USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1101 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 986 MET CE :methyl -145:sc= -0.357 (180deg=-1.19) USER MOD Set 1.2: A1034 ASN : amide:sc= -1.95! K(o=-2.3!,f=-0.36) USER MOD Set 2.1: A1006 GLN : amide:sc= -0.318 X(o=-1.5,f=-1.9!) USER MOD Set 2.2: A1007 GLN : amide:sc= -1.19! K(o=-1.5!,f=-0.5) USER MOD Set 3.1: A 954 MET CE :methyl -159:sc= -1.58 (180deg=-2.96!) USER MOD Set 3.2: A1002 MET CE :methyl -153:sc= -2.21 (180deg=-2.59!) USER MOD Set 3.3: A1021 MET CE :methyl 147:sc= -1.96 (180deg=-0.77) USER MOD Set 4.1: A 988 GLN : amide:sc= -0.0729 K(o=0.41,f=-6.7!) USER MOD Set 4.2: A 989 LYS NZ :NH3+ -173:sc= 0.481 (180deg=0) USER MOD Set 5.1: A 939 MET CE :methyl -155:sc= -1.16 (180deg=-2.79) USER MOD Set 5.2: A 940 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 928 ASN : amide:sc= 0.456 K(o=1.9,f=-1.7!) USER MOD Set 6.2: A 964 THR OG1 : rot 8:sc= 1.41 USER MOD Single : A 921 SER OG : rot -27:sc= 0.862 USER MOD Single : A 922 ASN : amide:sc= 1.04 K(o=1,f=-0.16) USER MOD Single : A 924 LYS NZ :NH3+ 169:sc= -0.0667 (180deg=-0.36) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 89:sc= 1.26 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 941 SER OG : rot 69:sc= 0.979 USER MOD Single : A 942 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0768) USER MOD Single : A 944 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 951 TYR OH : rot -107:sc= -2.35! USER MOD Single : A 956 LYS NZ :NH3+ 169:sc= 1.16 (180deg=0.853) USER MOD Single : A 968 THR OG1 : rot -119:sc= 0.665 USER MOD Single : A 972 SER OG : rot -70:sc= -3.76! USER MOD Single : A 979 SER OG : rot 23:sc= 1.24 USER MOD Single : A 980 THR OG1 : rot -21:sc= -0.837 USER MOD Single : A 981 HIS : no HE2:sc= 1.04 K(o=1,f=-3.5!) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 993 SER OG : rot 77:sc= 1.19 USER MOD Single : A1000 ASN : amide:sc= 0.648 K(o=0.65,f=-0.46) USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 USER MOD Single : A1014 GLN : amide:sc= -4.12! C(o=-4.1!,f=-4.3!) USER MOD Single : A1015 GLN : amide:sc= -1 K(o=-1,f=0.018) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1018 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1019 LYS NZ :NH3+ -164:sc= -0.0194 (180deg=-0.24) USER MOD Single : A1020 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A1023 THR OG1 : rot 81:sc= 0.209 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=-0.00055) USER MOD Single : A1033 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1041 GLN : amide:sc= -0.172 K(o=-0.17,f=-2.3) USER MOD Single : A1045 LYS NZ :NH3+ 147:sc= 0.00596 (180deg=0) USER MOD Single : A1046 MET CE :methyl -147:sc= -0.377 (180deg=-1.32!) USER MOD Single : A1048 SER OG : rot 71:sc= 1.26 USER MOD Single : A1049 GLN : amide:sc= -1.05 X(o=-1,f=-0.72) USER MOD Single : A1050 SER OG : rot -49:sc= 0.159 USER MOD Single : A1053 HIS : no HD1:sc= 0 X(o=0,f=-0.0039) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 920 -7.572 -19.707 -0.482 1.00 0.00 N ATOM 2 CA ARG A 920 -7.174 -18.317 -0.596 1.00 0.00 C ATOM 3 C ARG A 920 -8.234 -17.359 -0.044 1.00 0.00 C ATOM 4 O ARG A 920 -8.015 -16.728 0.992 1.00 0.00 O ATOM 5 CB ARG A 920 -6.875 -18.030 -2.057 1.00 0.00 C ATOM 6 CG ARG A 920 -6.746 -16.567 -2.391 1.00 0.00 C ATOM 7 CD ARG A 920 -5.791 -16.394 -3.538 1.00 0.00 C ATOM 8 NE ARG A 920 -6.157 -15.282 -4.406 1.00 0.00 N ATOM 9 CZ ARG A 920 -6.494 -15.398 -5.690 1.00 0.00 C ATOM 10 NH1 ARG A 920 -6.616 -16.594 -6.258 1.00 0.00 N ATOM 11 NH2 ARG A 920 -6.740 -14.310 -6.404 1.00 0.00 N ATOM 0 HA ARG A 920 -6.283 -18.150 0.010 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -5.949 -18.536 -2.332 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -7.667 -18.461 -2.669 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -7.721 -16.156 -2.651 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -6.389 -16.015 -1.521 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -4.786 -16.231 -3.148 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -5.761 -17.313 -4.123 1.00 0.00 H new ATOM 0 HE ARG A 920 -6.155 -14.346 -4.001 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -6.451 -17.438 -5.710 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -6.875 -16.667 -7.242 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -6.671 -13.389 -5.971 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -6.998 -14.393 -7.387 1.00 0.00 H new ATOM 25 N SER A 921 -9.366 -17.241 -0.744 1.00 0.00 N ATOM 26 CA SER A 921 -10.482 -16.395 -0.309 1.00 0.00 C ATOM 27 C SER A 921 -10.081 -14.919 -0.243 1.00 0.00 C ATOM 28 O SER A 921 -10.844 -14.085 0.251 1.00 0.00 O ATOM 29 CB SER A 921 -10.995 -16.871 1.054 1.00 0.00 C ATOM 30 OG SER A 921 -12.093 -16.093 1.507 1.00 0.00 O ATOM 0 H SER A 921 -9.535 -17.727 -1.625 1.00 0.00 H new ATOM 0 HA SER A 921 -11.280 -16.484 -1.046 1.00 0.00 H new ATOM 0 HB2 SER A 921 -11.295 -17.917 0.984 1.00 0.00 H new ATOM 0 HB3 SER A 921 -10.187 -16.819 1.784 1.00 0.00 H new ATOM 0 HG SER A 921 -12.043 -15.196 1.115 1.00 0.00 H new ATOM 36 N ASN A 922 -8.898 -14.611 -0.779 1.00 0.00 N ATOM 37 CA ASN A 922 -8.318 -13.266 -0.733 1.00 0.00 C ATOM 38 C ASN A 922 -8.432 -12.683 0.642 1.00 0.00 C ATOM 39 O ASN A 922 -8.889 -11.550 0.797 1.00 0.00 O ATOM 40 CB ASN A 922 -8.982 -12.306 -1.714 1.00 0.00 C ATOM 41 CG ASN A 922 -9.788 -13.012 -2.785 1.00 0.00 C ATOM 42 OD1 ASN A 922 -11.016 -13.115 -2.709 1.00 0.00 O ATOM 43 ND2 ASN A 922 -9.091 -13.536 -3.770 1.00 0.00 N ATOM 0 H ASN A 922 -8.311 -15.292 -1.261 1.00 0.00 H new ATOM 0 HA ASN A 922 -7.271 -13.383 -1.014 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -9.635 -11.628 -1.164 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -8.215 -11.694 -2.189 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -9.564 -14.052 -4.511 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -8.077 -13.426 -3.792 1.00 0.00 H new ATOM 50 N ASP A 923 -7.949 -13.461 1.598 1.00 0.00 N ATOM 51 CA ASP A 923 -7.971 -13.149 3.028 1.00 0.00 C ATOM 52 C ASP A 923 -7.531 -11.708 3.313 1.00 0.00 C ATOM 53 O ASP A 923 -7.326 -10.907 2.412 1.00 0.00 O ATOM 54 CB ASP A 923 -7.050 -14.144 3.752 1.00 0.00 C ATOM 55 CG ASP A 923 -7.291 -14.225 5.248 1.00 0.00 C ATOM 56 OD1 ASP A 923 -8.151 -15.026 5.668 1.00 0.00 O ATOM 57 OD2 ASP A 923 -6.610 -13.509 6.005 1.00 0.00 O ATOM 0 H ASP A 923 -7.514 -14.361 1.397 1.00 0.00 H new ATOM 0 HA ASP A 923 -8.995 -13.239 3.391 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -7.187 -15.134 3.317 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -6.013 -13.859 3.575 1.00 0.00 H new ATOM 62 N LYS A 924 -7.405 -11.382 4.579 1.00 0.00 N ATOM 63 CA LYS A 924 -7.026 -10.038 5.037 1.00 0.00 C ATOM 64 C LYS A 924 -5.848 -9.468 4.221 1.00 0.00 C ATOM 65 O LYS A 924 -5.567 -8.268 4.267 1.00 0.00 O ATOM 66 CB LYS A 924 -6.682 -10.099 6.531 1.00 0.00 C ATOM 67 CG LYS A 924 -7.154 -8.893 7.333 1.00 0.00 C ATOM 68 CD LYS A 924 -6.109 -7.793 7.377 1.00 0.00 C ATOM 69 CE LYS A 924 -6.585 -6.590 8.180 1.00 0.00 C ATOM 70 NZ LYS A 924 -7.075 -6.973 9.532 1.00 0.00 N ATOM 0 H LYS A 924 -7.562 -12.042 5.341 1.00 0.00 H new ATOM 0 HA LYS A 924 -7.868 -9.363 4.884 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -7.124 -11.000 6.957 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -5.601 -10.192 6.640 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -8.072 -8.503 6.894 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -7.394 -9.205 8.349 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -5.190 -8.182 7.816 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -5.869 -7.479 6.361 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -5.767 -5.876 8.281 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -7.383 -6.085 7.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -7.212 -6.117 10.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -7.979 -7.479 9.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -6.376 -7.591 9.992 1.00 0.00 H new ATOM 84 N VAL A 925 -5.181 -10.341 3.468 1.00 0.00 N ATOM 85 CA VAL A 925 -4.174 -9.941 2.516 1.00 0.00 C ATOM 86 C VAL A 925 -4.752 -9.070 1.395 1.00 0.00 C ATOM 87 O VAL A 925 -4.288 -7.951 1.210 1.00 0.00 O ATOM 88 CB VAL A 925 -3.459 -11.169 1.914 1.00 0.00 C ATOM 89 CG1 VAL A 925 -2.530 -11.800 2.941 1.00 0.00 C ATOM 90 CG2 VAL A 925 -4.465 -12.199 1.412 1.00 0.00 C ATOM 0 H VAL A 925 -5.333 -11.349 3.510 1.00 0.00 H new ATOM 0 HA VAL A 925 -3.447 -9.341 3.064 1.00 0.00 H new ATOM 0 HB VAL A 925 -2.867 -10.829 1.064 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -2.034 -12.665 2.500 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -1.781 -11.071 3.251 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -3.109 -12.117 3.809 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -3.933 -13.053 0.993 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -5.090 -12.532 2.241 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -5.093 -11.750 0.642 1.00 0.00 H new ATOM 100 N TYR A 926 -5.809 -9.516 0.698 1.00 0.00 N ATOM 101 CA TYR A 926 -6.355 -8.708 -0.388 1.00 0.00 C ATOM 102 C TYR A 926 -7.191 -7.586 0.216 1.00 0.00 C ATOM 103 O TYR A 926 -7.331 -6.502 -0.355 1.00 0.00 O ATOM 104 CB TYR A 926 -7.206 -9.564 -1.325 1.00 0.00 C ATOM 105 CG TYR A 926 -7.921 -8.768 -2.393 1.00 0.00 C ATOM 106 CD1 TYR A 926 -7.214 -8.109 -3.387 1.00 0.00 C ATOM 107 CD2 TYR A 926 -9.306 -8.667 -2.394 1.00 0.00 C ATOM 108 CE1 TYR A 926 -7.864 -7.370 -4.357 1.00 0.00 C ATOM 109 CE2 TYR A 926 -9.967 -7.933 -3.362 1.00 0.00 C ATOM 110 CZ TYR A 926 -9.242 -7.283 -4.340 1.00 0.00 C ATOM 111 OH TYR A 926 -9.894 -6.544 -5.309 1.00 0.00 O ATOM 0 H TYR A 926 -6.285 -10.403 0.863 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.539 -8.287 -0.976 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -6.568 -10.307 -1.804 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -7.943 -10.109 -0.736 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -6.136 -8.174 -3.403 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -9.876 -9.170 -1.627 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -7.297 -6.863 -5.124 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -11.045 -7.869 -3.353 1.00 0.00 H new ATOM 0 HH TYR A 926 -10.861 -6.585 -5.156 1.00 0.00 H new ATOM 121 N GLU A 927 -7.733 -7.874 1.391 1.00 0.00 N ATOM 122 CA GLU A 927 -8.587 -6.947 2.111 1.00 0.00 C ATOM 123 C GLU A 927 -7.849 -5.668 2.502 1.00 0.00 C ATOM 124 O GLU A 927 -8.153 -4.589 1.990 1.00 0.00 O ATOM 125 CB GLU A 927 -9.149 -7.630 3.356 1.00 0.00 C ATOM 126 CG GLU A 927 -10.189 -8.693 3.053 1.00 0.00 C ATOM 127 CD GLU A 927 -10.763 -9.310 4.309 1.00 0.00 C ATOM 128 OE1 GLU A 927 -11.496 -8.607 5.041 1.00 0.00 O ATOM 129 OE2 GLU A 927 -10.476 -10.488 4.584 1.00 0.00 O ATOM 0 H GLU A 927 -7.590 -8.762 1.872 1.00 0.00 H new ATOM 0 HA GLU A 927 -9.401 -6.659 1.446 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -8.329 -8.085 3.911 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -9.593 -6.875 4.005 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -10.995 -8.252 2.466 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -9.739 -9.474 2.440 1.00 0.00 H new ATOM 136 N ASN A 928 -6.868 -5.791 3.391 1.00 0.00 N ATOM 137 CA ASN A 928 -6.214 -4.617 3.958 1.00 0.00 C ATOM 138 C ASN A 928 -5.425 -3.860 2.900 1.00 0.00 C ATOM 139 O ASN A 928 -5.353 -2.638 2.941 1.00 0.00 O ATOM 140 CB ASN A 928 -5.276 -4.995 5.102 1.00 0.00 C ATOM 141 CG ASN A 928 -4.994 -3.812 6.012 1.00 0.00 C ATOM 142 OD1 ASN A 928 -5.653 -3.636 7.035 1.00 0.00 O ATOM 143 ND2 ASN A 928 -4.040 -2.975 5.635 1.00 0.00 N ATOM 0 H ASN A 928 -6.511 -6.684 3.732 1.00 0.00 H new ATOM 0 HA ASN A 928 -7.005 -3.975 4.345 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.719 -5.804 5.683 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -4.338 -5.372 4.694 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -3.831 -2.152 6.200 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -3.514 -3.153 4.780 1.00 0.00 H new ATOM 150 N VAL A 929 -4.814 -4.587 1.968 1.00 0.00 N ATOM 151 CA VAL A 929 -4.036 -3.951 0.909 1.00 0.00 C ATOM 152 C VAL A 929 -4.915 -3.038 0.041 1.00 0.00 C ATOM 153 O VAL A 929 -4.504 -1.936 -0.341 1.00 0.00 O ATOM 154 CB VAL A 929 -3.304 -4.990 0.041 1.00 0.00 C ATOM 155 CG1 VAL A 929 -4.285 -5.812 -0.767 1.00 0.00 C ATOM 156 CG2 VAL A 929 -2.284 -4.308 -0.854 1.00 0.00 C ATOM 0 H VAL A 929 -4.842 -5.606 1.924 1.00 0.00 H new ATOM 0 HA VAL A 929 -3.281 -3.332 1.393 1.00 0.00 H new ATOM 0 HB VAL A 929 -2.771 -5.675 0.700 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -3.741 -6.538 -1.371 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -4.963 -6.336 -0.093 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -4.859 -5.155 -1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -1.775 -5.056 -1.461 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -2.790 -3.595 -1.505 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -1.554 -3.782 -0.239 1.00 0.00 H new ATOM 166 N THR A 930 -6.137 -3.478 -0.245 1.00 0.00 N ATOM 167 CA THR A 930 -7.101 -2.626 -0.921 1.00 0.00 C ATOM 168 C THR A 930 -7.461 -1.473 0.009 1.00 0.00 C ATOM 169 O THR A 930 -7.700 -0.345 -0.424 1.00 0.00 O ATOM 170 CB THR A 930 -8.367 -3.417 -1.314 1.00 0.00 C ATOM 171 OG1 THR A 930 -8.003 -4.544 -2.120 1.00 0.00 O ATOM 172 CG2 THR A 930 -9.344 -2.541 -2.081 1.00 0.00 C ATOM 0 H THR A 930 -6.478 -4.413 -0.020 1.00 0.00 H new ATOM 0 HA THR A 930 -6.660 -2.242 -1.841 1.00 0.00 H new ATOM 0 HB THR A 930 -8.853 -3.757 -0.399 1.00 0.00 H new ATOM 0 HG1 THR A 930 -7.823 -5.315 -1.542 1.00 0.00 H new ATOM 0 HG21 THR A 930 -10.226 -3.124 -2.345 1.00 0.00 H new ATOM 0 HG22 THR A 930 -9.640 -1.696 -1.459 1.00 0.00 H new ATOM 0 HG23 THR A 930 -8.867 -2.173 -2.990 1.00 0.00 H new ATOM 180 N GLY A 931 -7.462 -1.785 1.300 1.00 0.00 N ATOM 181 CA GLY A 931 -7.633 -0.782 2.329 1.00 0.00 C ATOM 182 C GLY A 931 -6.590 0.321 2.254 1.00 0.00 C ATOM 183 O GLY A 931 -6.877 1.455 2.619 1.00 0.00 O ATOM 0 H GLY A 931 -7.345 -2.734 1.655 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.627 -0.343 2.241 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -7.581 -1.259 3.308 1.00 0.00 H new ATOM 187 N LEU A 932 -5.381 0.009 1.773 1.00 0.00 N ATOM 188 CA LEU A 932 -4.372 1.046 1.550 1.00 0.00 C ATOM 189 C LEU A 932 -4.866 2.019 0.498 1.00 0.00 C ATOM 190 O LEU A 932 -4.766 3.231 0.664 1.00 0.00 O ATOM 191 CB LEU A 932 -3.023 0.476 1.096 1.00 0.00 C ATOM 192 CG LEU A 932 -2.126 -0.102 2.189 1.00 0.00 C ATOM 193 CD1 LEU A 932 -2.577 -1.492 2.571 1.00 0.00 C ATOM 194 CD2 LEU A 932 -0.682 -0.103 1.721 1.00 0.00 C ATOM 0 H LEU A 932 -5.082 -0.937 1.535 1.00 0.00 H new ATOM 0 HA LEU A 932 -4.218 1.546 2.506 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -3.213 -0.306 0.361 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -2.473 1.266 0.585 1.00 0.00 H new ATOM 0 HG LEU A 932 -2.202 0.524 3.078 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -1.924 -1.885 3.351 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -3.602 -1.453 2.941 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -2.531 -2.142 1.698 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -0.046 -0.516 2.504 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -0.592 -0.712 0.821 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -0.370 0.918 1.501 1.00 0.00 H new ATOM 206 N VAL A 933 -5.401 1.477 -0.586 1.00 0.00 N ATOM 207 CA VAL A 933 -5.966 2.306 -1.643 1.00 0.00 C ATOM 208 C VAL A 933 -7.163 3.109 -1.119 1.00 0.00 C ATOM 209 O VAL A 933 -7.369 4.259 -1.494 1.00 0.00 O ATOM 210 CB VAL A 933 -6.386 1.460 -2.866 1.00 0.00 C ATOM 211 CG1 VAL A 933 -6.941 2.344 -3.974 1.00 0.00 C ATOM 212 CG2 VAL A 933 -5.206 0.644 -3.376 1.00 0.00 C ATOM 0 H VAL A 933 -5.456 0.473 -0.757 1.00 0.00 H new ATOM 0 HA VAL A 933 -5.189 2.999 -1.965 1.00 0.00 H new ATOM 0 HB VAL A 933 -7.174 0.776 -2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -7.229 1.725 -4.823 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -7.813 2.884 -3.606 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -6.178 3.057 -4.287 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -5.517 0.053 -4.238 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -4.399 1.315 -3.669 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -4.856 -0.022 -2.587 1.00 0.00 H new ATOM 222 N LYS A 934 -7.952 2.496 -0.251 1.00 0.00 N ATOM 223 CA LYS A 934 -9.067 3.189 0.388 1.00 0.00 C ATOM 224 C LYS A 934 -8.548 4.257 1.352 1.00 0.00 C ATOM 225 O LYS A 934 -9.173 5.296 1.547 1.00 0.00 O ATOM 226 CB LYS A 934 -9.966 2.202 1.143 1.00 0.00 C ATOM 227 CG LYS A 934 -10.388 0.960 0.353 1.00 0.00 C ATOM 228 CD LYS A 934 -11.260 1.274 -0.860 1.00 0.00 C ATOM 229 CE LYS A 934 -10.429 1.640 -2.082 1.00 0.00 C ATOM 230 NZ LYS A 934 -11.248 1.709 -3.320 1.00 0.00 N ATOM 0 H LYS A 934 -7.844 1.521 0.029 1.00 0.00 H new ATOM 0 HA LYS A 934 -9.657 3.668 -0.394 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -9.445 1.879 2.044 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -10.864 2.729 1.466 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -9.495 0.430 0.021 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -10.931 0.286 1.015 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -11.883 0.410 -1.091 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -11.933 2.097 -0.619 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -9.945 2.602 -1.915 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -9.636 0.903 -2.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -10.640 1.961 -4.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -11.690 0.784 -3.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -11.989 2.430 -3.207 1.00 0.00 H new ATOM 244 N ALA A 935 -7.393 3.996 1.945 1.00 0.00 N ATOM 245 CA ALA A 935 -6.772 4.934 2.870 1.00 0.00 C ATOM 246 C ALA A 935 -6.095 6.075 2.124 1.00 0.00 C ATOM 247 O ALA A 935 -5.910 7.158 2.667 1.00 0.00 O ATOM 248 CB ALA A 935 -5.785 4.223 3.773 1.00 0.00 C ATOM 0 H ALA A 935 -6.863 3.136 1.801 1.00 0.00 H new ATOM 0 HA ALA A 935 -7.559 5.361 3.492 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.333 4.942 4.456 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -6.304 3.455 4.347 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -5.007 3.759 3.167 1.00 0.00 H new ATOM 254 N VAL A 936 -5.700 5.842 0.883 1.00 0.00 N ATOM 255 CA VAL A 936 -5.194 6.933 0.073 1.00 0.00 C ATOM 256 C VAL A 936 -6.370 7.716 -0.514 1.00 0.00 C ATOM 257 O VAL A 936 -6.202 8.780 -1.109 1.00 0.00 O ATOM 258 CB VAL A 936 -4.193 6.466 -1.015 1.00 0.00 C ATOM 259 CG1 VAL A 936 -4.870 5.656 -2.106 1.00 0.00 C ATOM 260 CG2 VAL A 936 -3.444 7.647 -1.615 1.00 0.00 C ATOM 0 H VAL A 936 -5.719 4.931 0.425 1.00 0.00 H new ATOM 0 HA VAL A 936 -4.617 7.596 0.717 1.00 0.00 H new ATOM 0 HB VAL A 936 -3.473 5.813 -0.521 1.00 0.00 H new ATOM 0 HG11 VAL A 936 -4.129 5.351 -2.845 1.00 0.00 H new ATOM 0 HG12 VAL A 936 -5.332 4.771 -1.669 1.00 0.00 H new ATOM 0 HG13 VAL A 936 -5.635 6.264 -2.589 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -2.749 7.289 -2.375 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -4.156 8.336 -2.070 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.890 8.163 -0.831 1.00 0.00 H new ATOM 270 N ILE A 937 -7.575 7.190 -0.302 1.00 0.00 N ATOM 271 CA ILE A 937 -8.788 7.960 -0.526 1.00 0.00 C ATOM 272 C ILE A 937 -8.964 8.945 0.631 1.00 0.00 C ATOM 273 O ILE A 937 -9.468 10.057 0.452 1.00 0.00 O ATOM 274 CB ILE A 937 -10.045 7.066 -0.660 1.00 0.00 C ATOM 275 CG1 ILE A 937 -9.904 6.131 -1.863 1.00 0.00 C ATOM 276 CG2 ILE A 937 -11.300 7.922 -0.798 1.00 0.00 C ATOM 277 CD1 ILE A 937 -11.090 5.213 -2.064 1.00 0.00 C ATOM 0 H ILE A 937 -7.733 6.236 0.024 1.00 0.00 H new ATOM 0 HA ILE A 937 -8.682 8.491 -1.472 1.00 0.00 H new ATOM 0 HB ILE A 937 -10.138 6.463 0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -9.763 6.730 -2.763 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -9.005 5.527 -1.739 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -12.173 7.276 -0.891 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -11.408 8.554 0.084 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -11.217 8.549 -1.686 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -10.917 4.581 -2.935 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -11.219 4.587 -1.181 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -11.989 5.809 -2.221 1.00 0.00 H new ATOM 289 N GLU A 938 -8.541 8.521 1.829 1.00 0.00 N ATOM 290 CA GLU A 938 -8.421 9.429 2.971 1.00 0.00 C ATOM 291 C GLU A 938 -7.575 10.624 2.585 1.00 0.00 C ATOM 292 O GLU A 938 -7.893 11.755 2.929 1.00 0.00 O ATOM 293 CB GLU A 938 -7.781 8.741 4.180 1.00 0.00 C ATOM 294 CG GLU A 938 -8.594 7.580 4.728 1.00 0.00 C ATOM 295 CD GLU A 938 -9.984 7.998 5.158 1.00 0.00 C ATOM 296 OE1 GLU A 938 -10.129 8.530 6.277 1.00 0.00 O ATOM 297 OE2 GLU A 938 -10.937 7.794 4.376 1.00 0.00 O ATOM 0 H GLU A 938 -8.277 7.556 2.030 1.00 0.00 H new ATOM 0 HA GLU A 938 -9.427 9.744 3.247 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.792 8.379 3.899 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.638 9.477 4.971 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -8.671 6.803 3.967 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -8.070 7.143 5.578 1.00 0.00 H new ATOM 304 N MET A 939 -6.512 10.351 1.838 1.00 0.00 N ATOM 305 CA MET A 939 -5.629 11.395 1.337 1.00 0.00 C ATOM 306 C MET A 939 -6.422 12.386 0.494 1.00 0.00 C ATOM 307 O MET A 939 -6.337 13.595 0.696 1.00 0.00 O ATOM 308 CB MET A 939 -4.495 10.749 0.520 1.00 0.00 C ATOM 309 CG MET A 939 -3.543 11.729 -0.154 1.00 0.00 C ATOM 310 SD MET A 939 -4.186 12.416 -1.696 1.00 0.00 S ATOM 311 CE MET A 939 -4.295 10.946 -2.714 1.00 0.00 C ATOM 0 H MET A 939 -6.240 9.407 1.565 1.00 0.00 H new ATOM 0 HA MET A 939 -5.189 11.943 2.171 1.00 0.00 H new ATOM 0 HB2 MET A 939 -3.917 10.101 1.179 1.00 0.00 H new ATOM 0 HB3 MET A 939 -4.938 10.112 -0.246 1.00 