008 5.944 25.237 7.788 1.00 0.00 C ATOM 1521 CD1 TYR A1008 6.167 24.263 8.753 1.00 0.00 C ATOM 1522 CD2 TYR A1008 6.303 26.546 8.084 1.00 0.00 C ATOM 1523 CE1 TYR A1008 6.726 24.582 9.974 1.00 0.00 C ATOM 1524 CE2 TYR A1008 6.861 26.874 9.306 1.00 0.00 C ATOM 1525 CZ TYR A1008 7.072 25.887 10.244 1.00 0.00 C ATOM 1526 OH TYR A1008 7.634 26.202 11.461 1.00 0.00 O ATOM 0 H TYR A1008 3.777 22.562 6.621 1.00 0.00 H new ATOM 0 HA TYR A1008 3.383 25.465 7.040 1.00 0.00 H new ATOM 0 HB2 TYR A1008 5.833 23.983 6.067 1.00 0.00 H new ATOM 0 HB3 TYR A1008 5.567 25.684 5.737 1.00 0.00 H new ATOM 0 HD1 TYR A1008 5.898 23.238 8.544 1.00 0.00 H new ATOM 0 HD2 TYR A1008 6.144 27.320 7.348 1.00 0.00 H new ATOM 0 HE1 TYR A1008 6.891 23.812 10.713 1.00 0.00 H new ATOM 0 HE2 TYR A1008 7.130 27.897 9.524 1.00 0.00 H new ATOM 0 HH TYR A1008 7.822 27.163 11.496 1.00 0.00 H new ATOM 1536 N VAL A1009 2.058 24.125 4.906 1.00 0.00 N ATOM 1537 CA VAL A1009 1.352 24.096 3.617 1.00 0.00 C ATOM 1538 C VAL A1009 1.253 25.492 3.040 1.00 0.00 C ATOM 1539 O VAL A1009 1.084 25.684 1.833 1.00 0.00 O ATOM 1540 CB VAL A1009 -0.073 23.522 3.765 1.00 0.00 C ATOM 1541 CG1 VAL A1009 -0.924 24.446 4.620 1.00 0.00 C ATOM 1542 CG2 VAL A1009 -0.709 23.299 2.404 1.00 0.00 C ATOM 0 H VAL A1009 1.538 23.695 5.671 1.00 0.00 H new ATOM 0 HA VAL A1009 1.926 23.453 2.950 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.009 22.555 4.263 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -1.927 24.031 4.717 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -0.474 24.544 5.608 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -0.982 25.427 4.149 1.00 0.00 H new ATOM 0 HG21 VAL A1009 -1.713 22.894 2.533 1.00 0.00 H new ATOM 0 HG22 VAL A1009 -0.766 24.247 1.869 1.00 0.00 H new ATOM 0 HG23 VAL A1009 -0.105 22.595 1.831 1.00 0.00 H new ATOM 1552 N MET A1010 1.366 26.455 3.928 1.00 0.00 N ATOM 1553 CA MET A1010 1.342 27.858 3.566 1.00 0.00 C ATOM 1554 C MET A1010 2.313 28.168 2.421 1.00 0.00 C ATOM 1555 O MET A1010 2.054 29.080 1.643 1.00 0.00 O ATOM 1556 CB MET A1010 1.656 28.708 4.797 1.00 0.00 C ATOM 1557 CG MET A1010 0.698 28.449 5.950 1.00 0.00 C ATOM 1558 SD MET A1010 1.117 29.367 7.443 1.00 0.00 S ATOM 1559 CE MET A1010 -0.064 28.668 8.593 1.00 0.00 C ATOM 0 H MET A1010 1.478 26.287 4.928 1.00 0.00 H new ATOM 0 HA MET A1010 0.343 28.103 3.206 1.00 0.00 H new ATOM 0 HB2 MET A1010 2.675 28.503 5.124 1.00 0.00 H new ATOM 0 HB3 MET A1010 1.614 29.763 4.525 1.00 0.00 H new ATOM 0 HG2 MET A1010 -0.313 28.714 5.640 1.00 0.00 H new ATOM 0 HG3 MET A1010 0.693 27.383 6.177 1.00 0.00 H new ATOM 0 HE1 MET A1010 0.063 29.131 9.571 1.00 0.00 H new ATOM 0 HE2 MET A1010 -1.076 28.853 8.232 1.00 0.00 H new ATOM 0 HE3 MET A1010 0.101 27.594 8.676 1.00 0.00 H new ATOM 1569 N THR A1011 3.419 27.406 2.302 1.00 0.00 N ATOM 1570 CA THR A1011 4.363 27.614 1.188 1.00 0.00 C ATOM 1571 C THR A1011 5.347 26.443 0.956 1.00 0.00 C ATOM 1572 O THR A1011 5.010 25.402 0.345 1.00 0.00 O ATOM 1573 CB THR A1011 5.198 28.903 1.386 1.00 0.00 C ATOM 1574 OG1 THR A1011 5.319 29.202 2.786 1.00 0.00 O ATOM 1575 CG2 THR A1011 4.601 30.092 0.640 1.00 0.00 C ATOM 0 H THR A1011 3.676 26.659 2.947 1.00 0.00 H new ATOM 0 HA THR A1011 3.722 27.693 0.310 1.00 0.00 H new ATOM 0 HB THR A1011 6.188 28.721 0.968 1.00 0.00 H new ATOM 0 HG1 THR A1011 5.850 30.018 2.902 1.00 0.00 H new ATOM 0 HG21 THR A1011 5.219 30.974 0.807 1.00 0.00 H new ATOM 0 HG22 THR A1011 4.565 29.871 -0.427 1.00 0.00 H new ATOM 0 HG23 THR A1011 3.592 30.282 1.006 1.00 0.00 H new ATOM 1583 N SER A1012 6.562 26.635 1.478 1.00 0.00 N ATOM 1584 CA SER A1012 7.737 25.857 1.092 1.00 0.00 C ATOM 1585 C SER A1012 7.563 24.357 1.282 1.00 0.00 C ATOM 1586 O SER A1012 7.573 23.603 0.301 1.00 0.00 O ATOM 1587 CB SER A1012 8.953 26.359 1.874 1.00 0.00 C ATOM 1588 OG SER A1012 8.617 26.602 3.232 1.00 0.00 O ATOM 0 H SER A1012 6.757 27.342 2.187 1.00 0.00 H new ATOM 0 HA SER A1012 7.884 26.006 0.022 1.00 0.00 H new ATOM 0 HB2 SER A1012 9.755 25.622 1.820 1.00 0.00 H new ATOM 0 HB3 SER A1012 9.330 27.275 1.419 1.00 0.00 H new ATOM 0 HG SER A1012 9.409 26.920 3.713 1.00 0.00 H new ATOM 1594 N LEU A1013 7.417 23.915 2.530 1.00 0.00 N ATOM 1595 CA LEU A1013 7.300 22.495 2.825 1.00 0.00 C ATOM 1596 C LEU A1013 6.229 21.846 1.997 1.00 0.00 C ATOM 1597 O LEU A1013 6.394 20.727 1.552 1.00 0.00 O ATOM 1598 CB LEU A1013 6.968 22.244 4.290 1.00 0.00 C ATOM 1599 CG LEU A1013 7.865 22.973 5.302 1.00 0.00 C ATOM 1600 CD1 LEU A1013 7.766 22.318 6.667 1.00 0.00 C ATOM 1601 CD2 LEU A1013 9.314 22.990 4.836 1.00 0.00 C ATOM 0 H LEU A1013 7.377 24.521 3.349 1.00 0.00 H new ATOM 0 HA LEU A1013 8.272 22.062 2.588 1.00 0.00 H new ATOM 0 HB2 LEU A1013 5.934 22.540 4.467 1.00 0.00 H new ATOM 0 HB3 LEU A1013 7.030 21.173 4.481 1.00 0.00 H new ATOM 0 HG LEU A1013 7.517 24.003 5.377 1.00 0.00 H new ATOM 0 HD11 LEU A1013 8.408 22.847 7.372 1.00 0.00 H new ATOM 0 HD12 LEU A1013 6.734 22.358 7.016 1.00 0.00 H new ATOM 0 HD13 LEU A1013 8.085 21.278 6.596 1.00 0.00 H new ATOM 0 HD21 LEU A1013 9.926 23.512 5.571 1.00 0.00 H new ATOM 0 HD22 LEU A1013 9.673 21.967 4.726 1.00 0.00 H new ATOM 0 HD23 LEU A1013 9.382 23.503 3.877 1.00 0.00 H new ATOM 1613 N GLN A1014 5.149 22.564 1.768 1.00 0.00 N ATOM 1614 CA GLN A1014 3.970 21.965 1.192 1.00 0.00 C ATOM 1615 C GLN A1014 4.301 21.257 -0.112 1.00 0.00 C ATOM 1616 O GLN A1014 4.019 20.075 -0.283 1.00 0.00 O ATOM 1617 CB GLN A1014 2.913 23.027 0.962 1.00 0.00 C ATOM 1618 CG GLN A1014 1.775 22.575 0.065 1.00 0.00 C ATOM 1619 CD GLN A1014 1.803 23.227 -1.308 1.00 0.00 C ATOM 1620 OE1 GLN A1014 1.390 22.628 -2.303 1.00 0.00 O ATOM 1621 NE2 GLN A1014 2.278 24.463 -1.378 1.00 0.00 N ATOM 0 H GLN A1014 5.066 23.560 1.972 1.00 0.00 H new ATOM 0 HA GLN A1014 3.584 21.222 1.890 1.00 0.00 H new ATOM 0 HB2 GLN A1014 2.504 23.334 1.925 1.00 0.00 H new ATOM 0 HB3 GLN A1014 3.384 23.905 0.521 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.821 21.492 -0.052 1.00 0.00 H new ATOM 0 HG3 GLN A1014 0.826 22.803 0.550 1.00 0.00 H new ATOM 0 HE21 GLN A1014 2.612 24.930 -0.535 1.00 0.00 H new ATOM 0 HE22 GLN A1014 2.310 24.947 -2.275 1.00 0.00 H new ATOM 1630 N GLN A1015 4.950 21.989 -1.017 1.00 0.00 N ATOM 1631 CA GLN A1015 5.227 21.460 -2.345 1.00 0.00 C ATOM 1632 C GLN A1015 6.305 20.372 -2.296 1.00 0.00 C ATOM 1633 O GLN A1015 6.226 19.380 -3.010 1.00 0.00 O ATOM 1634 CB GLN A1015 5.605 22.592 -3.320 1.00 0.00 C ATOM 1635 CG GLN A1015 6.739 23.494 -2.852 1.00 0.00 C ATOM 1636 CD GLN A1015 8.118 22.915 -3.115 1.00 0.00 C ATOM 1637 OE1 GLN A1015 8.327 22.178 -4.077 1.00 0.00 O ATOM 1638 NE2 GLN A1015 9.069 23.243 -2.257 1.00 0.00 N ATOM 0 H GLN A1015 5.289 22.937 -0.855 1.00 0.00 H new ATOM 0 HA GLN A1015 4.315 20.994 -2.719 1.00 0.00 H new ATOM 0 HB2 GLN A1015 5.884 22.149 -4.276 1.00 0.00 H new ATOM 0 HB3 GLN A1015 4.723 23.206 -3.499 1.00 0.00 H new ATOM 0 HG2 GLN A1015 6.656 24.459 -3.353 1.00 0.00 H new ATOM 0 HG3 GLN A1015 6.629 23.679 -1.784 1.00 0.00 H new ATOM 0 HE21 GLN A1015 8.857 23.857 -1.471 1.00 0.00 H new ATOM 0 HE22 GLN A1015 10.015 22.882 -2.381 1.00 0.00 H new ATOM 1647 N GLU A1016 7.290 20.557 -1.426 1.00 0.00 N ATOM 1648 CA GLU A1016 8.388 19.603 -1.278 1.00 0.00 C ATOM 1649 C GLU A1016 7.921 18.338 -0.567 1.00 0.00 C ATOM 1650 O GLU A1016 8.118 17.224 -1.036 1.00 0.00 O ATOM 1651 CB GLU A1016 9.523 20.242 -0.470 1.00 0.00 C ATOM 1652 CG GLU A1016 10.752 19.358 -0.335 1.00 0.00 C ATOM 1653 CD GLU A1016 11.638 19.758 0.829 1.00 0.00 C ATOM 1654 OE1 GLU A1016 12.394 20.742 0.700 1.00 0.00 O ATOM 1655 OE2 GLU A1016 11.591 19.078 1.879 1.00 0.00 O ATOM 0 H GLU A1016 7.353 21.365 -0.807 1.00 0.00 H new ATOM 0 HA GLU A1016 8.742 19.336 -2.274 1.00 0.00 H new ATOM 0 HB2 GLU A1016 9.812 21.180 -0.945 1.00 0.00 H new ATOM 0 HB3 GLU A1016 9.154 20.489 0.525 1.00 0.00 H new ATOM 0 HG2 GLU A1016 10.437 18.322 -0.207 1.00 0.00 H new ATOM 0 HG3 GLU A1016 11.330 19.403 -1.258 1.00 0.00 H new ATOM 1662 N TYR A1017 7.293 18.528 0.561 1.00 0.00 N ATOM 1663 CA TYR A1017 6.879 17.449 1.427 1.00 0.00 C ATOM 1664 C TYR A1017 5.796 16.567 0.832 1.00 0.00 C ATOM 1665 O TYR A1017 5.791 15.361 1.022 1.00 0.00 O ATOM 1666 CB TYR A1017 6.397 18.068 2.718 1.00 0.00 C ATOM 1667 CG TYR A1017 7.578 18.198 3.647 1.00 0.00 C ATOM 1668 CD1 TYR A1017 8.041 17.101 4.359 1.00 0.00 C ATOM 1669 CD2 TYR A1017 8.279 19.386 3.751 1.00 0.00 C ATOM 1670 CE1 TYR A1017 9.164 17.187 5.151 1.00 0.00 C ATOM 1671 CE2 TYR A1017 9.397 19.485 4.552 1.00 0.00 C ATOM 1672 CZ TYR A1017 9.838 18.383 5.245 1.00 0.00 C ATOM 1673 OH TYR A1017 10.969 18.470 6.023 1.00 0.00 O ATOM 0 H TYR A1017 7.048 19.453 0.914 1.00 0.00 H new ATOM 0 HA TYR A1017 7.733 16.790 1.584 1.00 0.00 H new ATOM 0 HB2 TYR A1017 5.953 19.045 2.529 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.623 17.448 3.171 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.511 16.163 4.291 1.00 0.00 H new ATOM 0 HD2 TYR A1017 7.945 20.250 3.196 1.00 0.00 H new ATOM 0 HE1 TYR A1017 9.513 16.322 5.695 1.00 0.00 H new ATOM 0 HE2 TYR A1017 9.924 20.424 4.634 1.00 0.00 H new ATOM 0 HH TYR A1017 11.326 19.382 5.981 1.00 0.00 H new ATOM 1683 N LYS A1018 4.870 17.213 0.114 1.00 0.00 N ATOM 1684 CA LYS A1018 3.720 16.550 -0.496 1.00 0.00 C ATOM 1685 C LYS A1018 4.140 15.869 -1.796 1.00 0.00 C ATOM 1686 O LYS A1018 3.563 14.860 -2.196 1.00 0.00 O ATOM 1687 CB LYS A1018 2.599 17.567 -0.764 1.00 0.00 C ATOM 1688 CG LYS A1018 1.369 17.007 -1.479 1.00 0.00 C ATOM 1689 CD LYS A1018 0.403 16.291 -0.538 1.00 0.00 C ATOM 1690 CE LYS A1018 -0.934 16.040 -1.237 1.00 0.00 C ATOM 1691 NZ LYS A1018 -1.945 15.369 -0.363 1.00 0.00 N ATOM 0 H LYS A1018 4.901 18.218 -0.059 1.00 0.00 H new ATOM 0 HA LYS A1018 3.343 15.793 0.192 1.00 0.00 H new ATOM 0 HB2 LYS A1018 2.283 17.994 0.188 1.00 0.00 H new ATOM 0 HB3 LYS A1018 3.006 18.383 -1.361 1.00 0.00 H new ATOM 0 HG2 LYS A1018 0.844 17.822 -1.978 1.00 0.00 H new ATOM 0 HG3 LYS A1018 1.692 16.313 -2.255 1.00 0.00 H new ATOM 0 HD2 LYS A1018 0.835 15.344 -0.215 1.00 0.00 H new ATOM 0 HD3 LYS A1018 0.245 16.892 0.358 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -1.338 16.991 -1.583 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -0.764 15.425 -2.121 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -2.894 15.728 -0.591 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -1.916 14.342 -0.524 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -1.729 15.570 0.634 1.00 0.00 H new ATOM 1705 N LYS A1019 5.151 16.425 -2.454 1.00 0.00 N ATOM 1706 CA LYS A1019 5.688 15.806 -3.652 1.00 0.00 C ATOM 1707 C LYS A1019 6.513 14.584 -3.257 1.00 0.00 C ATOM 1708 O LYS A1019 6.427 13.540 -3.886 1.00 0.00 O