0.00 H new ATOM 0 HG2 MET A 939 -3.327 12.545 0.535 1.00 0.00 H new ATOM 0 HG3 MET A 939 -2.598 11.224 -0.357 1.00 0.00 H new ATOM 0 HE1 MET A 939 -4.238 11.227 -3.766 1.00 0.00 H new ATOM 0 HE2 MET A 939 -3.471 10.274 -2.472 1.00 0.00 H new ATOM 0 HE3 MET A 939 -5.242 10.441 -2.524 1.00 0.00 H new ATOM 321 N SER A 940 -7.245 11.864 -0.405 1.00 0.00 N ATOM 322 CA SER A 940 -8.072 12.699 -1.259 1.00 0.00 C ATOM 323 C SER A 940 -9.089 13.496 -0.437 1.00 0.00 C ATOM 324 O SER A 940 -9.415 14.639 -0.771 1.00 0.00 O ATOM 325 CB SER A 940 -8.791 11.835 -2.299 1.00 0.00 C ATOM 326 OG SER A 940 -7.860 11.105 -3.082 1.00 0.00 O ATOM 0 H SER A 940 -7.356 10.862 -0.561 1.00 0.00 H new ATOM 0 HA SER A 940 -7.423 13.410 -1.771 1.00 0.00 H new ATOM 0 HB2 SER A 940 -9.470 11.145 -1.798 1.00 0.00 H new ATOM 0 HB3 SER A 940 -9.399 12.468 -2.946 1.00 0.00 H new ATOM 0 HG SER A 940 -8.341 10.559 -3.738 1.00 0.00 H new ATOM 332 N SER A 941 -9.562 12.912 0.658 1.00 0.00 N ATOM 333 CA SER A 941 -10.593 13.553 1.458 1.00 0.00 C ATOM 334 C SER A 941 -9.957 14.646 2.297 1.00 0.00 C ATOM 335 O SER A 941 -10.439 15.781 2.366 1.00 0.00 O ATOM 336 CB SER A 941 -11.275 12.519 2.353 1.00 0.00 C ATOM 337 OG SER A 941 -11.672 11.383 1.599 1.00 0.00 O ATOM 0 H SER A 941 -9.251 12.006 1.008 1.00 0.00 H new ATOM 0 HA SER A 941 -11.348 13.993 0.807 1.00 0.00 H new ATOM 0 HB2 SER A 941 -10.594 12.214 3.148 1.00 0.00 H new ATOM 0 HB3 SER A 941 -12.146 12.965 2.833 1.00 0.00 H new ATOM 0 HG SER A 941 -10.877 10.888 1.310 1.00 0.00 H new ATOM 343 N LYS A 942 -8.839 14.271 2.890 1.00 0.00 N ATOM 344 CA LYS A 942 -8.052 15.132 3.743 1.00 0.00 C ATOM 345 C LYS A 942 -7.648 16.409 3.043 1.00 0.00 C ATOM 346 O LYS A 942 -7.791 17.498 3.596 1.00 0.00 O ATOM 347 CB LYS A 942 -6.807 14.377 4.178 1.00 0.00 C ATOM 348 CG LYS A 942 -6.968 13.693 5.508 1.00 0.00 C ATOM 349 CD LYS A 942 -6.925 14.725 6.603 1.00 0.00 C ATOM 350 CE LYS A 942 -7.822 14.348 7.777 1.00 0.00 C ATOM 351 NZ LYS A 942 -7.529 12.984 8.300 1.00 0.00 N ATOM 0 H LYS A 942 -8.446 13.335 2.787 1.00 0.00 H new ATOM 0 HA LYS A 942 -8.660 15.410 4.604 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -6.557 13.633 3.421 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -5.968 15.071 4.232 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -7.913 13.151 5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -6.175 12.959 5.652 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -5.899 14.840 6.953 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -7.236 15.690 6.204 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -7.694 15.077 8.578 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -8.865 14.398 7.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -8.026 12.844 9.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -7.851 12.272 7.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -6.505 12.882 8.449 1.00 0.00 H new ATOM 365 N ILE A 943 -7.154 16.270 1.827 1.00 0.00 N ATOM 366 CA ILE A 943 -6.632 17.407 1.107 1.00 0.00 C ATOM 367 C ILE A 943 -7.745 18.379 0.710 1.00 0.00 C ATOM 368 O ILE A 943 -7.516 19.585 0.589 1.00 0.00 O ATOM 369 CB ILE A 943 -5.834 16.964 -0.147 1.00 0.00 C ATOM 370 CG1 ILE A 943 -5.239 18.171 -0.877 1.00 0.00 C ATOM 371 CG2 ILE A 943 -6.713 16.163 -1.092 1.00 0.00 C ATOM 372 CD1 ILE A 943 -4.443 17.806 -2.112 1.00 0.00 C ATOM 0 H ILE A 943 -7.105 15.385 1.323 1.00 0.00 H new ATOM 0 HA ILE A 943 -5.951 17.926 1.782 1.00 0.00 H new ATOM 0 HB ILE A 943 -5.015 16.329 0.191 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -6.046 18.845 -1.163 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -4.594 18.718 -0.189 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -6.131 15.863 -1.964 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -7.083 15.275 -0.580 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -7.556 16.775 -1.411 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -4.053 18.713 -2.575 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -3.614 17.157 -1.832 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -5.088 17.286 -2.820 1.00 0.00 H new ATOM 384 N GLN A 944 -8.952 17.849 0.512 1.00 0.00 N ATOM 385 CA GLN A 944 -10.092 18.665 0.094 1.00 0.00 C ATOM 386 C GLN A 944 -10.335 19.882 1.005 1.00 0.00 C ATOM 387 O GLN A 944 -10.243 21.014 0.532 1.00 0.00 O ATOM 388 CB GLN A 944 -11.361 17.813 -0.013 1.00 0.00 C ATOM 389 CG GLN A 944 -11.354 16.860 -1.192 1.00 0.00 C ATOM 390 CD GLN A 944 -12.555 15.936 -1.205 1.00 0.00 C ATOM 391 OE1 GLN A 944 -13.634 16.291 -0.731 1.00 0.00 O ATOM 392 NE2 GLN A 944 -12.378 14.744 -1.754 1.00 0.00 N ATOM 0 H GLN A 944 -9.166 16.859 0.634 1.00 0.00 H new ATOM 0 HA GLN A 944 -9.840 19.059 -0.890 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -11.482 17.240 0.906 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -12.225 18.472 -0.094 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -11.333 17.435 -2.118 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -10.442 16.263 -1.166 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -11.467 14.488 -2.136 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -13.152 14.081 -1.795 1.00 0.00 H new ATOM 401 N PRO A 945 -10.639 19.700 2.310 1.00 0.00 N ATOM 402 CA PRO A 945 -11.068 20.814 3.165 1.00 0.00 C ATOM 403 C PRO A 945 -9.935 21.733 3.646 1.00 0.00 C ATOM 404 O PRO A 945 -10.130 22.947 3.755 1.00 0.00 O ATOM 405 CB PRO A 945 -11.725 20.122 4.371 1.00 0.00 C ATOM 406 CG PRO A 945 -11.697 18.657 4.073 1.00 0.00 C ATOM 407 CD PRO A 945 -10.604 18.456 3.067 1.00 0.00 C ATOM 0 HA PRO A 945 -11.724 21.479 2.604 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -11.183 20.343 5.290 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -12.748 20.472 4.512 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -11.505 18.079 4.977 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -12.656 18.322 3.678 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -9.637 18.299 3.545 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -10.791 17.590 2.433 1.00 0.00 H new ATOM 415 N ALA A 946 -8.760 21.176 3.921 1.00 0.00 N ATOM 416 CA ALA A 946 -7.720 21.921 4.638 1.00 0.00 C ATOM 417 C ALA A 946 -6.564 22.375 3.736 1.00 0.00 C ATOM 418 O ALA A 946 -6.428 21.915 2.600 1.00 0.00 O ATOM 419 CB ALA A 946 -7.187 21.067 5.779 1.00 0.00 C ATOM 0 H ALA A 946 -8.502 20.223 3.664 1.00 0.00 H new ATOM 0 HA ALA A 946 -8.183 22.830 5.022 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -6.413 21.617 6.315 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -8.000 20.825 6.463 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -6.765 20.146 5.377 1.00 0.00 H new ATOM 425 N PRO A 947 -5.745 23.333 4.235 1.00 0.00 N ATOM 426 CA PRO A 947 -4.468 23.728 3.612 1.00 0.00 C ATOM 427 C PRO A 947 -3.388 22.658 3.846 1.00 0.00 C ATOM 428 O PRO A 947 -3.662 21.686 4.536 1.00 0.00 O ATOM 429 CB PRO A 947 -4.108 25.043 4.339 1.00 0.00 C ATOM 430 CG PRO A 947 -5.319 25.421 5.121 1.00 0.00 C ATOM 431 CD PRO A 947 -6.017 24.135 5.432 1.00 0.00 C ATOM 0 HA PRO A 947 -4.540 23.844 2.531 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -3.248 24.905 4.994 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -3.844 25.824 3.626 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -5.046 25.949 6.035 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -5.963 26.088 4.548 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -5.623 23.666 6.334 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -7.086 24.280 5.590 1.00 0.00 H new ATOM 439 N PRO A 948 -2.132 22.851 3.339 1.00 0.00 N ATOM 440 CA PRO A 948 -1.059 21.812 3.340 1.00 0.00 C ATOM 441 C PRO A 948 -0.833 21.104 4.681 1.00 0.00 C ATOM 442 O PRO A 948 -0.172 20.042 4.752 1.00 0.00 O ATOM 443 CB PRO A 948 0.187 22.602 2.950 1.00 0.00 C ATOM 444 CG PRO A 948 -0.327 23.715 2.109 1.00 0.00 C ATOM 445 CD PRO A 948 -1.657 24.097 2.697 1.00 0.00 C ATOM 0 HA PRO A 948 -1.326 20.996 2.668 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.710 22.978 3.829 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.894 21.982 2.399 1.00 0.00 H new ATOM 0 HG2 PRO A 948 0.361 24.560 2.117 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -0.435 23.402 1.070 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -1.557 24.906 3.420 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -2.350 24.440 1.929 1.00 0.00 H new ATOM 453 N GLU A 949 -1.360 21.684 5.741 1.00 0.00 N ATOM 454 CA GLU A 949 -1.352 21.033 7.030 1.00 0.00 C ATOM 455 C GLU A 949 -2.049 19.684 6.974 1.00 0.00 C ATOM 456 O GLU A 949 -1.856 18.863 7.856 1.00 0.00 O ATOM 457 CB GLU A 949 -2.033 21.881 8.081 1.00 0.00 C ATOM 458 CG GLU A 949 -3.445 22.304 7.723 1.00 0.00 C ATOM 459 CD GLU A 949 -4.185 22.857 8.916 1.00 0.00 C ATOM 460 OE1 GLU A 949 -3.921 24.014 9.300 1.00 0.00 O ATOM 461 OE2 GLU A 949 -5.021 22.130 9.489 1.00 0.00 O ATOM 0 H GLU A 949 -1.798 22.605 5.732 1.00 0.00 H new ATOM 0 HA GLU A 949 -0.305 20.891 7.299 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -2.059 21.325 9.018 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -1.432 22.773 8.256 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -3.410 23.057 6.936 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -3.990 21.449 7.322 1.00 0.00 H new ATOM 468 N GLU A 950 -2.888 19.464 5.968 1.00 0.00 N ATOM 469 CA GLU A 950 -3.490 18.155 5.788 1.00 0.00 C ATOM 470 C GLU A 950 -2.600 17.270 4.946 1.00 0.00 C ATOM 471 O GLU A 950 -2.689 16.050 5.018 1.00 0.00 O ATOM 472 CB GLU A 950 -4.882 18.224 5.144 1.00 0.00 C ATOM 473 CG GLU A 950 -5.030 19.206 3.974 1.00 0.00 C ATOM 474 CD GLU A 950 -4.064 18.975 2.823 1.00 0.00 C ATOM 475 OE1 GLU A 950 -4.058 17.870 2.259 1.00 0.00 O ATOM 476 OE2 GLU A 950 -3.295 19.902 2.490 1.00 0.00 O ATOM 0 H GLU A 950 -3.161 20.163 5.278 1.00 0.00 H new ATOM 0 HA GLU A 950 -3.603 17.732 6.786 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -5.149 17.227 4.793 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -5.605 18.494 5.914 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -6.049 19.144 3.593 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -4.891 20.220 4.349 1.00 0.00 H new ATOM 483 N TYR A 951 -1.733 17.900 4.172 1.00 0.00 N ATOM 484 CA TYR A 951 -0.933 17.201 3.194 1.00 0.00 C ATOM 485 C TYR A 951 -0.140 16.103 3.857 1.00 0.00 C ATOM 486 O TYR A 951 -0.176 14.951 3.431 1.00 0.00 O ATOM 487 CB TYR A 951 -0.003 18.170 2.472 1.00 0.00 C ATOM 488 CG TYR A 951 -0.036 18.009 0.979 1.00 0.00 C ATOM 489 CD1 TYR A 951 -1.081 18.536 0.238 1.00 0.00 C ATOM 490 CD2 TYR A 951 0.961 17.314 0.315 1.00 0.00 C ATOM 491 CE1 TYR A 951 -1.127 18.381 -1.132 1.00 0.00 C ATOM 492 CE2 TYR A 951 0.922 17.153 -1.054 1.00 0.00 C ATOM 493 CZ TYR A 951 -0.124 17.686 -1.772 1.00 0.00 C ATOM 494 OH TYR A 951 -0.173 17.522 -3.134 1.00 0.00 O ATOM 0 H TYR A 951 -1.568 18.906 4.207 1.00 0.00 H new ATOM 0 HA TYR A 951 -1.599 16.753 2.457 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -0.282 19.192 2.728 1.00 0.00 H new ATOM 0 HB3 TYR A 951 1.017 18.019 2.826 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -1.871 19.076 0.740 1.00 0.00 H new ATOM 0 HD2 TYR A 951 1.781 16.892 0.877 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -1.944 18.802 -1.699 1.00 0.00 H new ATOM 0 HE2 TYR A 951 1.708 16.612 -1.560 1.00 0.00 H new ATOM 0 HH TYR A 951 -0.402 16.592 -3.344 1.00 0.00 H new ATOM 504 N VAL A 952 0.556 16.438 4.922 1.00 0.00 N ATOM 505 CA VAL A 952 1.314 15.406 5.617 1.00 0.00 C ATOM 506 C VAL A 952 0.412 14.468 6.458 1.00 0.00 C ATOM 507 O VAL A 952 0.586 13.258 6.396 1.00 0.00 O ATOM 508 CB VAL A 952 2.529 15.957 6.417 1.00 0.00 C ATOM 509 CG1 VAL A 952 2.227 17.297 7.072 1.00 0.00 C ATOM 510 CG2 VAL A 952 3.009 14.951 7.458 1.00 0.00 C ATOM 0 H VAL A 952 0.617 17.376 5.318 1.00 0.00 H new ATOM 0 HA VAL A 952 1.749 14.787 4.832 1.00 0.00 H new ATOM 0 HB VAL A 952 3.330 16.118 5.696 1.00 0.00 H new ATOM 0 HG11 VAL A 952 3.105 17.641 7.619 1.00 0.00 H new ATOM 0 HG12 VAL A 952 1.968 18.027 6.305 1.00 0.00 H new ATOM 0 HG13 VAL A 952 1.391 17.184 7.762 1.00 0.00 H new ATOM 0 HG21 VAL A 952 3.859 15.366 8.000 1.00 0.00 H new ATOM 0 HG22 VAL A 952 2.201 14.738 8.158 1.00 0.00 H new ATOM 0 HG23 VAL A 952 3.311 14.029 6.961 1.00 0.00 H new ATOM 520 N PRO A 953 -0.568 14.962 7.244 1.00 0.00 N ATOM 521 CA PRO A 953 -1.535 14.078 7.921 1.00 0.00 C ATOM 522 C PRO A 953 -2.317 13.153 6.989 1.00 0.00 C ATOM 523 O PRO A 953 -2.772 12.097 7.415 1.00 0.00 O ATOM 524 CB PRO A 953 -2.499 15.042 8.577 1.00 0.00 C ATOM 525 CG PRO A 953 -1.670 16.237 8.836 1.00 0.00 C ATOM 526 CD PRO A 953 -0.769 16.354 7.637 1.00 0.00 C ATOM 0 HA PRO A 953 -1.009 13.405 8.598 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -3.342 15.272 7.925 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -2.911 14.632 9.499 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -2.287 17.127 8.954 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -1.093 16.125 9.754 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -1.231 16.936 6.840 1.00 0.00 H new ATOM 0 HD3 PRO A 953 0.173 16.844 7.885 1.00 0.00 H new ATOM 534 N MET A 954 -2.517 13.542 5.740 1.00 0.00 N ATOM 535 CA MET A 954 -3.238 12.674 4.825 1.00 0.00 C ATOM 536 C MET A 954 -2.346 11.518 4.403 1.00 0.00 C ATOM 537 O MET A 954 -2.813 10.399 4.202 1.00 0.00 O ATOM 538 CB MET A 954 -3.780 13.426 3.602 1.00 0.00 C ATOM 539 CG MET A 954 -2.735 13.905 2.617 1.00 0.00 C ATOM 540 SD MET A 954 -3.468 14.734 1.199 1.00 0.00 S ATOM 541 CE MET A 954 -2.014 15.124 0.244 1.00 0.00 C ATOM 0 H MET A 954 -2.200 14.427 5.345 1.00 0.00 H new ATOM 0 HA MET A 954 -4.107 12.285 5.355 1.00 0.00 H new ATOM 0 HB2 MET A 954 -4.478 12.775 3.076 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.349 14.288 3.950 1.00 0.00 H new ATOM 0 HG2 MET A 954 -2.049 14.587 3.120 1.00 0.00 H new ATOM 0 HG3 MET A 954 -2.145 13.055 2.274 1.00 0.00 H new ATOM 0 HE1 MET A 954 -2.240 15.936 -0.447 1.00 0.00 H new ATOM 0 HE2 MET A 954 -1.210 15.430 0.914 1.00 0.00 H new ATOM 0 HE3 MET A 954 -1.702 14.245 -0.319 1.00 0.00 H new ATOM 551 N VAL A 955 -1.054 11.791 4.252 1.00 0.00 N ATOM 552 CA VAL A 955 -0.103 10.705 4.053 1.00 0.00 C ATOM 553 C VAL A 955 -0.070 9.797 5.272 1.00 0.00 C ATOM 554 O VAL A 955 0.253 8.615 5.167 1.00 0.00 O ATOM 555 CB VAL A 955 1.330 11.172 3.722 1.00 0.00 C ATOM 556 CG1 VAL A 955 2.184 11.359 4.969 1.00 0.00 C ATOM 557 CG2 VAL A 955 1.972 10.179 2.770 1.00 0.00 C ATOM 0 H VAL A 955 -0.650 12.728 4.263 1.00 0.00 H new ATOM 0 HA VAL A 955 -0.462 10.161 3.179 1.00 0.00 H new ATOM 0 HB VAL A 955 1.265 12.150 3.246 1.00 0.00 H new ATOM 0 HG11 VAL A 955 3.182 11.688 4.680 1.00 0.00 H new ATOM 0 HG12 VAL A 955 1.727 12.110 5.614 1.00 0.00 H new ATOM 0 HG13 VAL A 955 2.255 10.413 5.507 1.00 0.00 H new ATOM 0 HG21 VAL A 955 2.985 10.505 2.533 1.00 0.00 H new ATOM 0 HG22 VAL A 955 2.007 9.196 3.239 1.00 0.00 H new ATOM 0 HG23 VAL A 955 1.385 10.122 1.853 1.00 0.00 H new ATOM 567 N LYS A 956 -0.386 10.359 6.433 1.00 0.00 N ATOM 568 CA LYS A 956 -0.485 9.557 7.646 1.00 0.00 C ATOM 569 C LYS A 956 -1.487 8.434 7.414 1.00 0.00 C ATOM 570 O LYS A 956 -1.263 7.283 7.794 1.00 0.00 O ATOM 571 CB LYS A 956 -0.913 10.427 8.831 1.00 0.00 C ATOM 572 CG LYS A 956 -1.246 9.646 10.094 1.00 0.00 C ATOM 573 CD LYS A 956 -1.481 10.569 11.282 1.00 0.00 C ATOM 574 CE LYS A 956 -2.502 11.656 10.974 1.00 0.00 C ATOM 575 NZ LYS A 956 -3.843 11.104 10.651 1.00 0.00 N ATOM 0 H LYS A 956 -0.576 11.353 6.560 1.00 0.00 H new ATOM 0 HA LYS A 956 0.490 9.130 7.882 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -0.114 11.134 9.055 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.785 11.013 8.540 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -2.135 9.040 9.923 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -0.431 8.959 10.323 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -1.824 9.982 12.134 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -0.538 11.031 11.573 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -2.585 12.325 11.831 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.148 12.255 10.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -4.541 11.875 10.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -3.813 10.642 9.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -4.115 10.408 11.374 1.00 0.00 H new ATOM 589 N GLU A 957 -2.576 8.801 6.757 1.00 0.00 N ATOM 590 CA GLU A 957 -3.641 7.872 6.417 1.00 0.00 C ATOM 591 C GLU A 957 -3.121 6.705 5.561 1.00 0.00 C ATOM 592 O GLU A 957 -3.426 5.546 5.844 1.00 0.00 O ATOM 593 CB GLU A 957 -4.773 8.618 5.695 1.00 0.00 C ATOM 594 CG GLU A 957 -5.150 9.941 6.355 1.00 0.00 C ATOM 595 CD GLU A 957 -5.516 9.795 7.819 1.00 0.00 C ATOM 596 OE1 GLU A 957 -4.605 9.671 8.660 1.00 0.00 O ATOM 597 OE2 GLU A 957 -6.721 9.820 8.137 1.00 0.00 O ATOM 0 H GLU A 957 -2.746 9.757 6.443 1.00 0.00 H new ATOM 0 HA GLU A 957 -4.030 7.445 7.341 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -4.472 8.808 4.665 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -5.653 7.976 5.657 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -4.315 10.636 6.263 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -5.991 10.380 5.819 1.00 0.00 H new ATOM 604 N VAL A 958 -2.321 7.001 4.532 1.00 0.00 N ATOM 605 CA VAL A 958 -1.771 5.950 3.671 1.00 0.00 C ATOM 606 C VAL A 958 -0.644 5.174 4.367 1.00 0.00 C ATOM 607 O VAL A 958 -0.415 4.003 4.071 1.00 0.00 O ATOM 608 CB VAL A 958 -1.257 6.505 2.318 1.00 0.00 C ATOM 609 CG1 VAL A 958 -2.268 7.467 1.725 1.00 0.00 C ATOM 610 CG2 VAL A 958 0.098 7.180 2.454 1.00 0.00 C ATOM 0 H VAL A 958 -2.042 7.948 4.277 1.00 0.00 H new ATOM 0 HA VAL A 958 -2.597 5.268 3.470 1.00 0.00 H new ATOM 0 HB VAL A 958 -1.131 5.657 1.645 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -1.893 7.849 0.775 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -3.212 6.947 1.560 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.427 8.298 2.413 1.00 0.00 H new ATOM 0 HG21 VAL A 958 0.418 7.553 1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 958 0.022 8.012 3.154 1.00 0.00 H new ATOM 0 HG23 VAL A 958 0.828 6.460 2.824 1.00 0.00 H new ATOM 620 N GLY A 959 0.065 5.823 5.284 1.00 0.00 N ATOM 621 CA GLY A 959 1.120 5.136 6.008 1.00 0.00 C ATOM 622 C GLY A 959 0.564 4.174 7.036 1.00 0.00 C ATOM 623 O GLY A 959 1.060 3.056 7.187 1.00 0.00 O ATOM 0 H GLY A 959 -0.069 6.802 5.538 1.00 0.00 H new ATOM 0 HA2 GLY A 959 1.749 4.591 5.304 1.00 0.00 H new ATOM 0 HA3 GLY A 959 1.757 5.869 6.503 1.00 0.00 H new ATOM 627 N LEU A 960 -0.467 4.613 7.750 1.00 0.00 N ATOM 628 CA LEU A 960 -1.223 3.735 8.637 1.00 0.00 C ATOM 629 C LEU A 960 -1.803 2.576 7.836 1.00 0.00 C ATOM 630 O LEU A 960 -1.906 1.449 8.325 1.00 0.00 O ATOM 631 CB LEU A 960 -2.339 4.527 9.325 1.00 0.00 C ATOM 632 CG LEU A 960 -3.183 3.740 10.328 1.00 0.00 C ATOM 633 CD1 LEU A 960 -2.317 3.219 11.463 1.00 0.00 C ATOM 634 CD2 LEU A 960 -4.312 4.606 10.868 1.00 0.00 C ATOM 0 H LEU A 960 -0.800 5.577 7.732 1.00 0.00 H new ATOM 0 HA LEU A 960 -0.561 3.334 9.404 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -1.892 5.377 9.841 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -3.000 4.931 8.558 1.00 0.00 H new ATOM 0 HG LEU A 960 -3.622 2.885 9.814 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -2.936 2.662 12.166 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -1.545 2.563 11.060 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -1.848 4.058 11.978 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -4.903 4.031 11.581 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -3.893 5.480 11.366 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -4.949 4.928 10.044 1.00 0.00 H new ATOM 646 N ALA A 961 -2.170 2.874 6.598 1.00 0.00 N ATOM 647 CA ALA A 961 -2.631 1.861 5.663 1.00 0.00 C ATOM 648 C ALA A 961 -1.563 0.792 5.455 1.00 0.00 C ATOM 649 O ALA A 961 -1.849 -0.400 5.529 1.00 0.00 O ATOM 650 CB ALA A 961 -3.016 2.489 4.337 1.00 0.00 C ATOM 0 H ALA A 961 -2.156 3.820 6.216 1.00 0.00 H new ATOM 0 HA ALA A 961 -3.515 1.386 6.088 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -3.358 1.713 3.652 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -3.817 3.212 4.495 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -2.150 2.995 3.909 1.00 0.00 H new ATOM 656 N LEU A 962 -0.329 1.212 5.200 1.00 0.00 N ATOM 657 CA LEU A 962 0.760 0.262 5.044 1.00 0.00 C ATOM 658 C LEU A 962 1.102 -0.431 6.367 1.00 0.00 C ATOM 659 O LEU A 962 1.443 -1.607 6.369 1.00 0.00 O ATOM 660 CB LEU A 962 1.994 0.939 4.438 1.00 0.00 C ATOM 661 CG LEU A 962 3.302 0.154 4.574 1.00 0.00 C ATOM 662 CD1 LEU A 962 3.290 -1.076 3.684 1.00 0.00 C ATOM 663 CD2 LEU A 962 4.496 1.037 4.248 1.00 0.00 C ATOM 0 H LEU A 962 -0.062 2.191 5.098 1.00 0.00 H new ATOM 0 HA LEU A 962 0.424 -0.511 4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 962 1.806 1.120 3.380 1.00 0.00 H new ATOM 0 HB3 LEU A 962 2.123 1.913 4.910 1.00 0.00 H new ATOM 0 HG LEU A 962 3.391 -0.176 5.609 1.00 0.00 H new ATOM 0 HD11 LEU A 962 4.229 -1.617 3.798 1.00 0.00 H new ATOM 0 HD12 LEU A 962 2.461 -1.724 3.970 1.00 0.00 H new ATOM 0 HD13 LEU A 962 3.171 -0.772 2.644 1.00 0.00 H new ATOM 0 HD21 LEU A 962 5.415 0.459 4.351 1.00 0.00 H new ATOM 0 HD22 LEU A 962 4.410 1.402 3.225 1.00 0.00 H new ATOM 0 HD23 LEU A 962 4.521 1.883 4.934 1.00 0.00 H new ATOM 675 N ARG A 963 1.035 0.278 7.492 1.00 0.00 N ATOM 676 CA ARG A 963 1.284 -0.366 8.784 1.00 0.00 C ATOM 677 C ARG A 963 0.235 -1.441 9.090 1.00 0.00 C ATOM 678 O ARG A 963 0.581 -2.551 9.496 1.00 0.00 O ATOM 679 CB ARG A 963 1.342 0.655 9.921 1.00 0.00 C ATOM 680 CG ARG A 963 2.022 0.105 11.166 1.00 0.00 C ATOM 681 CD ARG A 963 2.142 1.151 12.260 1.00 0.00 C ATOM 682 NE ARG A 963 0.875 1.399 12.942 1.00 0.00 N ATOM 683 CZ ARG A 963 0.683 2.400 13.801 1.00 0.00 C ATOM 684 NH1 ARG A 963 1.654 3.280 14.034 1.00 0.00 N ATOM 685 NH2 ARG A 963 -0.481 2.526 14.426 1.00 0.00 N ATOM 0 H ARG A 963 0.816 1.273 7.539 1.00 0.00 H new ATOM 0 HA ARG A 963 2.258 -0.850 8.711 1.00 0.00 H new ATOM 0 HB2 ARG A 963 1.877 1.542 9.581 1.00 0.00 H new ATOM 0 HB3 ARG A 963 0.330 0.970 10.174 1.00 0.00 H new ATOM 0 HG2 ARG A 963 1.456 -0.748 11.541 1.00 0.00 H new ATOM 0 HG3 ARG A 963 3.015 -0.261 10.905 1.00 0.00 H new ATOM 0 HD2 ARG A 963 2.885 0.826 12.988 1.00 0.00 H new ATOM 0 HD3 ARG A 963 2.506 2.083 11.828 1.00 0.00 H new ATOM 0 HE ARG A 963 0.094 0.772 12.751 1.00 0.00 H new ATOM 0 HH11 ARG A 963 2.550 3.190 13.554 1.00 0.00 H new ATOM 0 HH12 ARG A 963 1.502 4.044 14.692 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -1.230 1.856 14.249 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -0.627 3.292 15.083 1.00 0.00 H new ATOM 699 N THR A 964 -1.044 -1.113 8.919 1.00 0.00 N ATOM 700 CA THR A 964 -2.093 -2.129 9.014 1.00 0.00 C ATOM 701 C THR A 964 -1.819 -3.252 8.018 1.00 0.00 C ATOM 702 O THR A 964 -2.061 -4.428 8.296 1.00 0.00 O ATOM 703 CB THR A 964 -3.505 -1.557 8.764 1.00 0.00 C ATOM 704 OG1 THR A 964 -3.521 -0.764 7.575 1.00 0.00 O ATOM 705 CG2 THR A 964 -3.980 -0.719 9.938 1.00 0.00 C ATOM 0 H THR A 964 -1.376 -0.170 8.718 1.00 0.00 H new ATOM 0 HA THR A 964 -2.072 -2.511 10.035 1.00 0.00 H new ATOM 0 HB THR A 964 -4.183 -2.402 8.646 1.00 0.00 H new ATOM 0 HG1 THR A 964 -2.663 -0.854 7.110 1.00 0.00 H new ATOM 0 HG21 THR A 964 -4.977 -0.332 9.729 1.00 0.00 H new ATOM 0 HG22 THR A 964 -4.011 -1.336 10.836 1.00 0.00 H new ATOM 0 HG23 THR A 964 -3.293 0.113 10.093 1.00 0.00 H new ATOM 713 N LEU A 965 -1.284 -2.872 6.864 1.00 0.00 N ATOM 714 CA LEU A 965 -0.890 -3.825 5.840 1.00 0.00 C ATOM 715 C LEU A 965 0.239 -4.715 6.335 1.00 0.00 C ATOM 716 O LEU A 965 0.316 -5.878 5.976 1.00 0.00 O ATOM 717 CB LEU A 965 -0.444 -3.092 4.586 1.00 0.00 C ATOM 718 CG LEU A 965 0.031 -3.984 3.448 1.00 0.00 C ATOM 719 CD1 LEU A 965 -1.107 -4.853 2.937 1.00 0.00 C ATOM 720 CD2 LEU A 965 0.612 -3.139 2.332 1.00 0.00 C ATOM 0 H LEU A 965 -1.113 -1.898 6.615 1.00 0.00 H new ATOM 0 HA LEU A 965 -1.753 -4.449 5.609 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -1.273 -2.482 4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 965 0.363 -2.409 4.851 1.00 0.00 H new ATOM 0 HG LEU A 965 0.813 -4.644 3.823 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -0.747 -5.483 2.124 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -1.477 -5.482 3.747 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -1.915 -4.218 2.573 1.00 0.00 H new ATOM 0 HD21 LEU A 965 0.949 -3.787 1.523 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -0.151 -2.457 1.957 1.00 0.00 H new ATOM 0 HD23 LEU A 965 1.457 -2.565 2.712 1.00 0.00 H new ATOM 732 N LEU A 966 1.117 -4.150 7.148 1.00 0.00 N ATOM 733 CA LEU A 966 2.237 -4.900 7.715 1.00 0.00 C ATOM 734 C LEU A 966 1.743 -6.103 8.519 1.00 0.00 C ATOM 735 O LEU A 966 2.394 -7.145 8.548 1.00 0.00 O ATOM 736 CB LEU A 966 3.115 -4.003 8.589 1.00 0.00 C ATOM 737 CG LEU A 966 3.850 -2.884 7.848 1.00 0.00 C ATOM 738 CD1 LEU A 966 4.662 -2.046 8.822 1.00 0.00 C ATOM 739 CD2 LEU A 966 4.748 -3.458 6.762 1.00 0.00 C ATOM 0 H LEU A 966 1.079 -3.172 7.434 1.00 0.00 H new ATOM 0 HA LEU A 966 2.840 -5.266 6.884 1.00 0.00 H new ATOM 0 HB2 LEU A 966 2.491 -3.555 9.363 1.00 0.00 H new ATOM 0 HB3 LEU A 966 3.852 -4.626 9.095 1.00 0.00 H new ATOM 0 HG LEU A 966 3.108 -2.242 7.374 1.00 0.00 H new ATOM 0 HD11 LEU A 966 5.178 -1.255 8.279 1.00 0.00 H new ATOM 0 HD12 LEU A 966 3.997 -1.603 9.563 1.00 0.00 H new ATOM 0 HD13 LEU A 966 5.394 -2.679 9.324 1.00 0.00 H new ATOM 0 HD21 LEU A 966 5.261 -2.646 6.247 1.00 0.00 H new ATOM 0 HD22 LEU A 966 5.484 -4.124 7.213 1.00 0.00 H new ATOM 0 HD23 LEU A 966 4.143 -4.016 6.047 1.00 0.00 H new ATOM 751 N ALA A 967 0.591 -5.958 9.169 1.00 0.00 N ATOM 752 CA ALA A 967 -0.038 -7.084 9.857 1.00 0.00 C ATOM 753 C ALA A 967 -0.462 -8.135 8.838 1.00 0.00 C ATOM 754 O ALA A 967 -0.265 -9.338 9.029 1.00 0.00 O ATOM 755 CB ALA A 967 -1.235 -6.617 10.671 1.00 0.00 C ATOM 0 H ALA A 967 0.077 -5.080 9.234 1.00 0.00 H new ATOM 0 HA ALA A 967 0.684 -7.525 10.544 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.688 -7.471 11.175 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -0.908 -5.889 11.414 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.968 -6.156 10.009 1.00 0.00 H new ATOM 761 N THR A 968 -1.034 -7.655 7.746 1.00 0.00 N ATOM 762 CA THR A 968 -1.385 -8.495 6.613 1.00 0.00 C ATOM 763 C THR A 968 -0.142 -9.174 6.032 1.00 0.00 C ATOM 764 O THR A 968 -0.157 -10.361 5.702 1.00 0.00 O ATOM 765 CB THR A 968 -2.076 -7.650 5.530 1.00 0.00 C ATOM 766 OG1 THR A 968 -3.412 -7.339 5.932 1.00 0.00 O ATOM 767 CG2 THR A 968 -2.090 -8.362 4.197 1.00 0.00 C ATOM 0 H THR A 968 -1.268 -6.670 7.620 1.00 0.00 H new ATOM 0 HA THR A 968 -2.069 -9.270 6.958 1.00 0.00 H new ATOM 0 HB THR A 968 -1.508 -6.727 5.411 1.00 0.00 H new ATOM 0 HG1 THR A 968 -4.044 -7.710 5.281 1.00 0.00 H new ATOM 0 HG21 THR A 968 -2.586 -7.736 3.455 1.00 0.00 H new ATOM 0 HG22 THR A 968 -1.066 -8.559 3.879 1.00 0.00 H new ATOM 0 HG23 THR A 968 -2.628 -9.305 4.294 1.00 0.00 H new ATOM 775 N VAL A 969 0.925 -8.400 5.908 1.00 0.00 N ATOM 776 CA VAL A 969 2.200 -8.907 5.432 1.00 0.00 C ATOM 777 C VAL A 969 2.665 -10.088 6.276 1.00 0.00 C ATOM 778 O VAL A 969 3.223 -11.039 5.749 1.00 0.00 O ATOM 779 CB VAL A 969 3.284 -7.805 5.433 1.00 0.00 C ATOM 780 CG1 VAL A 969 4.646 -8.374 5.071 1.00 0.00 C ATOM 781 CG2 VAL A 969 2.910 -6.688 4.472 1.00 0.00 C ATOM 0 H VAL A 969 0.930 -7.405 6.134 1.00 0.00 H new ATOM 0 HA VAL A 969 2.051 -9.241 4.405 1.00 0.00 H new ATOM 0 HB VAL A 969 3.343 -7.397 6.442 1.00 0.00 H new ATOM 0 HG11 VAL A 969 5.388 -7.576 5.080 1.00 0.00 H new ATOM 0 HG12 VAL A 969 4.926 -9.138 5.797 1.00 0.00 H new ATOM 0 HG13 VAL A 969 4.602 -8.818 4.076 1.00 0.00 H new ATOM 0 HG21 VAL A 969 3.685 -5.921 4.486 1.00 0.00 H new ATOM 0 HG22 VAL A 969 2.817 -7.091 3.464 1.00 0.00 H new ATOM 0 HG23 VAL A 969 1.960 -6.249 4.776 1.00 0.00 H new ATOM 791 N ASP A 970 2.393 -10.043 7.575 1.00 0.00 N ATOM 792 CA ASP A 970 2.804 -11.114 8.481 1.00 0.00 C ATOM 793 C ASP A 970 1.982 -12.373 8.262 1.00 0.00 C ATOM 794 O ASP A 970 2.411 -13.459 8.607 1.00 0.00 O ATOM 795 CB ASP A 970 2.708 -10.663 9.939 1.00 0.00 C ATOM 796 CG ASP A 970 3.377 -11.637 10.890 1.00 0.00 C ATOM 797 OD1 ASP A 970 4.597 -11.489 11.137 1.00 0.00 O ATOM 798 OD2 ASP A 970 2.695 -12.551 11.400 1.00 0.00 O ATOM 0 H ASP A 970 1.890 -9.278 8.026 1.00 0.00 H new ATOM 0 HA ASP A 970 3.845 -11.348 8.258 1.00 0.00 H new ATOM 0 HB2 ASP A 970 3.170 -9.681 10.044 1.00 0.00 H new ATOM 0 HB3 ASP A 970 1.659 -10.553 10.214 1.00 0.00 H new ATOM 803 N GLU A 971 0.804 -12.223 7.693 1.00 0.00 N ATOM 804 CA GLU A 971 0.031 -13.383 7.258 1.00 0.00 C ATOM 805 C GLU A 971 0.733 -14.005 6.053 1.00 0.00 C ATOM 806 O GLU A 971 0.993 -15.215 5.977 1.00 0.00 O ATOM 807 CB GLU A 971 -1.390 -12.966 6.877 1.00 0.00 C ATOM 808 CG GLU A 971 -2.106 -12.201 7.975 1.00 0.00 C ATOM 809 CD GLU A 971 -2.417 -13.068 9.178 1.00 0.00 C ATOM 810 OE1 GLU A 971 -1.531 -13.233 10.041 1.00 0.00 O ATOM 811 OE2 GLU A 971 -3.548 -13.590 9.264 1.00 0.00 O ATOM 0 H GLU A 971 0.359 -11.322 7.519 1.00 0.00 H new ATOM 0 HA GLU A 971 -0.035 -14.107 8.070 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -1.352 -12.349 5.979 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -1.968 -13.856 6.628 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.489 -11.359 8.288 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -3.034 -11.787 7.580 1.00 0.00 H new ATOM 818 N SER A 972 1.073 -13.133 5.134 1.00 0.00 N ATOM 819 CA SER A 972 1.750 -13.503 3.916 1.00 0.00 C ATOM 820 C SER A 972 3.180 -13.991 4.188 1.00 0.00 C ATOM 821 O SER A 972 3.739 -14.731 3.389 1.00 0.00 O ATOM 822 CB SER A 972 1.728 -12.316 2.954 1.00 0.00 C ATOM 823 OG SER A 972 2.414 -12.609 1.756 1.00 0.00 O ATOM 0 H SER A 972 0.884 -12.134 5.213 1.00 0.00 H new ATOM 0 HA SER A 972 1.226 -14.341 3.456 1.00 0.00 H new ATOM 0 HB2 SER A 972 0.696 -12.049 2.728 1.00 0.00 H new ATOM 0 HB3 SER A 972 2.184 -11.449 3.433 1.00 0.00 H new ATOM 0 HG SER A 972 3.376 -12.668 1.936 1.00 0.00 H new ATOM 829 N LEU A 973 3.775 -13.547 5.296 1.00 0.00 N ATOM 830 CA LEU A 973 5.157 -13.903 5.635 1.00 0.00 C ATOM 831 C LEU A 973 5.357 -15.406 5.870 1.00 0.00 C ATOM 832 O LEU A 973 6.275 -15.966 5.298 1.00 0.00 O ATOM 833 CB LEU A 973 5.666 -13.099 6.836 1.00 0.00 C ATOM 834 CG LEU A 973 6.050 -11.651 6.526 1.00 0.00 C ATOM 835 CD1 LEU A 973 6.437 -10.916 7.798 1.00 0.00 C ATOM 836 CD2 LEU A 973 7.189 -11.608 5.519 1.00 0.00 C ATOM 0 H LEU A 973 3.321 -12.938 5.977 1.00 0.00 H new ATOM 0 HA LEU A 973 5.752 -13.640 4.760 1.00 0.00 H new ATOM 0 HB2 LEU A 973 4.895 -13.098 7.607 1.00 0.00 H new ATOM 0 HB3 LEU A 973 6.534 -13.608 7.254 1.00 0.00 H new ATOM 0 HG LEU A 973 5.184 -11.151 6.091 1.00 0.00 H new ATOM 0 HD11 LEU A 973 6.707 -9.888 7.556 1.00 0.00 H new ATOM 0 HD12 LEU A 973 5.594 -10.917 8.490 1.00 0.00 H new ATOM 0 HD13 LEU A 973 7.288 -11.415 8.262 1.00 0.00 H new ATOM 0 HD21 LEU A 973 7.450 -10.571 5.309 1.00 0.00 H new ATOM 0 HD22 LEU A 973 8.057 -12.125 5.929 1.00 0.00 H new ATOM 0 HD23 LEU A 973 6.878 -12.097 4.596 1.00 0.00 H new ATOM 848 N PRO A 974 4.566 -16.102 6.718 1.00 0.00 N ATOM 849 CA PRO A 974 4.627 -17.565 6.767 1.00 0.00 C ATOM 850 C PRO A 974 4.339 -18.162 5.398 1.00 0.00 C ATOM 851 O PRO A 974 4.857 -19.227 5.039 1.00 0.00 O ATOM 852 CB PRO A 974 3.544 -17.969 7.776 1.00 0.00 C ATOM 853 CG PRO A 974 2.735 -16.741 7.991 1.00 0.00 C ATOM 854 CD PRO A 974 3.651 -15.583 7.714 1.00 0.00 C ATOM 0 HA PRO A 974 5.614 -17.926 7.058 1.00 0.00 H new ATOM 0 HB2 PRO A 974 2.930 -18.783 7.390 1.00 0.00 H new ATOM 0 HB3 PRO A 974 3.986 -18.318 8.709 1.00 0.00 H new ATOM 0 HG2 PRO A 974 1.871 -16.722 7.326 1.00 0.00 H new ATOM 0 HG3 PRO A 974 2.353 -16.700 9.011 1.00 0.00 H new ATOM 0 HD2 PRO A 974 3.102 -14.718 7.342 1.00 0.00 H new ATOM 0 HD3 PRO A 974 4.177 -15.264 8.614 1.00 0.00 H new ATOM 862 N VAL A 975 3.535 -17.454 4.609 1.00 0.00 N ATOM 863 CA VAL A 975 3.285 -17.896 3.239 1.00 0.00 C ATOM 864 C VAL A 975 4.481 -17.571 2.332 1.00 0.00 C ATOM 865 O VAL A 975 4.565 -18.060 1.212 1.00 0.00 O ATOM 866 CB VAL A 975 1.992 -17.302 2.654 1.00 0.00 C ATOM 867 CG1 VAL A 975 1.522 -18.156 1.493 1.00 0.00 C ATOM 868 CG2 VAL A 975 0.903 -17.209 3.711 1.00 0.00 C ATOM 0 H VAL A 975 3.057 -16.596 4.883 1.00 0.00 H new ATOM 0 HA VAL A 975 3.154 -18.977 3.279 1.00 0.00 H new ATOM 0 HB VAL A 975 2.203 -16.292 2.302 1.00 0.00 H new ATOM 0 HG11 VAL A 975 0.606 -17.735 1.079 1.00 0.00 H new ATOM 0 HG12 VAL A 975 2.292 -18.178 0.722 1.00 0.00 H new ATOM 0 HG13 VAL A 975 1.329 -19.170 1.842 1.00 0.00 H new ATOM 0 HG21 VAL A 975 0.001 -16.786 3.268 1.00 0.00 H new ATOM 0 HG22 VAL A 975 0.685 -18.205 4.097 1.00 0.00 H new ATOM 0 HG23 VAL A 975 1.241 -16.570 4.527 1.00 0.00 H new ATOM 878 N LEU A 976 5.417 -16.766 2.830 1.00 0.00 N ATOM 879 CA LEU A 976 6.640 -16.443 2.093 1.00 0.00 C ATOM 880 C LEU A 976 7.505 -17.692 1.901 1.00 0.00 C ATOM 881 O LEU A 976 7.813 -18.031 0.757 1.00 0.00 O ATOM 882 CB LEU A 976 7.405 -15.279 2.769 1.00 0.00 C ATOM 883 CG LEU A 976 8.835 -14.974 2.278 1.00 0.00 C ATOM 884 CD1 LEU A 976 9.193 -13.528 2.589 1.00 0.00 C ATOM 885 CD2 LEU A 976 9.862 -15.886 2.936 1.00 0.00 C ATOM 0 H LEU A 976 5.352 -16.322 3.746 1.00 0.00 H new ATOM 0 HA LEU A 976 6.367 -16.095 1.097 1.00 0.00 H new ATOM 0 HB2 LEU A 976 6.810 -14.374 2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 976 7.456 -15.488 3.838 1.00 0.00 H new ATOM 0 HG LEU A 976 8.855 -15.147 1.202 1.00 0.00 H new ATOM 0 HD11 LEU A 976 10.204 -13.320 2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 976 8.491 -12.863 2.086 1.00 0.00 H new ATOM 0 HD13 LEU A 976 9.140 -13.364 3.665 1.00 0.00 H new ATOM 0 HD21 LEU A 976 10.857 -15.641 2.565 1.00 0.00 H new ATOM 0 HD22 LEU A 976 9.833 -15.746 4.017 1.00 0.00 H new ATOM 0 HD23 LEU A 976 9.632 -16.925 2.698 1.00 0.00 H new ATOM 897 N PRO A 977 7.905 -18.423 2.978 1.00 0.00 N ATOM 898 CA PRO A 977 8.633 -19.685 2.814 1.00 0.00 C ATOM 899 C PRO A 977 7.797 -20.688 2.039 1.00 0.00 C ATOM 900 O PRO A 977 8.325 -21.508 1.286 1.00 0.00 O ATOM 901 CB PRO A 977 8.872 -20.176 4.248 1.00 0.00 C ATOM 902 CG PRO A 977 8.738 -18.961 5.092 1.00 0.00 C ATOM 903 CD PRO A 977 7.717 -18.104 4.401 1.00 0.00 C ATOM 0 HA PRO A 977 9.561 -19.560 2.256 1.00 0.00 H new ATOM 0 HB2 PRO A 977 8.145 -20.937 4.532 1.00 0.00 H new ATOM 0 HB3 PRO A 977 9.860 -20.624 4.353 1.00 0.00 H new ATOM 0 HG2 PRO A 977 8.417 -19.218 6.101 1.00 0.00 H new ATOM 0 HG3 PRO A 977 9.691 -18.440 5.184 1.00 0.00 H new ATOM 0 HD2 PRO A 977 6.706 -18.337 4.734 1.00 0.00 H new ATOM 0 HD3 PRO A 977 7.882 -17.045 4.600 1.00 0.00 H new ATOM 911 N ALA A 978 6.481 -20.598 2.217 1.00 0.00 N ATOM 912 CA ALA A 978 5.547 -21.427 1.476 1.00 0.00 C ATOM 913 C ALA A 978 5.655 -21.177 -0.030 1.00 0.00 C ATOM 914 O ALA A 978 5.845 -22.117 -0.802 1.00 0.00 O ATOM 915 CB ALA A 978 4.126 -21.177 1.960 1.00 0.00 C ATOM 0 H ALA A 978 6.040 -19.954 2.873 1.00 0.00 H new ATOM 0 HA ALA A 978 5.803 -22.471 1.657 1.00 0.00 H new ATOM 0 HB1 ALA A 978 3.434 -21.804 1.397 1.00 0.00 H new ATOM 0 HB2 ALA A 978 4.055 -21.419 3.020 1.00 0.00 H new ATOM 0 HB3 ALA A 978 3.870 -20.128 1.810 1.00 0.00 H new ATOM 921 N SER A 979 5.552 -19.908 -0.441 1.00 0.00 N ATOM 922 CA SER A 979 5.570 -19.552 -1.862 1.00 0.00 C ATOM 923 C SER A 979 5.702 -18.034 -2.101 1.00 0.00 C ATOM 924 O SER A 979 6.406 -17.600 -3.015 1.00 0.00 O ATOM 925 CB SER A 979 4.296 -20.069 -2.533 1.00 0.00 C ATOM 926 OG SER A 979 4.436 -21.421 -2.940 1.00 0.00 O ATOM 0 H SER A 979 5.456 -19.113 0.190 1.00 0.00 H new ATOM 0 HA SER A 979 6.452 -20.020 -2.299 1.00 0.00 H new ATOM 0 HB2 SER A 979 3.458 -19.981 -1.842 1.00 0.00 H new ATOM 0 HB3 SER A 979 4.062 -19.449 -3.399 1.00 0.00 H new ATOM 0 HG SER A 979 5.140 -21.851 -2.411 1.00 0.00 H new ATOM 932 N THR A 980 5.041 -17.241 -1.266 1.00 0.00 N ATOM 933 CA THR A 980 4.916 -15.788 -1.454 1.00 0.00 C ATOM 934 C THR A 980 6.252 -15.039 -1.553 1.00 0.00 C ATOM 935 O THR A 980 6.279 -13.904 -2.026 1.00 0.00 O ATOM 936 CB THR A 980 4.080 -15.159 -0.336 1.00 0.00 C ATOM 937 OG1 THR A 980 2.938 -15.977 -0.089 1.00 0.00 O ATOM 938 CG2 THR A 980 3.623 -13.765 -0.735 1.00 0.00 C ATOM 0 H THR A 980 4.570 -17.585 -0.429 1.00 0.00 H new ATOM 0 HA THR A 980 4.419 -15.679 -2.418 1.00 0.00 H new ATOM 0 HB THR A 980 4.690 -15.085 0.564 1.00 0.00 H new ATOM 0 HG1 THR A 980 2.762 -16.538 -0.873 1.00 0.00 H new ATOM 0 HG21 THR A 980 3.030 -13.332 0.071 1.00 0.00 H new ATOM 0 HG22 THR A 980 4.494 -13.137 -0.923 1.00 0.00 H new ATOM 0 HG23 THR A 980 3.017 -13.826 -1.639 1.00 0.00 H new ATOM 946 N HIS A 981 7.343 -15.666 -1.117 1.00 0.00 N ATOM 947 CA HIS A 981 8.669 -15.018 -1.055 1.00 0.00 C ATOM 948 C HIS A 981 9.057 -14.290 -2.349 1.00 0.00 C ATOM 949 O HIS A 981 9.943 -13.443 -2.337 1.00 0.00 O ATOM 950 CB HIS A 981 9.760 -16.049 -0.715 1.00 0.00 C ATOM 951 CG HIS A 981 9.857 -17.201 -1.676 1.00 0.00 C ATOM 952 ND1 HIS A 981 9.353 -18.452 -1.399 1.00 0.00 N ATOM 953 CD2 HIS A 981 10.405 -17.287 -2.913 1.00 0.00 C ATOM 954 CE1 HIS A 981 9.590 -19.258 -2.417 1.00 0.00 C ATOM 955 NE2 HIS A 981 10.226 -18.574 -3.348 1.00 0.00 N ATOM 0 H HIS A 981 7.342 -16.634 -0.796 1.00 0.00 H new ATOM 0 HA HIS A 981 8.593 -14.267 -0.268 1.00 0.00 H new ATOM 0 HB2 HIS A 981 10.723 -15.540 -0.680 1.00 0.00 H new ATOM 0 HB3 HIS A 981 9.571 -16.442 0.284 1.00 0.00 H new ATOM 0 HD1 HIS A 981 8.871 -18.715 -0.540 1.00 0.00 H new ATOM 0 HD2 HIS A 981 10.892 -16.490 -3.455 1.00 0.00 H new ATOM 0 HE1 HIS A 981 9.311 -20.300 -2.477 1.00 0.00 H new ATOM 964 N ARG A 982 8.414 -14.612 -3.457 1.00 0.00 N ATOM 965 CA ARG A 982 8.723 -13.907 -4.697 1.00 0.00 C ATOM 966 C ARG A 982 8.056 -12.530 -4.698 1.00 0.00 C ATOM 967 O ARG A 982 8.721 -11.500 -4.824 1.00 0.00 O ATOM 968 CB ARG A 982 8.263 -14.688 -5.932 1.00 0.00 C ATOM 969 CG ARG A 982 8.796 -16.107 -6.017 1.00 0.00 C ATOM 970 CD ARG A 982 8.863 -16.584 -7.462 1.00 0.00 C ATOM 971 NE ARG A 982 7.671 -16.218 -8.231 1.00 0.00 N ATOM 972 CZ ARG A 982 7.685 -15.952 -9.541 1.00 0.00 C ATOM 973 NH1 ARG A 982 8.821 -16.037 -10.229 1.00 0.00 N ATOM 974 NH2 ARG A 982 6.567 -15.600 -10.166 1.00 0.00 N ATOM 0 H ARG A 982 7.696 -15.333 -3.530 1.00 0.00 H new ATOM 0 HA ARG A 982 9.807 -13.801 -4.746 1.00 0.00 H new ATOM 0 HB2 ARG A 982 7.174 -14.722 -5.939 1.00 0.00 H new ATOM 0 HB3 ARG A 982 8.571 -14.144 -6.825 1.00 0.00 H new ATOM 0 HG2 ARG A 982 9.789 -16.153 -5.570 1.00 0.00 H new ATOM 0 HG3 ARG A 982 8.155 -16.774 -5.440 1.00 0.00 H new ATOM 0 HD2 ARG A 982 9.745 -16.158 -7.941 1.00 0.00 H new ATOM 0 HD3 ARG A 982 8.983 -17.667 -7.478 1.00 0.00 H new ATOM 0 HE ARG A 982 6.779 -16.163 -7.739 1.00 0.00 H new ATOM 0 HH11 ARG A 982 9.684 -16.306 -9.757 1.00 0.00 H new ATOM 0 HH12 ARG A 982 8.828 -15.833 -11.228 1.00 0.00 H new ATOM 0 HH21 ARG A 982 5.692 -15.532 -9.646 1.00 0.00 H new ATOM 0 HH22 ARG A 982 6.583 -15.398 -11.166 1.00 0.00 H new ATOM 988 N GLU A 983 6.743 -12.512 -4.495 1.00 0.00 N ATOM 989 CA GLU A 983 5.986 -11.269 -4.553 1.00 0.00 C ATOM 990 C GLU A 983 6.086 -10.442 -3.294 1.00 0.00 C ATOM 991 O GLU A 983 6.206 -9.219 -3.362 1.00 0.00 O ATOM 992 CB GLU A 983 4.521 -11.510 -4.836 1.00 0.00 C ATOM 993 CG GLU A 983 4.124 -11.085 -6.222 1.00 0.00 C ATOM 994 CD GLU A 983 4.653 -12.025 -7.283 1.00 0.00 C ATOM 995 OE1 GLU A 983 4.287 -13.219 -7.252 1.00 0.00 O ATOM 996 OE2 GLU A 983 5.432 -11.585 -8.146 1.00 0.00 O ATOM 0 H GLU A 983 6.184 -13.340 -4.290 1.00 0.00 H new ATOM 0 HA GLU A 983 6.443 -10.714 -5.372 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.299 -12.569 -4.707 1.00 0.00 H new ATOM 0 HB3 GLU A 983 3.920 -10.967 -4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 983 3.037 -11.040 -6.289 1.00 0.00 H new ATOM 0 HG3 GLU A 983 4.497 -10.079 -6.412 1.00 0.00 H new ATOM 1003 N ILE A 984 5.971 -11.087 -2.143 1.00 0.00 N ATOM 1004 CA ILE A 984 5.918 -10.351 -0.892 1.00 0.00 C ATOM 1005 C ILE A 984 7.193 -9.530 -0.752 1.00 0.00 C ATOM 1006 O ILE A 984 7.170 -8.407 -0.270 1.00 0.00 O ATOM 1007 CB ILE A 984 5.673 -11.293 0.321 1.00 0.00 C ATOM 1008 CG1 ILE A 984 5.352 -10.505 1.607 1.00 0.00 C ATOM 1009 CG2 ILE A 984 6.862 -12.215 0.540 1.00 0.00 C ATOM 1010 CD1 ILE A 984 6.561 -9.932 2.323 1.00 0.00 C ATOM 0 H ILE A 984 5.914 -12.101 -2.050 1.00 0.00 H new ATOM 0 HA ILE A 984 5.067 -9.670 -0.905 1.00 0.00 H new ATOM 0 HB ILE A 984 4.800 -11.902 0.085 1.00 0.00 H new ATOM 0 HG12 ILE A 984 4.676 -9.688 1.356 1.00 0.00 H new ATOM 0 HG13 ILE A 984 4.818 -11.161 2.294 1.00 0.00 H new ATOM 0 HG21 ILE A 984 6.667 -12.864 1.394 1.00 0.00 H new ATOM 0 HG22 ILE A 984 7.019 -12.824 -0.350 1.00 0.00 H new ATOM 0 HG23 ILE A 984 7.754 -11.619 0.734 1.00 0.00 H new ATOM 0 HD11 ILE A 984 6.236 -9.396 3.214 1.00 0.00 H new ATOM 0 HD12 ILE A 984 7.231 -10.742 2.611 1.00 0.00 H new ATOM 0 HD13 ILE A 984 7.086 -9.246 1.658 1.00 0.00 H new ATOM 1022 N GLU A 985 8.287 -10.065 -1.264 1.00 0.00 N ATOM 1023 CA GLU A 985 9.534 -9.334 -1.288 1.00 0.00 C ATOM 1024 C GLU A 985 9.483 -8.215 -2.327 1.00 0.00 C ATOM 1025 O GLU A 985 10.024 -7.131 -2.098 1.00 0.00 O ATOM 1026 CB GLU A 985 10.701 -10.276 -1.575 1.00 0.00 C ATOM 1027 CG GLU A 985 10.947 -11.295 -0.475 1.00 0.00 C ATOM 1028 CD GLU A 985 11.463 -10.671 0.804 1.00 0.00 C ATOM 1029 OE1 GLU A 985 10.647 -10.289 1.660 1.00 0.00 O ATOM 1030 OE2 GLU A 985 12.699 -10.581 0.965 1.00 0.00 O ATOM 0 H GLU A 985 8.334 -11.001 -1.667 1.00 0.00 H new ATOM 0 HA GLU A 985 9.686 -8.884 -0.307 1.00 0.00 H new ATOM 0 HB2 GLU A 985 10.510 -10.803 -2.510 1.00 0.00 H new ATOM 0 HB3 GLU A 985 11.606 -9.686 -1.721 1.00 0.00 H new ATOM 0 HG2 GLU A 985 10.019 -11.826 -0.265 1.00 0.00 H new ATOM 0 HG3 GLU A 985 11.665 -12.035 -0.827 1.00 0.00 H new ATOM 1037 N MET A 986 8.814 -8.451 -3.462 1.00 0.00 N ATOM 1038 CA MET A 986 8.802 -7.458 -4.526 1.00 0.00 C ATOM 1039 C MET A 986 8.030 -6.204 -4.092 1.00 0.00 C ATOM 1040 O MET A 986 8.579 -5.106 -4.075 1.00 0.00 O ATOM 1041 CB MET A 986 8.263 -8.033 -5.858 1.00 0.00 C ATOM 1042 CG MET A 986 6.750 -8.008 -6.025 1.00 0.00 C ATOM 1043 SD MET A 986 6.209 -8.516 -7.669 1.00 0.00 S ATOM 1044 CE MET A 986 7.092 -7.351 -8.703 1.00 0.00 C ATOM 0 H MET A 986 8.287 -9.302 -3.659 1.00 0.00 H new ATOM 0 HA MET A 986 9.836 -7.167 -4.714 1.00 0.00 H new ATOM 0 HB2 MET A 986 8.710 -7.475 -6.680 1.00 0.00 H new ATOM 0 HB3 MET A 986 8.603 -9.064 -5.951 1.00 0.00 H new ATOM 0 HG2 MET A 986 6.298 -8.665 -5.282 1.00 0.00 H new ATOM 0 HG3 MET A 986 6.385 -7.001 -5.825 1.00 0.00 H new ATOM 0 HE1 MET A 986 6.477 -7.091 -9.565 1.00 0.00 H new ATOM 0 HE2 MET A 986 7.313 -6.451 -8.130 1.00 0.00 H new ATOM 0 HE3 MET A 986 8.024 -7.801 -9.045 1.00 0.00 H new ATOM 1054 N ALA A 987 6.778 -6.381 -3.692 1.00 0.00 N ATOM 1055 CA ALA A 987 5.906 -5.268 -3.400 1.00 0.00 C ATOM 1056 C ALA A 987 6.127 -4.704 -2.010 1.00 0.00 C ATOM 1057 O ALA A 987 6.085 -3.505 -1.833 1.00 0.00 O ATOM 1058 CB ALA A 987 4.459 -5.659 -3.581 1.00 0.00 C ATOM 0 H ALA A 987 6.347 -7.297 -3.564 1.00 0.00 H new ATOM 0 HA ALA A 987 6.156 -4.481 -4.111 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.820 -4.805 -3.356 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.293 -5.974 -4.611 1.00 0.00 H new ATOM 0 HB3 ALA A 987 4.217 -6.481 -2.907 1.00 0.00 H new ATOM 1064 N GLN A 988 6.346 -5.557 -1.015 1.00 0.00 N ATOM 1065 CA GLN A 988 6.429 -5.066 0.359 1.00 0.00 C ATOM 1066 C GLN A 988 7.673 -4.204 0.549 1.00 0.00 C ATOM 1067 O GLN A 988 7.623 -3.172 1.221 1.00 0.00 O ATOM 1068 CB GLN A 988 6.390 -6.218 1.373 1.00 0.00 C ATOM 1069 CG GLN A 988 6.207 -5.776 2.823 1.00 0.00 C ATOM 1070 CD GLN A 988 7.512 -5.454 3.525 1.00 0.00 C ATOM 1071 OE1 GLN A 988 8.554 -6.028 3.218 1.00 0.00 O ATOM 1072 NE2 GLN A 988 7.462 -4.541 4.481 1.00 0.00 N ATOM 0 H GLN A 988 6.466 -6.564 -1.126 1.00 0.00 H new ATOM 0 HA GLN A 988 5.553 -4.444 0.544 1.00 0.00 H new ATOM 0 HB2 GLN A 988 5.577 -6.893 1.106 1.00 0.00 H new ATOM 0 HB3 GLN A 988 7.316 -6.787 1.294 1.00 0.00 H new ATOM 0 HG2 GLN A 988 5.563 -4.897 2.848 1.00 0.00 H new ATOM 0 HG3 GLN A 988 5.692 -6.564 3.373 1.00 0.00 H new ATOM 0 HE21 GLN A 988 6.577 -4.087 4.706 1.00 0.00 H new ATOM 0 HE22 GLN A 988 8.308 -4.291 4.993 1.00 0.00 H new ATOM 1081 N LYS A 989 8.781 -4.603 -0.065 1.00 0.00 N ATOM 1082 CA LYS A 989 9.988 -3.787 -0.019 1.00 0.00 C ATOM 1083 C LYS A 989 9.800 -2.563 -0.901 1.00 0.00 C ATOM 1084 O LYS A 989 10.420 -1.515 -0.691 1.00 0.00 O ATOM 1085 CB LYS A 989 11.216 -4.584 -0.466 1.00 0.00 C ATOM 1086 CG LYS A 989 11.448 -5.850 0.344 1.00 0.00 C ATOM 1087 CD LYS A 989 11.432 -5.567 1.835 1.00 0.00 C ATOM 1088 CE LYS A 989 11.549 -6.845 2.646 1.00 0.00 C ATOM 1089 NZ LYS A 989 11.280 -6.606 4.087 1.00 0.00 N ATOM 0 H LYS A 989 8.869 -5.472 -0.592 1.00 0.00 H new ATOM 0 HA LYS A 989 10.158 -3.473 1.011 1.00 0.00 H new ATOM 0 HB2 LYS A 989 11.103 -4.851 -1.517 1.00 0.00 H new ATOM 0 HB3 LYS A 989 12.098 -3.948 -0.392 1.00 0.00 H new ATOM 0 HG2 LYS A 989 10.678 -6.583 0.103 1.00 0.00 H new ATOM 0 HG3 LYS A 989 12.406 -6.290 0.066 1.00 0.00 H new ATOM 0 HD2 LYS A 989 12.254 -4.898 2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 989 10.509 -5.051 2.098 1.00 0.00 H new ATOM 0 HE2 LYS A 989 10.847 -7.585 2.262 1.00 0.00 H new ATOM 0 HE3 LYS A 989 12.549 -7.262 2.