ATOM 1709 CB LYS A1019 6.448 16.837 -4.508 1.00 0.00 C ATOM 1710 CG LYS A1019 7.868 16.485 -4.886 1.00 0.00 C ATOM 1711 CD LYS A1019 8.808 16.926 -3.796 1.00 0.00 C ATOM 1712 CE LYS A1019 10.265 16.814 -4.216 1.00 0.00 C ATOM 1713 NZ LYS A1019 10.618 17.797 -5.275 1.00 0.00 N ATOM 0 H LYS A1019 5.609 17.294 -2.179 1.00 0.00 H new ATOM 0 HA LYS A1019 4.883 15.448 -4.293 1.00 0.00 H new ATOM 0 HB2 LYS A1019 5.882 17.002 -5.425 1.00 0.00 H new ATOM 0 HB3 LYS A1019 6.464 17.784 -3.968 1.00 0.00 H new ATOM 0 HG2 LYS A1019 7.957 15.410 -5.043 1.00 0.00 H new ATOM 0 HG3 LYS A1019 8.134 16.968 -5.826 1.00 0.00 H new ATOM 0 HD2 LYS A1019 8.588 17.958 -3.524 1.00 0.00 H new ATOM 0 HD3 LYS A1019 8.640 16.319 -2.906 1.00 0.00 H new ATOM 0 HE2 LYS A1019 10.905 16.971 -3.348 1.00 0.00 H new ATOM 0 HE3 LYS A1019 10.461 15.805 -4.578 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 11.653 17.854 -5.365 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 10.208 17.493 -6.181 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 10.241 18.732 -5.020 1.00 0.00 H new ATOM 1727 N GLN A1020 7.272 14.722 -2.178 1.00 0.00 N ATOM 1728 CA GLN A1020 7.830 13.582 -1.454 1.00 0.00 C ATOM 1729 C GLN A1020 6.718 12.693 -0.921 1.00 0.00 C ATOM 1730 O GLN A1020 6.884 11.476 -0.859 1.00 0.00 O ATOM 1731 CB GLN A1020 8.675 14.060 -0.279 1.00 0.00 C ATOM 1732 CG GLN A1020 9.918 14.823 -0.689 1.00 0.00 C ATOM 1733 CD GLN A1020 10.726 15.276 0.505 1.00 0.00 C ATOM 1734 OE1 GLN A1020 11.639 14.586 0.952 1.00 0.00 O ATOM 1735 NE2 GLN A1020 10.373 16.425 1.052 1.00 0.00 N ATOM 0 H GLN A1020 7.520 15.627 -1.778 1.00 0.00 H new ATOM 0 HA GLN A1020 8.451 13.017 -2.149 1.00 0.00 H new ATOM 0 HB2 GLN A1020 8.064 14.697 0.361 1.00 0.00 H new ATOM 0 HB3 GLN A1020 8.970 13.198 0.319 1.00 0.00 H new ATOM 0 HG2 GLN A1020 10.537 14.192 -1.327 1.00 0.00 H new ATOM 0 HG3 GLN A1020 9.631 15.691 -1.282 1.00 0.00 H new ATOM 0 HE21 GLN A1020 9.609 16.968 0.650 1.00 0.00 H new ATOM 0 HE22 GLN A1020 10.864 16.770 1.877 1.00 0.00 H new ATOM 1744 N MET A1021 5.591 13.279 -0.551 1.00 0.00 N ATOM 1745 CA MET A1021 4.493 12.505 -0.009 1.00 0.00 C ATOM 1746 C MET A1021 3.956 11.576 -1.066 1.00 0.00 C ATOM 1747 O MET A1021 3.863 10.381 -0.838 1.00 0.00 O ATOM 1748 CB MET A1021 3.372 13.401 0.522 1.00 0.00 C ATOM 1749 CG MET A1021 2.240 12.649 1.213 1.00 0.00 C ATOM 1750 SD MET A1021 1.175 11.704 0.097 1.00 0.00 S ATOM 1751 CE MET A1021 0.614 12.970 -1.032 1.00 0.00 C ATOM 0 H MET A1021 5.416 14.282 -0.616 1.00 0.00 H new ATOM 0 HA MET A1021 4.875 11.925 0.831 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.798 14.118 1.224 1.00 0.00 H new ATOM 0 HB3 MET A1021 2.958 13.975 -0.307 1.00 0.00 H new ATOM 0 HG2 MET A1021 2.669 11.968 1.948 1.00 0.00 H new ATOM 0 HG3 MET A1021 1.627 13.365 1.761 1.00 0.00 H new ATOM 0 HE1 MET A1021 0.082 12.507 -1.863 1.00 0.00 H new ATOM 0 HE2 MET A1021 -0.055 13.654 -0.509 1.00 0.00 H new ATOM 0 HE3 MET A1021 1.472 13.523 -1.414 1.00 0.00 H new ATOM 1761 N LEU A1022 3.645 12.103 -2.246 1.00 0.00 N ATOM 1762 CA LEU A1022 3.015 11.271 -3.247 1.00 0.00 C ATOM 1763 C LEU A1022 4.081 10.496 -4.020 1.00 0.00 C ATOM 1764 O LEU A1022 3.772 9.711 -4.905 1.00 0.00 O ATOM 1765 CB LEU A1022 2.110 12.099 -4.177 1.00 0.00 C ATOM 1766 CG LEU A1022 2.610 12.250 -5.612 1.00 0.00 C ATOM 1767 CD1 LEU A1022 1.451 12.585 -6.537 1.00 0.00 C ATOM 1768 CD2 LEU A1022 3.681 13.328 -5.701 1.00 0.00 C ATOM 0 H LEU A1022 3.814 13.071 -2.521 1.00 0.00 H new ATOM 0 HA LEU A1022 2.366 10.550 -2.750 1.00 0.00 H new ATOM 0 HB2 LEU A1022 1.123 11.638 -4.201 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.987 13.093 -3.746 1.00 0.00 H new ATOM 0 HG LEU A1022 3.051 11.303 -5.923 1.00 0.00 H new ATOM 0 HD11 LEU A1022 1.819 12.690 -7.558 1.00 0.00 H new ATOM 0 HD12 LEU A1022 0.712 11.785 -6.499 1.00 0.00 H new ATOM 0 HD13 LEU A1022 0.990 13.520 -6.219 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.022 13.418 -6.732 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.266 14.281 -5.372 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.522 13.058 -5.063 1.00 0.00 H new ATOM 1780 N THR A1023 5.345 10.752 -3.693 1.00 0.00 N ATOM 1781 CA THR A1023 6.447 9.956 -4.213 1.00 0.00 C ATOM 1782 C THR A1023 6.701 8.777 -3.280 1.00 0.00 C ATOM 1783 O THR A1023 7.058 7.692 -3.718 1.00 0.00 O ATOM 1784 CB THR A1023 7.734 10.792 -4.385 1.00 0.00 C ATOM 1785 OG1 THR A1023 7.524 11.804 -5.375 1.00 0.00 O ATOM 1786 CG2 THR A1023 8.913 9.926 -4.799 1.00 0.00 C ATOM 0 H THR A1023 5.629 11.507 -3.069 1.00 0.00 H new ATOM 0 HA THR A1023 6.167 9.593 -5.202 1.00 0.00 H new ATOM 0 HB THR A1023 7.965 11.248 -3.422 1.00 0.00 H new ATOM 0 HG1 THR A1023 7.334 12.658 -4.934 1.00 0.00 H new ATOM 0 HG21 THR A1023 9.801 10.549 -4.910 1.00 0.00 H new ATOM 0 HG22 THR A1023 9.094 9.169 -4.036 1.00 0.00 H new ATOM 0 HG23 THR A1023 8.691 9.438 -5.748 1.00 0.00 H new ATOM 1794 N ALA A1024 6.496 8.999 -1.985 1.00 0.00 N ATOM 1795 CA ALA A1024 6.482 7.916 -1.016 1.00 0.00 C ATOM 1796 C ALA A1024 5.139 7.208 -1.084 1.00 0.00 C ATOM 1797 O ALA A1024 4.996 6.079 -0.648 1.00 0.00 O ATOM 1798 CB ALA A1024 6.758 8.433 0.389 1.00 0.00 C ATOM 0 H ALA A1024 6.337 9.924 -1.585 1.00 0.00 H new ATOM 0 HA ALA A1024 7.275 7.208 -1.258 1.00 0.00 H new ATOM 0 HB1 ALA A1024 6.741 7.601 1.093 1.00 0.00 H new ATOM 0 