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 11.484 -7.471 4.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 11.886 -5.834 4.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 10.281 -6.345 4.215 1.00 0.00 H new ATOM 1103 N LEU A 990 8.913 -2.706 -1.873 1.00 0.00 N ATOM 1104 CA LEU A 990 8.554 -1.623 -2.761 1.00 0.00 C ATOM 1105 C LEU A 990 7.691 -0.606 -2.007 1.00 0.00 C ATOM 1106 O LEU A 990 7.924 0.595 -2.099 1.00 0.00 O ATOM 1107 CB LEU A 990 7.843 -2.220 -3.988 1.00 0.00 C ATOM 1108 CG LEU A 990 6.874 -1.320 -4.741 1.00 0.00 C ATOM 1109 CD1 LEU A 990 7.572 -0.070 -5.257 1.00 0.00 C ATOM 1110 CD2 LEU A 990 6.240 -2.081 -5.894 1.00 0.00 C ATOM 0 H LEU A 990 8.423 -3.580 -2.065 1.00 0.00 H new ATOM 0 HA LEU A 990 9.435 -1.086 -3.111 1.00 0.00 H new ATOM 0 HB2 LEU A 990 8.606 -2.555 -4.690 1.00 0.00 H new ATOM 0 HB3 LEU A 990 7.297 -3.106 -3.663 1.00 0.00 H new ATOM 0 HG LEU A 990 6.093 -1.008 -4.047 1.00 0.00 H new ATOM 0 HD11 LEU A 990 6.854 0.553 -5.791 1.00 0.00 H new ATOM 0 HD12 LEU A 990 7.985 0.489 -4.417 1.00 0.00 H new ATOM 0 HD13 LEU A 990 8.378 -0.356 -5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 990 5.549 -1.427 -6.425 1.00 0.00 H new ATOM 0 HD22 LEU A 990 7.018 -2.419 -6.578 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.698 -2.944 -5.506 1.00 0.00 H new ATOM 1122 N LEU A 991 6.767 -1.116 -1.186 1.00 0.00 N ATOM 1123 CA LEU A 991 5.869 -0.278 -0.393 1.00 0.00 C ATOM 1124 C LEU A 991 6.665 0.621 0.519 1.00 0.00 C ATOM 1125 O LEU A 991 6.450 1.825 0.566 1.00 0.00 O ATOM 1126 CB LEU A 991 4.954 -1.127 0.486 1.00 0.00 C ATOM 1127 CG LEU A 991 4.050 -2.106 -0.242 1.00 0.00 C ATOM 1128 CD1 LEU A 991 3.756 -3.293 0.656 1.00 0.00 C ATOM 1129 CD2 LEU A 991 2.748 -1.432 -0.629 1.00 0.00 C ATOM 0 H LEU A 991 6.623 -2.117 -1.055 1.00 0.00 H new ATOM 0 HA LEU A 991 5.273 0.307 -1.094 1.00 0.00 H new ATOM 0 HB2 LEU A 991 5.574 -1.687 1.186 1.00 0.00 H new ATOM 0 HB3 LEU A 991 4.329 -0.458 1.078 1.00 0.00 H new ATOM 0 HG LEU A 991 4.556 -2.446 -1.146 1.00 0.00 H new ATOM 0 HD11 LEU A 991 3.107 -3.994 0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 991 4.690 -3.790 0.919 1.00 0.00 H new ATOM 0 HD13 LEU A 991 3.260 -2.949 1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 991 2.110 -2.146 -1.150 1.00 0.00 H new ATOM 0 HD22 LEU A 991 2.240 -1.079 0.269 1.00 0.00 H new ATOM 0 HD23 LEU A 991 2.957 -0.586 -1.284 1.00 0.00 H new ATOM 1141 N ASN A 992 7.589 0.018 1.252 1.00 0.00 N ATOM 1142 CA ASN A 992 8.412 0.752 2.195 1.00 0.00 C ATOM 1143 C ASN A 992 9.120 1.890 1.483 1.00 0.00 C ATOM 1144 O ASN A 992 9.206 2.995 2.000 1.00 0.00 O ATOM 1145 CB ASN A 992 9.429 -0.186 2.856 1.00 0.00 C ATOM 1146 CG ASN A 992 10.302 0.509 3.886 1.00 0.00 C ATOM 1147 OD1 ASN A 992 11.378 1.013 3.566 1.00 0.00 O ATOM 1148 ND2 ASN A 992 9.850 0.532 5.132 1.00 0.00 N ATOM 0 H ASN A 992 7.786 -0.982 1.210 1.00 0.00 H new ATOM 0 HA ASN A 992 7.774 1.169 2.975 1.00 0.00 H new ATOM 0 HB2 ASN A 992 8.897 -1.008 3.335 1.00 0.00 H new ATOM 0 HB3 ASN A 992 10.065 -0.623 2.086 1.00 0.00 H new ATOM 0 HD21 ASN A 992 10.400 0.979 5.866 1.00 0.00 H new ATOM 0 HD22 ASN A 992 8.952 0.103 5.357 1.00 0.00 H new ATOM 1155 N SER A 993 9.562 1.625 0.264 1.00 0.00 N ATOM 1156 CA SER A 993 10.304 2.605 -0.508 1.00 0.00 C ATOM 1157 C SER A 993 9.439 3.806 -0.915 1.00 0.00 C ATOM 1158 O SER A 993 9.909 4.943 -0.868 1.00 0.00 O ATOM 1159 CB SER A 993 10.903 1.943 -1.750 1.00 0.00 C ATOM 1160 OG SER A 993 11.703 0.824 -1.392 1.00 0.00 O ATOM 0 H SER A 993 9.418 0.735 -0.213 1.00 0.00 H new ATOM 0 HA SER A 993 11.102 2.985 0.129 1.00 0.00 H new ATOM 0 HB2 SER A 993 10.103 1.624 -2.419 1.00 0.00 H new ATOM 0 HB3 SER A 993 11.507 2.667 -2.297 1.00 0.00 H new ATOM 0 HG SER A 993 11.124 0.067 -1.166 1.00 0.00 H new ATOM 1166 N ASP A 994 8.174 3.581 -1.277 1.00 0.00 N ATOM 1167 CA ASP A 994 7.379 4.665 -1.866 1.00 0.00 C ATOM 1168 C ASP A 994 6.217 5.116 -0.977 1.00 0.00 C ATOM 1169 O ASP A 994 5.838 6.286 -1.022 1.00 0.00 O ATOM 1170 CB ASP A 994 6.907 4.315 -3.276 1.00 0.00 C ATOM 1171 CG ASP A 994 7.975 4.586 -4.322 1.00 0.00 C ATOM 1172 OD1 ASP A 994 9.016 3.892 -4.326 1.00 0.00 O ATOM 1173 OD2 ASP A 994 7.796 5.521 -5.136 1.00 0.00 O ATOM 0 H ASP A 994 7.689 2.689 -1.178 1.00 0.00 H new ATOM 0 HA ASP A 994 8.049 5.522 -1.941 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.624 3.263 -3.312 1.00 0.00 H new ATOM 0 HB3 ASP A 994 6.014 4.893 -3.513 1.00 0.00 H new ATOM 1178 N LEU A 995 5.649 4.223 -0.168 1.00 0.00 N ATOM 1179 CA LEU A 995 4.738 4.660 0.895 1.00 0.00 C ATOM 1180 C LEU A 995 5.478 5.665 1.764 1.00 0.00 C ATOM 1181 O LEU A 995 4.996 6.769 2.020 1.00 0.00 O ATOM 1182 CB LEU A 995 4.246 3.490 1.776 1.00 0.00 C ATOM 1183 CG LEU A 995 2.973 2.764 1.324 1.00 0.00 C ATOM 1184 CD1 LEU A 995 1.756 3.660 1.484 1.00 0.00 C ATOM 1185 CD2 LEU A 995 3.096 2.276 -0.111 1.00 0.00 C ATOM 0 H LEU A 995 5.797 3.215 -0.223 1.00 0.00 H new ATOM 0 HA LEU A 995 3.856 5.101 0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 995 5.049 2.756 1.843 1.00 0.00 H new ATOM 0 HB3 LEU A 995 4.079 3.872 2.783 1.00 0.00 H new ATOM 0 HG LEU A 995 2.843 1.891 1.964 1.00 0.00 H new ATOM 0 HD11 LEU A 995 0.865 3.125 1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 995 1.647 3.942 2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 995 1.883 4.557 0.878 1.00 0.00 H new ATOM 0 HD21 LEU A 995 2.178 1.766 -0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 995 3.263 3.127 -0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 995 3.936 1.585 -0.190 1.00 0.00 H new ATOM 1197 N ALA A 996 6.670 5.261 2.197 1.00 0.00 N ATOM 1198 CA ALA A 996 7.544 6.153 2.937 1.00 0.00 C ATOM 1199 C ALA A 996 7.904 7.366 2.097 1.00 0.00 C ATOM 1200 O ALA A 996 7.859 8.483 2.585 1.00 0.00 O ATOM 1201 CB ALA A 996 8.796 5.445 3.418 1.00 0.00 C ATOM 0 H ALA A 996 7.047 4.325 2.047 1.00 0.00 H new ATOM 0 HA ALA A 996 6.999 6.488 3.820 1.00 0.00 H new ATOM 0 HB1 ALA A 996 9.423 6.147 3.967 1.00 0.00 H new ATOM 0 HB2 ALA A 996 8.518 4.619 4.072 1.00 0.00 H new ATOM 0 HB3 ALA A 996 9.348 5.059 2.561 1.00 0.00 H new ATOM 1207 N GLU A 997 8.239 7.159 0.831 1.00 0.00 N ATOM 1208 CA GLU A 997 8.578 8.277 -0.043 1.00 0.00 C ATOM 1209 C GLU A 997 7.493 9.345 -0.008 1.00 0.00 C ATOM 1210 O GLU A 997 7.784 10.536 0.089 1.00 0.00 O ATOM 1211 CB GLU A 997 8.753 7.803 -1.479 1.00 0.00 C ATOM 1212 CG GLU A 997 9.113 8.915 -2.439 1.00 0.00 C ATOM 1213 CD GLU A 997 10.579 9.278 -2.391 1.00 0.00 C ATOM 1214 OE1 GLU A 997 11.384 8.576 -3.031 1.00 0.00 O ATOM 1215 OE2 GLU A 997 10.931 10.269 -1.723 1.00 0.00 O ATOM 0 H GLU A 997 8.284 6.241 0.389 1.00 0.00 H new ATOM 0 HA GLU A 997 9.514 8.702 0.319 1.00 0.00 H new ATOM 0 HB2 GLU A 997 9.531 7.040 -1.510 1.00 0.00 H new ATOM 0 HB3 GLU A 997 7.830 7.330 -1.813 1.00 0.00 H new ATOM 0 HG2 GLU A 997 8.851 8.612 -3.453 1.00 0.00 H new ATOM 0 HG3 GLU A 997 8.517 9.797 -2.206 1.00 0.00 H new ATOM 1222 N LEU A 998 6.245 8.912 -0.043 1.00 0.00 N ATOM 1223 CA LEU A 998 5.128 9.834 -0.114 1.00 0.00 C ATOM 1224 C LEU A 998 4.941 10.582 1.187 1.00 0.00 C ATOM 1225 O LEU A 998 4.539 11.743 1.175 1.00 0.00 O ATOM 1226 CB LEU A 998 3.844 9.111 -0.501 1.00 0.00 C ATOM 1227 CG LEU A 998 3.525 9.135 -1.994 1.00 0.00 C ATOM 1228 CD1 LEU A 998 3.235 10.559 -2.445 1.00 0.00 C ATOM 1229 CD2 LEU A 998 4.675 8.549 -2.794 1.00 0.00 C ATOM 0 H LEU A 998 5.981 7.927 -0.023 1.00 0.00 H new ATOM 0 HA LEU A 998 5.360 10.563 -0.890 1.00 0.00 H new ATOM 0 HB2 LEU A 998 3.915 8.073 -0.175 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.012 9.560 0.042 1.00 0.00 H new ATOM 0 HG LEU A 998 2.639 8.525 -2.171 1.00 0.00 H new ATOM 0 HD11 LEU A 998 3.009 10.564 -3.511 1.00 0.00 H new ATOM 0 HD12 LEU A 998 2.381 10.949 -1.891 1.00 0.00 H new ATOM 0 HD13 LEU A 998 4.107 11.185 -2.256 1.00 0.00 H new ATOM 0 HD21 LEU A 998 4.430 8.574 -3.856 1.00 0.00 H new ATOM 0 HD22 LEU A 998 5.577 9.134 -2.616 1.00 0.00 H new ATOM 0 HD23 LEU A 998 4.845 7.517 -2.485 1.00 0.00 H new ATOM 1241 N ILE A 999 5.239 9.941 2.309 1.00 0.00 N ATOM 1242 CA ILE A 999 5.136 10.635 3.594 1.00 0.00 C ATOM 1243 C ILE A 999 6.112 11.805 3.637 1.00 0.00 C ATOM 1244 O ILE A 999 5.900 12.771 4.360 1.00 0.00 O ATOM 1245 CB ILE A 999 5.349 9.721 4.831 1.00 0.00 C ATOM 1246 CG1 ILE A 999 6.831 9.436 5.076 1.00 0.00 C ATOM 1247 CG2 ILE A 999 4.577 8.419 4.667 1.00 0.00 C ATOM 1248 CD1 ILE A 999 7.101 8.617 6.321 1.00 0.00 C ATOM 0 H ILE A 999 5.546 8.970 2.362 1.00 0.00 H new ATOM 0 HA ILE A 999 4.108 10.993 3.658 1.00 0.00 H new ATOM 0 HB ILE A 999 4.968 10.252 5.703 1.00 0.00 H new ATOM 0 HG12 ILE A 999 7.237 8.910 4.212 1.00 0.00 H new ATOM 0 HG13 ILE A 999 7.365 10.383 5.153 1.00 0.00 H new ATOM 0 HG21 ILE A 999 4.736 7.789 5.542 1.00 0.00 H new ATOM 0 HG22 ILE A 999 3.514 8.637 4.565 1.00 0.00 H new ATOM 0 HG23 ILE A 999 4.927 7.898 3.776 1.00 0.00 H new ATOM 0 HD11 ILE A 999 8.174 8.457 6.426 1.00 0.00 H new ATOM 0 HD12 ILE A 999 6.727 9.150 7.195 1.00 0.00 H new ATOM 0 HD13 ILE A 999 6.597 7.654 6.239 1.00 0.00 H new ATOM 1260 N ASN A1000 7.163 11.722 2.822 1.00 0.00 N ATOM 1261 CA ASN A1000 8.137 12.805 2.695 1.00 0.00 C ATOM 1262 C ASN A1000 7.778 13.697 1.532 1.00 0.00 C ATOM 1263 O ASN A1000 8.371 14.742 1.371 1.00 0.00 O ATOM 1264 CB ASN A1000 9.549 12.267 2.453 1.00 0.00 C ATOM 1265 CG ASN A1000 10.055 11.362 3.549 1.00 0.00 C ATOM 1266 OD1 ASN A1000 10.770 11.792 4.455 1.00 0.00 O ATOM 1267 ND2 ASN A1000 9.659 10.110 3.483 1.00 0.00 N ATOM 0 H ASN A1000 7.362 10.911 2.237 1.00 0.00 H new ATOM 0 HA ASN A1000 8.116 13.362 3.631 1.00 0.00 H new ATOM 0 HB2 ASN A1000 9.562 11.721 1.510 1.00 0.00 H new ATOM 0 HB3 ASN A1000 10.234 13.108 2.345 1.00 0.00 