HB2 ALA A1024 7.737 8.911 0.415 1.00 0.00 H new ATOM 0 HB3 ALA A1024 5.993 9.158 0.667 1.00 0.00 H new ATOM 1804 N ALA A1025 4.155 7.912 -1.610 1.00 0.00 N ATOM 1805 CA ALA A1025 2.874 7.330 -1.956 1.00 0.00 C ATOM 1806 C ALA A1025 2.942 6.727 -3.355 1.00 0.00 C ATOM 1807 O ALA A1025 2.157 5.851 -3.682 1.00 0.00 O ATOM 1808 CB ALA A1025 1.751 8.340 -1.830 1.00 0.00 C ATOM 0 H ALA A1025 4.223 8.910 -1.810 1.00 0.00 H new ATOM 0 HA ALA A1025 2.651 6.531 -1.249 1.00 0.00 H new ATOM 0 HB1 ALA A1025 0.806 7.868 -2.097 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.699 8.700 -0.803 1.00 0.00 H new ATOM 0 HB3 ALA A1025 1.940 9.179 -2.499 1.00 0.00 H new ATOM 1814 N HIS A1026 3.849 7.209 -4.194 1.00 0.00 N ATOM 1815 CA HIS A1026 4.193 6.479 -5.413 1.00 0.00 C ATOM 1816 C HIS A1026 5.080 5.301 -5.038 1.00 0.00 C ATOM 1817 O HIS A1026 5.132 4.315 -5.746 1.00 0.00 O ATOM 1818 CB HIS A1026 4.868 7.378 -6.459 1.00 0.00 C ATOM 1819 CG HIS A1026 5.260 6.671 -7.725 1.00 0.00 C ATOM 1820 ND1 HIS A1026 6.541 6.225 -7.972 1.00 0.00 N ATOM 1821 CD2 HIS A1026 4.536 6.346 -8.823 1.00 0.00 C ATOM 1822 CE1 HIS A1026 6.588 5.660 -9.162 1.00 0.00 C ATOM 1823 NE2 HIS A1026 5.385 5.718 -9.701 1.00 0.00 N ATOM 0 H HIS A1026 4.353 8.085 -4.060 1.00 0.00 H new ATOM 0 HA HIS A1026 3.276 6.117 -5.878 1.00 0.00 H new ATOM 0 HB2 HIS A1026 4.192 8.196 -6.708 1.00 0.00 H new ATOM 0 HB3 HIS A1026 5.758 7.825 -6.016 1.00 0.00 H new ATOM 0 HD2 HIS A1026 3.486 6.544 -8.979 1.00 0.00 H new ATOM 0 HE1 HIS A1026 7.464 5.223 -9.619 1.00 0.00 H new ATOM 0 HE2 HIS A1026 5.128 5.356 -10.619 1.00 0.00 H new ATOM 1832 N ALA A1027 5.737 5.409 -3.901 1.00 0.00 N ATOM 1833 CA ALA A1027 6.383 4.278 -3.235 1.00 0.00 C ATOM 1834 C ALA A1027 5.328 3.386 -2.623 1.00 0.00 C ATOM 1835 O ALA A1027 5.432 2.168 -2.704 1.00 0.00 O ATOM 1836 CB ALA A1027 7.341 4.774 -2.164 1.00 0.00 C ATOM 0 H ALA A1027 5.843 6.292 -3.401 1.00 0.00 H new ATOM 0 HA ALA A1027 6.954 3.708 -3.968 1.00 0.00 H new ATOM 0 HB1 ALA A1027 7.815 3.922 -1.677 1.00 0.00 H new ATOM 0 HB2 ALA A1027 8.106 5.401 -2.622 1.00 0.00 H new ATOM 0 HB3 ALA A1027 6.790 5.355 -1.424 1.00 0.00 H new ATOM 1842 N LEU A1028 4.309 3.969 -2.038 1.00 0.00 N ATOM 1843 CA LEU A1028 3.165 3.192 -1.618 1.00 0.00 C ATOM 1844 C LEU A1028 2.527 2.534 -2.829 1.00 0.00 C ATOM 1845 O LEU A1028 2.192 1.367 -2.783 1.00 0.00 O ATOM 1846 CB LEU A1028 2.159 4.055 -0.864 1.00 0.00 C ATOM 1847 CG LEU A1028 2.642 4.550 0.493 1.00 0.00 C ATOM 1848 CD1 LEU A1028 1.493 5.174 1.254 1.00 0.00 C ATOM 1849 CD2 LEU A1028 3.240 3.397 1.266 1.00 0.00 C ATOM 0 H LEU A1028 4.247 4.968 -1.843 1.00 0.00 H new ATOM 0 HA LEU A1028 3.499 2.415 -0.930 1.00 0.00 H new ATOM 0 HB2 LEU A1028 1.904 4.917 -1.481 1.00 0.00 H new ATOM 0 HB3 LEU A1028 1.242 3.482 -0.722 1.00 0.00 H new ATOM 0 HG LEU A1028 3.410 5.311 0.354 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.847 5.525 2.223 1.00 0.00 H new ATOM 0 HD12 LEU A1028 1.095 6.015 0.686 1.00 0.00 H new ATOM 0 HD13 LEU A1028 0.708 4.432 1.401 1.00 0.00 H new ATOM 0 HD21 LEU A1028 3.586 3.751 2.237 1.00 0.00 H new ATOM 0 HD22 LEU A1028 2.485 2.624 1.409 1.00 0.00 H new ATOM 0 HD23 LEU A1028 4.081 2.983 0.710 1.00 0.00 H new ATOM 1861 N ALA A1029 2.381 3.283 -3.911 1.00 0.00 N ATOM 1862 CA ALA A1029 1.912 2.728 -5.173 1.00 0.00 C ATOM 1863 C ALA A1029 2.837 1.623 -5.674 1.00 0.00 C ATOM 1864 O ALA A1029 2.368 0.586 -6.138 1.00 0.00 O ATOM 1865 CB ALA A1029 1.781 3.826 -6.223 1.00 0.00 C ATOM 0 H ALA A1029 2.582 4.283 -3.941 1.00 0.00 H new ATOM 0 HA ALA A1029 0.930 2.289 -4.998 1.00 0.00 H new ATOM 0 HB1 ALA A1029 1.429 3.394 -7.160 1.00 0.00 H new ATOM 0 HB2 ALA A1029 1.068 4.575 -5.879 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.752 4.295 -6.382 1.00 0.00 H new ATOM 1871 N VAL A1030 4.146 1.847 -5.573 1.00 0.00 N ATOM 1872 CA VAL A1030 5.123 0.881 -6.052 1.00 0.00 C ATOM 1873 C VAL A1030 5.063 -0.390 -5.218 1.00 0.00 C ATOM 1874 O VAL A1030 4.956 -1.502 -5.741 1.00 0.00 O ATOM 1875 CB VAL A1030 6.560 1.458 -6.000 1.00 0.00 C ATOM 1876 CG1 VAL A1030 7.607 0.351 -6.029 1.00 0.00 C ATOM 1877 CG2 VAL A1030 6.794 2.409 -7.162 1.00 0.00 C ATOM 0 H VAL A1030 4.551 2.689 -5.164 1.00 0.00 H new ATOM 0 HA VAL A1030 4.877 0.652 -7.089 1.00 0.00 H new ATOM 0 HB VAL A1030 6.659 2.002 -5.061 1.00 0.00 H new ATOM 0 HG11 VAL A1030 8.603 0.791 -5.991 1.00 0.00 H new ATOM 0 HG12 VAL A1030 7.467 -0.305 -5.170 1.00 0.00 H new ATOM 0 HG13 VAL A1030 7.500 -0.227 -6.947 1.00 0.00 H new ATOM 0 HG21 VAL A1030 7.808 2.805 -7.110 1.00 0.00 H new ATOM 0 HG22 VAL A1030 6.661 1.874 -8.102 1.00 0.00 H new ATOM 0 HG23 VAL A1030 6.080 3.231 -7.109 1.00 0.00 H new ATOM 1887 N ASP A1031 5.116 -0.202 -3.906 1.00 0.00 N ATOM 1888 CA ASP A1031 5.139 -1.312 -2.979 1.00 0.00 C ATOM 1889 C ASP A1031 3.792 -1.989 -2.908 1.00 0.00 C ATOM 1890 O ASP A1031 3.723 -3.190 -2.855 1.00 0.00 O ATOM 1891 CB ASP A1031 5.587 -0.866 -1.591 1.00 0.00 C ATOM 1892 CG ASP A1031 7.090 -0.946 -1.442 1.00 0.00 C ATOM 1893 OD1 ASP A1031 7.599 -2.040 -1.129 1.00 0.00 O ATOM 1894 OD2 ASP A1031 7.772 0.076 -1.659 1.00 0.00 O ATOM 0 H ASP A1031 5.144 0.717 -3.463 1.00 0.00 H new ATOM 0 HA ASP A1031 5.865 -2.034 -3.352 1.00 0.00 H new ATOM 0 HB2 ASP A1031 5.256 0.157 -1.412 1.00 0.00 H new ATOM 0 HB3 ASP A1031 5.111 -1.491 -0.835 1.00 0.00 H new ATOM 1899 N ALA A1032 2.717 -1.221 -2.930 1.00 0.00 N ATOM 1900 CA ALA A1032 1.379 -1.804 -2.943 1.00 0.00 C ATOM 1901 C ALA A1032 1.165 -2.606 -4.224 1.00 0.00 C ATOM 1902 O ALA A1032 0.521 -3.651 -4.192 1.00 0.00 O ATOM 1903 CB ALA A1032 0.304 -0.751 -2.784 1.00 0.00 C ATOM 0 H ALA A1032 2.739 -0.201 -2.939 1.00 0.00 H new ATOM 0 HA ALA A1032 1.301 -2.476 -2.088 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -0.677 -1.227 -2.799 1.00 0.00 H new ATOM 0 HB2 ALA A1032 0.441 -0.232 -1.836 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.372 -0.035 -3.603 1.00 0.00 H new ATOM 1909 N LYS A1033 1.730 -2.140 -5.334 1.00 0.00 N ATOM 1910 CA LYS A1033 1.729 -2.914 -6.573 1.00 0.00 C ATOM 1911 C LYS A1033 2.483 -4.223 -6.360 1.00 0.00 C ATOM 1912 O LYS A1033 2.039 -5.298 -6.768 1.00 0.00 O ATOM 1913 CB LYS A1033 2.387 -2.100 -7.697 1.00 0.00 C ATOM 1914 CG LYS A1033 2.469 -2.823 -9.039 1.00 0.00 C ATOM 1915 CD LYS A1033 3.821 -3.490 -9.240 1.00 0.00 C ATOM 1916 CE LYS A1033 3.883 -4.269 -10.546 1.00 0.00 C ATOM 1917 NZ LYS A1033 3.054 -5.507 -10.506 1.00 0.00 N ATOM 0 H LYS A1033 2.193 -1.234 -5.402 1.00 0.00 H new ATOM 0 HA LYS A1033 0.701 -3.139 -6.858 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.829 -1.173 -7.832 1.00 0.00 H new ATOM 0 HB3 LYS A1033 3.394 -1.823 -7.386 1.00 0.00 H new ATOM 0 HG2 LYS A1033 1.681 -3.574 -9.096 1.00 0.00 H new ATOM 0 HG3 LYS A1033 2.291 -2.112 -9.846 1.00 0.00 H new ATOM 0 HD2 LYS A1033 4.604 -2.732 -9.232 1.00 0.00 H new ATOM 0 HD3 LYS A1033 4.021 -4.163 -8.406 1.00 0.00 H new ATOM 0 HE2 LYS A1033 3.542 -3.633 -11.363 1.00 0.00 H new ATOM 0 HE3 LYS A1033 4.918 -4.534 -10.759 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 3.194 -6.047 -11.384 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 3.338 -6.089 -9.692 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 2.050 -5.250 -10.414 1.00 0.00 H new ATOM 1931 N ASN A1034 3.625 -4.107 -5.697 1.00 0.00 N ATOM 1932 CA ASN A1034 4.502 -5.237 -5.438 1.00 0.00 C ATOM 1933 C ASN A1034 3.891 -6.184 -4.411 1.00 0.00 C ATOM 1934 O ASN A1034 3.751 -7.369 -4.661 1.00 0.00 O ATOM 1935 CB ASN A1034 5.851 -4.727 -4.924 1.00 0.00 C ATOM 1936 CG ASN A1034 6.834 -5.840 -4.611 1.00 0.00 C ATOM 1937 OD1 ASN A1034 6.875 -6.867 -5.289 1.00 0.00 O ATOM 1938 ND2 ASN A1034 7.632 -5.635 -3.577 1.00 0.00 N ATOM 0 H ASN A1034 3.969 -3.223 -5.323 1.00 0.00 H new ATOM 0 HA ASN A1034 4.640 -5.786 -6.370 1.00 0.00 H new ATOM 0 HB2 ASN A1034 6.289 -4.064 -5.670 1.00 0.00 H new ATOM 0 HB3 ASN A1034 5.688 -4.132 -4.025 1.00 0.00 H new ATOM 0 HD21 ASN A1034 8.317 -6.343 -3.313 1.00 0.00 H new ATOM 0 HD22 ASN A1034 7.563 -4.768 -3.043 1.00 0.00 H new ATOM 1945 N LEU A1035 3.517 -5.631 -3.268 1.00 0.00 N ATOM 1946 CA LEU A1035 3.046 -6.403 -2.126 1.00 0.00 C ATOM 1947 C LEU A1035 1.813 -7.233 -2.490 1.00 0.00 C ATOM 1948 O LEU A1035 1.722 -8.387 -2.066 1.00 0.00 O ATOM 1949 CB LEU A1035 2.751 -5.498 -0.928 1.00 0.00 C ATOM 1950 CG LEU A1035 3.966 -4.962 -0.155 1.00 0.00 C ATOM 1951 CD1 LEU A1035 5.262 -5.105 -0.942 1.00 0.00 C ATOM 1952 CD2 LEU A1035 3.733 -3.511 0.219 1.00 0.00 C ATOM 0 H LEU A1035 3.532 -4.624 -3.104 1.00 0.00 H new ATOM 0 HA LEU A1035 3.845 -7.088 -1.843 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.168 -4.647 -1.280 1.00 0.00 H new ATOM 0 HB3 LEU A1035 2.120 -6.050 -0.231 1.00 0.00 H new ATOM 0 HG LEU A1035 4.075 -5.563 0.748 1.00 0.00 H new ATOM 0 HD11 LEU A1035 6.091 -4.712 -0.353 1.00 0.00 H new ATOM 0 HD12 LEU A1035 5.440 -6.158 -1.162 1.00 0.00 H new ATOM 0 HD13 LEU A1035 5.184 -4.548 -1.876 1.00 0.00 H new ATOM 0 HD21 LEU A1035 4.596 -3.133 0.767 1.00 0.00 H new ATOM 0 HD22 LEU A1035 3.591 -2.920 -0.686 1.00 0.00 H new ATOM 0 HD23 LEU A1035 2.844 -3.435 0.845 1.00 0.00 H new ATOM 1964 N LEU A1036 0.853 -6.672 -3.245 1.00 0.00 N ATOM 1965 CA LEU A1036 -0.301 -7.484 -3.615 1.00 0.00 C ATOM 1966 C LEU A1036 0.153 -8.667 -4.480 1.00 0.00 C ATOM 1967 O LEU A1036 -0.172 -9.826 -4.217 1.00 0.00 O ATOM 1968 CB LEU A1036 -1.402 -6.637 -4.295 1.00 0.00 C ATOM 1969 CG LEU A1036 -1.086 -6.065 -5.687 1.00 0.00 C ATOM 1970 CD1 LEU A1036 -1.495 -7.039 -6.783 1.00 0.00 C ATOM 1971 CD2 LEU A1036 -1.787 -4.730 -5.886 1.00 0.00 C ATOM 0 H LEU A1036 0.854 -5.713 -3.591 1.00 0.00 H new ATOM 0 HA LEU A1036 -0.754 -7.887 -2.709 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -2.299 -7.251 -4.377 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -1.645 -5.805 -3.634 1.00 0.00 H new ATOM 0 HG LEU A1036 -0.009 -5.911 -5.750 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -1.261 -6.610 -7.757 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -0.952 -7.976 -6.659 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -2.566 -7.230 -6.719 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -1.552 -4.340 -6.876 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -2.865 -4.868 -5.796 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -1.447 -4.024 -5.128 1.00 0.00 H new ATOM 1983 N ASP A1037 0.961 -8.330 -5.484 1.00 0.00 N ATOM 1984 CA ASP A1037 1.594 -9.273 -6.395 1.00 0.00 C ATOM 1985 C ASP A1037 2.337 -10.360 -5.620 1.00 0.00 C ATOM 1986 O ASP A1037 2.348 -11.535 -5.990 1.00 0.00 O ATOM 1987 CB ASP A1037 2.588 -8.479 -7.248 1.00 0.00 C ATOM 1988 CG ASP A1037 3.044 -9.212 -8.489 1.00 0.00 C ATOM 1989 OD1 ASP A1037 2.185 -9.691 -9.257 1.00 0.00 O ATOM 1990 OD2 ASP A1037 4.271 -9.295 -8.712 1.00 0.00 O ATOM 0 H ASP A1037 1.199 -7.360 -5.690 1.00 0.00 H new ATOM 0 HA ASP A1037 0.841 -9.761 -7.014 1.00 0.00 H new ATOM 0 HB2 ASP A1037 2.128 -7.535 -7.542 1.00 0.00 H new ATOM 0 HB3 ASP A1037 3.459 -8.233 -6.641 1.00 0.00 H new ATOM 1995 N VAL A1038 2.961 -9.917 -4.532 1.00 0.00 N ATOM 1996 CA VAL A1038 3.744 -10.761 -3.642 1.00 0.00 C ATOM 1997 C VAL A1038 2.914 -11.846 -2.977 1.00 0.00 C ATOM 1998 O VAL A1038 3.316 -12.988 -3.024 1.00 0.00 O ATOM 1999 CB VAL A1038 4.483 -9.924 -2.566 1.00 0.00 C ATOM 2000 CG1 VAL A1038 4.978 -10.799 -1.422 1.00 0.00 C ATOM 2001 CG2 VAL A1038 5.656 -9.179 -3.181 1.00 0.00 C ATOM 0 H VAL A1038 2.934 -8.940 -4.241 1.00 0.00 H new ATOM 0 HA VAL A1038 4.483 -11.254 -4.274 1.00 0.00 H new ATOM 0 HB VAL A1038 3.768 -9.205 -2.166 1.00 0.00 H new ATOM 0 HG11 VAL A1038 5.491 -10.180 -0.686 1.00 0.00 H new ATOM 0 HG12 VAL A1038 4.130 -11.296 -0.950 1.00 0.00 H new ATOM 0 HG13 VAL A1038 5.668 -11.549 -1.810 1.00 0.00 H new ATOM 0 HG21 VAL A1038 6.162 -8.597 -2.410 1.00 0.00 H new ATOM 0 HG22 VAL A1038 6.355 -9.895 -3.613 1.00 0.00 H new ATOM 0 HG23 VAL A1038 5.293 -8.510 -3.961 1.00 0.00 H new ATOM 2011 N ILE A1039 1.784 -11.529 -2.362 1.00 0.00 N ATOM 2012 CA ILE A1039 1.017 -12.565 -1.669 1.00 0.00 C ATOM 2013 C ILE A1039 0.254 -13.440 -2.641 1.00 0.00 C ATOM 2014 O ILE A1039 0.033 -14.632 -2.385 1.00 0.00 O ATOM 2015 CB ILE A1039 0.101 -11.992 -0.572 1.00 0.00 C ATOM 2016 CG1 ILE A1039 0.916 -11.854 0.699 1.00 0.00 C ATOM 2017 CG2 ILE A1039 -1.128 -12.860 -0.332 1.00 0.00 C ATOM 2018 CD1 ILE A1039 1.862 -10.682 0.689 1.00 0.00 C ATOM 0 H ILE A1039 1.383 -10.592 -2.325 1.00 0.00 H new ATOM 0 HA ILE A1039 1.743 -13.199 -1.160 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.271 -11.020 -0.896 1.00 0.00 H new ATOM 0 HG12 ILE A1039 0.237 -11.754 1.546 1.00 0.00 H new ATOM 0 HG13 ILE A1039 1.487 -12.769 0.855 1.00 0.00 H new ATOM 0 HG21 ILE A1039 -1.742 -12.413 0.450 1.00 0.00 H new ATOM 0 HG22 ILE A1039 -1.708 -12.932 -1.252 1.00 0.00 H new ATOM 0 HG23 ILE A1039 -0.814 -13.857 -0.022 1.00 0.00 H new ATOM 0 HD11 ILE A1039 2.410 -10.649 1.631 1.00 0.00 H new ATOM 0 HD12 ILE A1039 2.566 -10.789 -0.137 1.00 0.00 H new ATOM 0 HD13 ILE A1039 1.296 -9.759 0.566 1.00 0.00 H new ATOM 2030 N ASP A1040 -0.111 -12.871 -3.754 1.00 0.00 N ATOM 2031 CA ASP A1040 -0.597 -13.655 -4.862 1.00 0.00 C ATOM 2032 C ASP A1040 0.431 -14.714 -5.252 1.00 0.00 C ATOM 2033 O ASP A1040 0.123 -15.902 -5.299 1.00 0.00 O ATOM 2034 CB ASP A1040 -0.919 -12.723 -6.015 1.00 0.00 C ATOM 2035 CG ASP A1040 -2.376 -12.290 -6.005 1.00 0.00 C ATOM 2036 OD1 ASP A1040 -3.237 -13.103 -6.404 1.00 0.00 O ATOM 2037 OD2 ASP A1040 -2.665 -11.154 -5.583 1.00 0.00 O ATOM 0 H ASP A1040 -0.083 -11.865 -3.922 1.00 0.00 H new ATOM 0 HA ASP A1040 -1.507 -14.185 -4.580 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -0.278 -11.843 -5.960 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -0.695 -13.222 -6.958 1.00 0.00 H new ATOM 2042 N GLN A1041 1.662 -14.308 -5.456 1.00 0.00 N ATOM 2043 CA GLN A1041 2.715 -15.255 -5.767 1.00 0.00 C ATOM 2044 C GLN A1041 3.185 -16.003 -4.518 1.00 0.00 C ATOM 2045 O GLN A1041 3.774 -17.064 -4.617 1.00 0.00 O ATOM 2046 CB GLN A1041 3.882 -14.540 -6.411 1.00 0.00 C ATOM 2047 CG GLN A1041 3.636 -14.172 -7.858 1.00 0.00 C ATOM 2048 CD GLN A1041 4.636 -13.165 -8.360 1.00 0.00 C ATOM 2049 OE1 GLN A1041 5.680 -13.514 -8.916 1.00 0.00 O ATOM 2050 NE2 GLN A1041 4.331 -11.908 -8.128 1.00 0.00 N ATOM 0 H GLN A1041 1.962 -13.334 -5.413 1.00 0.00 H new ATOM 0 HA GLN A1041 2.309 -15.988 -6.464 1.00 0.00 H new ATOM 0 HB2 GLN A1041 4.101 -13.634 -5.845 1.00 0.00 H new ATOM 0 HB3 GLN A1041 4.766 -15.175 -6.350 1.00 0.00 H new ATOM 0 HG2 GLN A1041 3.685 -15.070 -8.474 1.00 0.00 H new ATOM 0 HG3 GLN A1041 2.629 -13.767 -7.963 1.00 0.00 H new ATOM 0 HE21 GLN A1041 3.453 -11.673 -7.664 1.00 0.00 H new ATOM 0 HE22 GLN A1041 4.972 -11.167 -8.412 1.00 0.00 H new ATOM 2059 N ALA A1042 2.974 -15.413 -3.352 1.00 0.00 N ATOM 2060 CA ALA A1042 3.295 -16.033 -2.076 1.00 0.00 C ATOM 2061 C ALA A1042 2.624 -17.362 -1.942 1.00 0.00 C ATOM 2062 O ALA A1042 3.256 -18.376 -1.652 1.00 0.00 O ATOM 2063 CB ALA A1042 2.805 -15.149 -0.954 1.00 0.00 C ATOM 0 H ALA A1042 2.571 -14.480 -3.264 1.00 0.00 H new ATOM 0 HA ALA A1042 4.376 -16.166 -2.027 1.00 0.00 H new ATOM 0 HB1 ALA A1042 3.044 -15.611 0.004 1.00 0.00 H new ATOM 0 HB2 ALA A1042 3.291 -14.176 -1.019 1.00 0.00 H new ATOM 0 HB3 ALA A1042 1.726 -15.022 -1.036 1.00 0.00 H new ATOM 2069 N ARG A1043 1.328 -17.347 -2.148 1.00 0.00 N ATOM 2070 CA ARG A1043 0.551 -18.545 -2.044 1.00 0.00 C ATOM 2071 C ARG A1043 1.021 -19.521 -3.125 1.00 0.00 C ATOM 2072 O ARG A1043 1.084 -20.727 -2.911 1.00 0.00 O ATOM 2073 CB ARG A1043 -0.938 -18.206 -2.162 1.00 0.00 C ATOM 2074 CG ARG A1043 -1.389 -17.805 -3.558 1.00 0.00 C ATOM 2075 CD ARG A1043 -1.834 -19.027 -4.337 1.00 0.00 C ATOM 2076 NE ARG A1043 -2.866 -19.799 -3.642 1.00 0.00 N ATOM 2077 CZ ARG A1043 -3.741 -20.582 -4.271 1.00 0.00 C ATOM 2078 NH1 ARG A1043 -3.791 -20.581 -5.598 1.00 0.00 N ATOM 2079 NH2 ARG A1043 -4.584 -21.339 -3.581 1.00 0.00 N ATOM 0 H ARG A1043 0.794 -16.512 -2.389 1.00 0.00 H new ATOM 0 HA ARG A1043 0.690 -19.022 -1.074 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -1.520 -19.070 -1.841 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -1.167 -17.393 -1.473 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -2.208 -17.089 -3.492 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -0.573 -17.308 -4.083 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -2.214 -18.714 -5.309 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -0.972 -19.667 -4.523 1.00 0.00 H new ATOM 0 HE ARG A1043 -2.917 -19.734 -2.625 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -3.161 -19.982 -6.132 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -4.460 -21.179 -6.084 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -4.565 -21.324 -2.561 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -5.251 -21.936 -4.070 1.00 0.00 H new ATOM 2093 N LEU A1044 1.384 -18.951 -4.273 1.00 0.00 N ATOM 2094 CA LEU A1044 1.959 -19.688 -5.391 1.00 0.00 C ATOM 2095 C LEU A1044 3.242 -20.388 -4.962 1.00 0.00 C ATOM 2096 O LEU A1044 3.408 -21.593 -5.149 1.00 0.00 O ATOM 2097 CB LEU A1044 2.238 -18.683 -6.532 1.00 0.00 C ATOM 2098 CG LEU A1044 2.923 -19.199 -7.807 1.00 0.00 C ATOM 2099 CD1 LEU A1044 2.650 -18.240 -8.954 1.00 0.00 C ATOM 2100 CD2 LEU A1044 4.430 -19.334 -7.618 1.00 0.00 C ATOM 0 H LEU A1044 1.285 -17.952 -4.452 1.00 0.00 H new ATOM 0 HA LEU A1044 1.266 -20.456 -5.734 1.00 0.00 H new ATOM 0 HB2 LEU A1044 1.286 -18.238 -6.823 1.00 0.00 H new ATOM 0 HB3 LEU A1044 2.854 -17.881 -6.125 1.00 0.00 H new ATOM 0 HG LEU A1044 2.516 -20.185 -8.030 1.00 0.00 H new ATOM 0 HD11 LEU A1044 3.136 -18.606 -9.858 1.00 0.00 H new ATOM 0 HD12 LEU A1044 1.575 -18.171 -9.122 1.00 0.00 H new ATOM 0 HD13 LEU A1044 3.043 -17.254 -8.705 1.00 0.00 H new ATOM 0 HD21 LEU A1044 4.881 -19.701 -8.540 1.00 0.00 H new ATOM 0 HD22 LEU A1044 4.854 -18.361 -7.369 1.00 0.00 H new ATOM 0 HD23 LEU A1044 4.634 -20.036 -6.810 1.00 0.00 H new ATOM 2112 N LYS A1045 4.120 -19.611 -4.356 1.00 0.00 N ATOM 2113 CA LYS A1045 5.459 -20.027 -4.035 1.00 0.00 C ATOM 2114 C LYS A1045 5.458 -21.036 -2.891 1.00 0.00 C ATOM 2115 O LYS A1045 6.285 -21.921 -2.841 1.00 0.00 O ATOM 2116 CB LYS A1045 6.278 -18.763 -3.717 1.00 0.00 C ATOM 2117 CG LYS A1045 7.674 -19.010 -3.179 1.00 0.00 C ATOM 2118 CD LYS A1045 7.670 -19.110 -1.664 1.00 0.00 C ATOM 2119 CE LYS A1045 7.389 -17.767 -1.000 1.00 0.00 C ATOM 2120 NZ LYS A1045 8.294 -16.694 -1.491 1.00 0.00 N ATOM 0 H LYS A1045 3.911 -18.654 -4.070 1.00 0.00 H new ATOM 0 HA LYS A1045 5.918 -20.543 -4.878 1.00 0.00 H new ATOM 0 HB2 LYS A1045 6.357 -18.164 -4.624 1.00 0.00 H new ATOM 0 HB3 LYS A1045 5.727 -18.167 -2.989 1.00 0.00 H new ATOM 0 HG2 LYS A1045 8.073 -19.930 -3.606 1.00 0.00 H new ATOM 0 HG3 LYS A1045 8.335 -18.201 -3.491 1.00 0.00 H new ATOM 0 HD2 LYS A1045 6.917 -19.833 -1.351 1.00 0.00 H new ATOM 0 HD3 LYS A1045 8.634 -19.487 -1.324 1.00 0.00 H new ATOM 0 HE2 LYS A1045 6.354 -17.481 -1.188 1.00 0.00 H new ATOM 0 HE3 LYS A1045 7.501 -17.868 0.080 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 8.418 -15.977 -0.748 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 9.218 -17.104 -1.734 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 7.880 -16.250 -2.335 1.00 0.00 H new ATOM 2134 N MET A1046 4.527 -20.920 -1.975 1.00 0.00 N ATOM 2135 CA MET A1046 4.454 -21.888 -0.894 1.00 0.00 C ATOM 2136 C MET A1046 3.909 -23.224 -1.381 1.00 0.00 C ATOM 2137 O MET A1046 4.442 -24.277 -1.028 1.00 0.00 O ATOM 2138 CB MET A1046 3.589 -21.368 0.225 1.00 0.00 C ATOM 2139 CG MET A1046 4.089 -20.064 0.828 1.00 0.00 C ATOM 2140 SD MET A1046 5.872 -20.045 1.122 1.00 0.00 S ATOM 2141 CE MET A1046 6.092 -21.470 2.186 1.00 0.00 C ATOM 0 H MET A1046 3.821 -20.184 -1.950 1.00 0.00 H new ATOM 0 HA MET A1046 5.468 -22.042 -0.525 1.00 0.00 H new ATOM 0 HB2 MET A1046 2.576 -21.220 -0.149 1.00 0.00 H new ATOM 0 HB3 MET A1046 3.532 -22.123 1.009 1.00 0.00 H new ATOM 0 HG2 MET A1046 3.830 -19.241 0.162 1.00 0.00 H new ATOM 0 HG3 MET A1046 3.571 -19.886 1.770 1.00 0.00 H new ATOM 0 HE1 MET A1046 7.156 -21.679 2.298 1.00 0.00 H new ATOM 0 HE2 MET A1046 5.657 -21.264 3.164 1.00 0.00 H new ATOM 0 HE3 MET A1046 5.597 -22.334 1.744 1.00 0.00 H new ATOM 2151 N ILE A1047 2.847 -23.181 -2.186 1.00 0.00 N ATOM 2152 CA ILE A1047 2.319 -24.380 -2.825 1.00 0.00 C ATOM 2153 C ILE A1047 3.391 -25.024 -3.684 1.00 0.00 C ATOM 2154 O ILE A1047 3.690 -26.212 -3.538 1.00 0.00 O ATOM 2155 CB ILE A1047 1.096 -24.066 -3.721 1.00 0.00 C ATOM 2156 CG1 ILE A1047 -0.041 -23.452 -2.893 1.00 0.00 C ATOM 2157 CG2 ILE A1047 0.613 -25.329 -4.425 1.00 0.00 C ATOM 2158 CD1 ILE A1047 -0.483 -24.301 -1.717 1.00 0.00 C ATOM 0 H ILE A1047 2.337 -22.326 -2.409 1.00 0.00 H new ATOM 0 HA ILE A1047 2.005 -25.056 -2.030 1.00 0.00 H new ATOM 0 HB ILE A1047 1.403 -23.341 -4.475 1.00 0.00 H new ATOM 0 HG12 ILE A1047 0.279 -22.478 -2.523 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -0.898 -23.280 -3.545 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -0.247 -25.091 -5.051 1.00 0.00 H new ATOM 0 HG22 ILE A1047 1.414 -25.728 -5.047 1.00 0.00 H new ATOM 0 HG23 ILE A1047 0.326 -26.073 -3.682 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -1.289 -23.795 -1.186 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -0.837 -25.267 -2.078 1.00 0.00 H new ATOM 0 HD13 ILE A1047 0.358 -24.452 -1.041 1.00 0.00 H new ATOM 2170 N SER A1048 3.994 -24.240 -4.560 1.00 0.00 N ATOM 2171 CA SER A1048 5.016 -24.765 -5.436 1.00 0.00 C ATOM 2172 C SER A1048 6.169 -23.775 -5.607 1.00 0.00 C ATOM 2173 O SER A1048 6.204 -23.004 -6.565 1.00 0.00 O ATOM 2174 CB SER A1048 4.400 -25.149 -6.788 1.00 0.00 C ATOM 2175 OG SER A1048 3.436 -26.180 -6.643 1.00 0.00 O ATOM 0 H SER A1048 3.794 -23.247 -4.680 1.00 0.00 H new ATOM 0 HA SER A1048 5.435 -25.662 -4.980 1.00 0.00 H new ATOM 0 HB2 SER A1048 3.933 -24.273 -7.239 1.00 0.00 H new ATOM 0 HB3 SER A1048 5.186 -25.477 -7.468 1.00 0.00 H new ATOM 0 HG SER A1048 3.060 -26.402 -7.520 1.00 0.00 H new ATOM 2181 N GLN A1049 7.062 -23.741 -4.615 1.00 0.00 N ATOM 2182 CA GLN A1049 8.347 -23.048 -4.771 1.00 0.00 C ATOM 2183 C GLN A1049 9.348 -23.948 -5.487 1.00 0.00 C ATOM 2184 O GLN A1049 10.128 -23.479 -6.316 1.00 0.00 O ATOM 2185 CB GLN A1049 8.919 -22.619 -3.407 1.00 0.00 C ATOM 2186 CG GLN A1049 9.996 -21.535 -3.479 1.00 0.00 C ATOM 2187 CD GLN A1049 11.369 -22.059 -3.862 1.00 0.00 C ATOM 2188 OE1 GLN A1049 11.728 -23.195 -3.548 1.00 0.00 O ATOM 2189 NE2 GLN A1049 12.152 -21.229 -4.532 1.00 0.00 N ATOM 0 H GLN A1049 6.924 -24.179 -3.704 1.00 0.00 H new ATOM 0 HA GLN A1049 8.172 -22.153 -5.368 1.00 0.00 H new ATOM 0 HB2 GLN A1049 8.102 -22.259 -2.782 1.00 0.00 H new ATOM 0 HB3 GLN A1049 9.337 -23.495 -2.912 1.00 0.00 H new ATOM 0 HG2 GLN A1049 9.691 -20.780 -4.204 1.00 0.00 H new ATOM 0 HG3 GLN A1049 10.064 -21.039 -2.511 1.00 0.00 H new ATOM 0 HE21 GLN A1049 11.818 -20.296 -4.773 1.00 0.00 H new ATOM 0 HE22 GLN A1049 13.089 -21.522 -4.807 1.00 0.00 H new ATOM 2198 N SER A1050 9.313 -25.237 -5.165 1.00 0.00 N ATOM 2199 CA SER A1050 10.257 -26.200 -5.722 1.00 0.00 C ATOM 2200 C SER A1050 10.145 -26.248 -7.246 1.00 0.00 C ATOM 2201 O SER A1050 11.148 -26.334 -7.955 1.00 0.00 O ATOM 2202 CB SER A1050 10.008 -27.583 -5.116 1.00 0.00 C ATOM 2203 OG SER A1050 11.029 -28.494 -5.478 1.00 0.00 O ATOM 0 H SER A1050 8.637 -25.641 -4.517 1.00 0.00 H new ATOM 0 HA SER A1050 11.270 -25.885 -5.471 1.00 0.00 H new ATOM 0 HB2 SER A1050 9.957 -27.503 -4.030 1.00 0.00 H new ATOM 0 HB3 SER A1050 9.043 -27.962 -5.453 1.00 0.00 H new ATOM 0 HG SER A1050 10.845 -29.368 -5.076 1.00 0.00 H new ATOM 2209 N ARG A1051 8.920 -26.185 -7.734 1.00 0.00 N ATOM 2210 CA ARG A1051 8.658 -26.087 -9.159 1.00 0.00 C ATOM 2211 C ARG A1051 7.749 -24.892 -9.381 1.00 0.00 C ATOM 2212 O ARG A1051 6.852 -24.662 -8.578 1.00 0.00 O ATOM 2213 CB ARG A1051 8.004 -27.371 -9.680 1.00 0.00 C ATOM 2214 CG ARG A1051 6.653 -27.671 -9.050 1.00 0.00 C ATOM 2215 CD ARG A1051 6.070 -28.962 -9.584 1.00 0.00 C ATOM 2216 NE ARG A1051 5.997 -28.960 -11.041 1.00 0.00 N ATOM 2217 CZ ARG A1051 6.351 -29.996 -11.799 1.00 0.00 C ATOM 2218 NH1 ARG A1051 6.817 -31.102 -11.228 1.00 0.00 N ATOM 2219 NH2 ARG A1051 6.256 -29.916 -13.123 1.00 0.00 N ATOM 0 H ARG A1051 8.080 -26.200 -7.156 1.00 0.00 H new ATOM 0 HA ARG A1051 9.592 -25.957 -9.706 1.00 0.00 H new ATOM 0 HB2 ARG A1051 7.881 -27.293 -10.760 1.00 0.00 H new ATOM 0 HB3 ARG A1051 8.675 -28.210 -9.495 1.00 0.00 H new ATOM 0 HG2 ARG A1051 6.762 -27.739 -7.968 1.00 0.00 H new ATOM 0 HG3 ARG A1051 5.966 -26.849 -9.250 1.00 0.00 H new ATOM 0 HD2 ARG A1051 6.680 -29.802 -9.252 1.00 0.00 H new ATOM 0 HD3 ARG A1051 5.073 -29.109 -9.170 1.00 0.00 H new ATOM 0 HE ARG A1051 5.656 -28.118 -11.505 1.00 0.00 H new ATOM 0 HH11 ARG A1051 6.902 -31.155 -10.213 1.00 0.00 H new ATOM 0 HH12 ARG A1051 7.089 -31.898 -11.805 1.00 0.00 H new ATOM 0 HH21 ARG A1051 5.912 -29.060 -13.559 1.00 0.00 H new ATOM 0 HH22 ARG A1051 6.527 -30.710 -13.703 1.00 0.00 H new ATOM 2233 N PRO A1052 7.966 -24.098 -10.436 1.00 0.00 N ATOM 2234 CA PRO A1052 7.225 -22.851 -10.623 1.00 0.00 C ATOM 2235 C PRO A1052 5.724 -23.094 -10.763 1.00 0.00 C ATOM 2236 O PRO A1052 5.261 -23.658 -11.758 1.00 0.00 O ATOM 2237 CB PRO A1052 7.819 -22.247 -11.901 1.00 0.00 C ATOM 2238 CG PRO A1052 9.105 -22.975 -12.120 1.00 0.00 C ATOM 2239 CD PRO A1052 8.926 -24.341 -11.520 1.00 0.00 C ATOM 0 HA PRO A1052 7.321 -22.186 -9.765 1.00 0.00 H new ATOM 0 HB2 PRO A1052 7.145 -22.376 -12.748 1.00 0.00 H new ATOM 0 HB3 PRO A1052 7.987 -21.176 -11.788 1.00 0.00 H new ATOM 0 HG2 PRO A1052 9.336 -23.045 -13.183 1.00 0.00 H new ATOM 0 HG3 PRO A1052 9.935 -22.449 -11.648 1.00 0.00 H new ATOM 0 HD2 PRO A1052 8.541 -25.055 -12.248 1.00 0.00 H new ATOM 0 HD3 PRO A1052 9.867 -24.744 -11.144 1.00 0.00 H new ATOM 2247 N HIS A1053 4.986 -22.699 -9.732 1.00 0.00 N ATOM 2248 CA HIS A1053 3.541 -22.887 -9.679 1.00 0.00 C ATOM 2249 C HIS A1053 2.855 -22.044 -10.747 1.00 0.00 C ATOM 2250 CB HIS A1053 3.026 -22.507 -8.287 1.00 0.00 C ATOM 2251 CG HIS A1053 1.619 -22.940 -7.991 1.00 0.00 C ATOM 2252 ND1 HIS A1053 0.871 -23.732 -8.833 1.00 0.00 N ATOM 2253 CD2 HIS A1053 0.828 -22.689 -6.917 1.00 0.00 C ATOM 2254 CE1 HIS A1053 -0.315 -23.945 -8.298 1.00 0.00 C ATOM 2255 NE2 HIS A1053 -0.370 -23.325 -7.134 1.00 0.00 N ATOM 0 H HIS A1053 5.373 -22.239 -8.908 1.00 0.00 H new ATOM 0 HA HIS A1053 3.310 -23.935 -9.872 1.00 0.00 H new ATOM 0 HB2 HIS A1053 3.689 -22.942 -7.539 1.00 0.00 H new ATOM 0 HB3 HIS A1053 3.088 -21.424 -8.176 1.00 0.00 H new ATOM 0 HD2 HIS A1053 1.092 -22.099 -6.052 1.00 0.00 H new ATOM 0 HE1 HIS A1053 -1.109 -24.529 -8.739 1.00 0.00 H new ATOM 0 HE2 HIS A1053 -1.170 -23.319 -6.501 1.00 0.00 H new TER 2264 HIS A1053