H new ATOM 0 HD21 ASN A1000 9.944 9.446 4.203 1.00 0.00 H new ATOM 0 HD22 ASN A1000 9.067 9.802 2.712 1.00 0.00 H new ATOM 1274 N LYS A1001 6.826 13.273 0.715 1.00 0.00 N ATOM 1275 CA LYS A1001 6.371 14.087 -0.408 1.00 0.00 C ATOM 1276 C LYS A1001 5.340 15.085 0.083 1.00 0.00 C ATOM 1277 O LYS A1001 5.330 16.243 -0.327 1.00 0.00 O ATOM 1278 CB LYS A1001 5.772 13.232 -1.526 1.00 0.00 C ATOM 1279 CG LYS A1001 6.767 12.305 -2.208 1.00 0.00 C ATOM 1280 CD LYS A1001 7.983 13.057 -2.734 1.00 0.00 C ATOM 1281 CE LYS A1001 8.879 12.142 -3.548 1.00 0.00 C ATOM 1282 NZ LYS A1001 10.153 12.800 -3.939 1.00 0.00 N ATOM 0 H LYS A1001 6.353 12.374 0.806 1.00 0.00 H new ATOM 0 HA LYS A1001 7.235 14.608 -0.820 1.00 0.00 H new ATOM 0 HB2 LYS A1001 4.960 12.634 -1.114 1.00 0.00 H new ATOM 0 HB3 LYS A1001 5.334 13.891 -2.276 1.00 0.00 H new ATOM 0 HG2 LYS A1001 7.092 11.540 -1.503 1.00 0.00 H new ATOM 0 HG3 LYS A1001 6.275 11.790 -3.033 1.00 0.00 H new ATOM 0 HD2 LYS A1001 7.658 13.895 -3.350 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.546 13.474 -1.899 1.00 0.00 H new ATOM 0 HE2 LYS A1001 9.099 11.245 -2.970 1.00 0.00 H new ATOM 0 HE3 LYS A1001 8.348 11.821 -4.445 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 10.731 12.136 -4.493 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 9.947 13.642 -4.513 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 10.674 13.083 -3.085 1.00 0.00 H new ATOM 1296 N MET A1002 4.476 14.624 0.973 1.00 0.00 N ATOM 1297 CA MET A1002 3.516 15.485 1.620 1.00 0.00 C ATOM 1298 C MET A1002 4.263 16.379 2.579 1.00 0.00 C ATOM 1299 O MET A1002 4.032 17.584 2.652 1.00 0.00 O ATOM 1300 CB MET A1002 2.519 14.642 2.389 1.00 0.00 C ATOM 1301 CG MET A1002 2.128 13.362 1.682 1.00 0.00 C ATOM 1302 SD MET A1002 1.187 13.631 0.174 1.00 0.00 S ATOM 1303 CE MET A1002 0.709 11.951 -0.223 1.00 0.00 C ATOM 0 H MET A1002 4.425 13.647 1.262 1.00 0.00 H new ATOM 0 HA MET A1002 2.981 16.082 0.881 1.00 0.00 H new ATOM 0 HB2 MET A1002 2.942 14.394 3.363 1.00 0.00 H new ATOM 0 HB3 MET A1002 1.622 15.234 2.572 1.00 0.00 H new ATOM 0 HG2 MET A1002 3.030 12.799 1.442 1.00 0.00 H new ATOM 0 HG3 MET A1002 1.540 12.746 2.362 1.00 0.00 H new ATOM 0 HE1 MET A1002 0.560 11.860 -1.299 1.00 0.00 H new ATOM 0 HE2 MET A1002 1.494 11.265 0.094 1.00 0.00 H new ATOM 0 HE3 MET A1002 -0.218 11.705 0.294 1.00 0.00 H new ATOM 1313 N LYS A1003 5.177 15.750 3.305 1.00 0.00 N ATOM 1314 CA LYS A1003 6.086 16.448 4.182 1.00 0.00 C ATOM 1315 C LYS A1003 6.880 17.468 3.381 1.00 0.00 C ATOM 1316 O LYS A1003 7.056 18.581 3.824 1.00 0.00 O ATOM 1317 CB LYS A1003 7.013 15.433 4.851 1.00 0.00 C ATOM 1318 CG LYS A1003 7.990 16.011 5.856 1.00 0.00 C ATOM 1319 CD LYS A1003 8.696 14.895 6.609 1.00 0.00 C ATOM 1320 CE LYS A1003 9.740 15.428 7.576 1.00 0.00 C ATOM 1321 NZ LYS A1003 10.338 14.336 8.391 1.00 0.00 N ATOM 0 H LYS A1003 5.303 14.738 3.297 1.00 0.00 H new ATOM 0 HA LYS A1003 5.532 16.978 4.957 1.00 0.00 H new ATOM 0 HB2 LYS A1003 6.402 14.683 5.353 1.00 0.00 H new ATOM 0 HB3 LYS A1003 7.578 14.916 4.076 1.00 0.00 H new ATOM 0 HG2 LYS A1003 8.723 16.633 5.343 1.00 0.00 H new ATOM 0 HG3 LYS A1003 7.461 16.655 6.559 1.00 0.00 H new ATOM 0 HD2 LYS A1003 7.960 14.307 7.158 1.00 0.00 H new ATOM 0 HD3 LYS A1003 9.173 14.223 5.896 1.00 0.00 H new ATOM 0 HE2 LYS A1003 10.525 15.939 7.019 1.00 0.00 H new ATOM 0 HE3 LYS A1003 9.283 16.167 8.235 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 11.046 14.735 9.040 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 9.592 13.864 8.941 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 10.795 13.644 7.763 1.00 0.00 H new ATOM 1335 N LEU A1004 7.385 17.048 2.225 1.00 0.00 N ATOM 1336 CA LEU A1004 8.046 17.936 1.260 1.00 0.00 C ATOM 1337 C LEU A1004 7.171 19.117 0.846 1.00 0.00 C ATOM 1338 O LEU A1004 7.602 20.263 0.911 1.00 0.00 O ATOM 1339 CB LEU A1004 8.409 17.136 0.016 1.00 0.00 C ATOM 1340 CG LEU A1004 9.443 17.773 -0.912 1.00 0.00 C ATOM 1341 CD1 LEU A1004 10.778 17.927 -0.200 1.00 0.00 C ATOM 1342 CD2 LEU A1004 9.605 16.943 -2.178 1.00 0.00 C ATOM 0 H LEU A1004 7.349 16.074 1.924 1.00 0.00 H new ATOM 0 HA LEU A1004 8.934 18.339 1.747 1.00 0.00 H new ATOM 0 HB2 LEU A1004 8.784 16.162 0.331 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.498 16.957 -0.556 1.00 0.00 H new ATOM 0 HG LEU A1004 9.088 18.765 -1.193 1.00 0.00 H new ATOM 0 HD11 LEU A1004 11.501 18.382 -0.877 1.00 0.00 H new ATOM 0 HD12 LEU A1004 10.652 18.562 0.677 1.00 0.00 H new ATOM 0 HD13 LEU A1004 11.140 16.947 0.111 1.00 0.00 H new ATOM 0 HD21 LEU A1004 10.345 17.411 -2.828 1.00 0.00 H new ATOM 0 HD22 LEU A1004 9.937 15.939 -1.915 1.00 0.00 H new ATOM 0 HD23 LEU A1004 8.650 16.885 -2.699 1.00 0.00 H new ATOM 1354 N ALA A1005 5.961 18.838 0.388 1.00 0.00 N ATOM 1355 CA ALA A1005 5.058 19.894 -0.052 1.00 0.00 C ATOM 1356 C ALA A1005 4.762 20.856 1.091 1.00 0.00 C ATOM 1357 O ALA A1005 4.756 22.075 0.911 1.00 0.00 O ATOM 1358 CB ALA A1005 3.772 19.302 -0.603 1.00 0.00 C ATOM 0 H ALA A1005 5.581 17.895 0.311 1.00 0.00 H new ATOM 0 HA ALA A1005 5.546 20.453 -0.851 1.00 0.00 H new ATOM 0 HB1 ALA A1005 3.111 20.106 -0.926 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.002 18.658 -1.452 1.00 0.00 H new ATOM 0 HB3 ALA A1005 3.279 18.717 0.173 1.00 0.00 H new ATOM 1364 N GLN A1006 4.552 20.293 2.271 1.00 0.00 N ATOM 1365 CA GLN A1006 4.298 21.078 3.467 1.00 0.00 C ATOM 1366 C GLN A1006 5.612 21.690 3.968 1.00 0.00 C ATOM 1367 O GLN A1006 5.620 22.648 4.737 1.00 0.00 O ATOM 1368 CB GLN A1006 3.635 20.180 4.526 1.00 0.00 C ATOM 1369 CG GLN A1006 4.591 19.499 5.499 1.00 0.00 C ATOM 1370 CD GLN A1006 4.830 20.312 6.760 1.00 0.00 C ATOM 1371 OE1 GLN A1006 3.959 21.059 7.209 1.00 0.00 O ATOM 1372 NE2 GLN A1006 6.011 20.168 7.338 1.00 0.00 N ATOM 0 H GLN A1006 4.553 19.285 2.425 1.00 0.00 H new ATOM 0 HA GLN A1006 3.616 21.900 3.249 1.00 0.00 H new ATOM 0 HB2 GLN A1006 2.930 20.783 5.098 1.00 0.00 H new ATOM 0 HB3 GLN A1006 3.056 19.411 4.015 1.00 0.00 H new ATOM 0 HG2 GLN A1006 4.189 18.523 5.773 1.00 0.00 H new ATOM 0 HG3 GLN A1006 5.544 19.323 5.000 1.00 0.00 H new ATOM 0 HE21 GLN A1006 6.704 19.539 6.933 1.00 0.00 H new ATOM 0 HE22 GLN A1006 6.229 20.686 8.189 1.00 0.00 H new ATOM 1381 N GLN A1007 6.718 21.123 3.499 1.00 0.00 N ATOM 1382 CA GLN A1007 8.057 21.589 3.837 1.00 0.00 C ATOM 1383 C GLN A1007 8.359 22.858 3.061 1.00 0.00 C ATOM 1384 O GLN A1007 8.943 23.807 3.583 1.00 0.00 O ATOM 1385 CB GLN A1007 9.081 20.499 3.485 1.00 0.00 C ATOM 1386 CG GLN A1007 10.347 20.526 4.313 1.00 0.00 C ATOM 1387 CD GLN A1007 10.084 20.210 5.771 1.00 0.00 C ATOM 1388 OE1 GLN A1007 10.787 20.688 6.661 1.00 0.00 O ATOM 1389 NE2 GLN A1007 9.066 19.397 6.027 1.00 0.00 N ATOM 0 H GLN A1007 6.710 20.321 2.869 1.00 0.00 H new ATOM 0 HA GLN A1007 8.115 21.801 4.905 1.00 0.00 H new ATOM 0 HB2 GLN A1007 8.608 19.524 3.602 1.00 0.00 H new ATOM 0 HB3 GLN A1007 9.349 20.598 2.433 1.00 0.00 H new ATOM 0 HG2 GLN A1007 11.058 19.806 3.909 1.00 0.00 H new ATOM 0 HG3 GLN A1007 10.810 21.510 4.234 1.00 0.00 H new ATOM 0 HE21 GLN A1007 8.508 19.022 5.260 1.00 0.00 H new ATOM 0 HE22 GLN A1007 8.842 19.147 6.990 1.00 0.00 H new ATOM 1398 N TYR A1008 7.949 22.850 1.803 1.00 0.00 N ATOM 1399 CA TYR A1008 8.085 24.002 0.932 1.00 0.00 C ATOM 1400 C TYR A1008 7.110 25.085 1.372 1.00 0.00 C ATOM 1401 O TYR A1008 7.510 26.217 1.638 1.00 0.00 O ATOM 1402 CB TYR A1008 7.788 23.583 -0.510 1.00 0.00 C ATOM 1403 CG TYR A1008 8.284 24.542 -1.570 1.00 0.00 C ATOM 1404 CD1 TYR A1008 9.012 25.677 -1.236 1.00 0.00 C ATOM 1405 CD2 TYR A1008 8.031 24.295 -2.912 1.00 0.00 C ATOM 1406 CE1 TYR A1008 9.470 26.538 -2.210 1.00 0.00 C ATOM 1407 CE2 TYR A1008 8.490 25.150 -3.894 1.00 0.00 C ATOM 1408 CZ TYR A1008 9.209 26.270 -3.536 1.00 0.00 C ATOM 1409 OH TYR A1008 9.673 27.128 -4.505 1.00 0.00 O ATOM 0 H TYR A1008 7.512 22.043 1.358 1.00 0.00 H new ATOM 0 HA TYR A1008 9.101 24.392 0.990 1.00 0.00 H new ATOM 0 HB2 TYR A1008 8.236 22.605 -0.688 1.00 0.00 H new ATOM 0 HB3 TYR A1008 6.710 23.465 -0.624 1.00 0.00 H new ATOM 0 HD1 TYR A1008 9.222 25.888 -0.198 1.00 0.00 H new ATOM 0 HD2 TYR A1008 7.465 23.419 -3.193 1.00 0.00 H new ATOM 0 HE1 TYR A1008 10.031 27.419 -1.935 1.00 0.00 H new ATOM 0 HE2 TYR A1008 8.287 24.943 -4.934 1.00 0.00 H new ATOM 0 HH TYR A1008 9.407 26.798 -5.389 1.00 0.00 H new ATOM 1419 N VAL A1009 5.834 24.691 1.449 1.00 0.00 N ATOM 1420 CA VAL A1009 4.721 25.556 1.857 1.00 0.00 C ATOM 1421 C VAL A1009 4.898 27.017 1.409 1.00 0.00 C ATOM 1422 O VAL A1009 5.304 27.897 2.175 1.00 0.00 O ATOM 1423 CB VAL A1009 4.428 25.458 3.384 1.00 0.00 C ATOM 1424 CG1 VAL A1009 5.626 25.874 4.232 1.00 0.00 C ATOM 1425 CG2 VAL A1009 3.194 26.271 3.751 1.00 0.00 C ATOM 0 H VAL A1009 5.540 23.741 1.224 1.00 0.00 H new ATOM 0 HA VAL A1009 3.845 25.176 1.332 1.00 0.00 H new ATOM 0 HB VAL A1009 4.231 24.409 3.605 1.00 0.00 H new ATOM 0 HG11 VAL A1009 5.371 25.788 5.288 1.00 0.00 H new ATOM 0 HG12 VAL A1009 6.473 25.225 4.009 1.00 0.00 H new ATOM 0 HG13 VAL A1009 5.891 26.907 4.005 1.00 0.00 H new ATOM 0 HG21 VAL A1009 3.009 26.188 4.822 1.00 0.00 H new ATOM 0 HG22 VAL A1009 3.357 27.317 3.491 1.00 0.00 H new ATOM 0 HG23 VAL A1009 2.332 25.891 3.203 1.00 0.00 H new ATOM 1435 N MET A1010 4.616 27.255 0.143 1.00 0.00 N ATOM 1436 CA MET A1010 4.667 28.593 -0.415 1.00 0.00 C ATOM 1437 C MET A1010 3.431 28.794 -1.275 1.00 0.00 C ATOM 1438 O MET A1010 3.198 28.015 -2.192 1.00 0.00 O ATOM 1439 CB MET A1010 5.943 28.781 -1.238 1.00 0.00 C ATOM 1440 CG MET A1010 6.243 30.228 -1.588 1.00 0.00 C ATOM 1441 SD MET A1010 7.800 30.415 -2.481 1.00 0.00 S ATOM 1442 CE MET A1010 7.925 32.201 -2.567 1.00 0.00 C ATOM 0 H MET A1010 4.347 26.532 -0.524 1.00 0.00 H new ATOM 0 HA MET A1010 4.683 29.334 0.384 1.00 0.00 H new ATOM 0 HB2 MET A1010 6.786 28.370 -0.682 1.00 0.00 H new ATOM 0 HB3 MET A1010 5.857 28.205 -2.159 1.00 0.00 H new ATOM 0 HG2 MET A1010 5.430 30.628 -2.194 1.00 0.00 H new ATOM 0 HG3 MET A1010 6.279 30.820 -0.673 1.00 0.00 H new ATOM 0 HE1 MET A1010 8.839 32.477 -3.093 1.00 0.00 H new ATOM 0 HE2 MET A1010 7.064 32.601 -3.102 1.00 0.00 H new ATOM 0 HE3 MET A1010 7.948 32.613 -1.558 1.00 0.00 H new ATOM 1452 N THR A1011 2.665 29.837 -0.978 1.00 0.00 N ATOM 1453 CA THR A1011 1.310 30.017 -1.517 1.00 0.00 C ATOM 1454 C THR A1011 1.167 29.601 -2.992 1.00 0.00 C ATOM 1455 O THR A1011 0.262 28.839 -3.331 1.00 0.00 O ATOM 1456 CB THR A1011 0.819 31.476 -1.314 1.00 0.00 C ATOM 1457 OG1 THR A1011 -0.517 31.634 -1.816 1.00 0.00 O ATOM 1458 CG2 THR A1011 1.743 32.483 -1.988 1.00 0.00 C ATOM 0 H THR A1011 2.962 30.588 -0.355 1.00 0.00 H new ATOM 0 HA THR A1011 0.675 29.340 -0.946 1.00 0.00 H new ATOM 0 HB THR A1011 0.828 31.672 -0.242 1.00 0.00 H new ATOM 0 HG1 THR A1011 -0.811 32.559 -1.679 1.00 0.00 H new ATOM 0 HG21 THR A1011 1.364 33.492 -1.823 1.00 0.00 H new ATOM 0 HG22 THR A1011 2.744 32.397 -1.566 1.00 0.00 H new ATOM 0 HG23 THR A1011 1.782 32.281 -3.058 1.00 0.00 H new ATOM 1466 N SER A1012 2.053 30.062 -3.864 1.00 0.00 N ATOM 1467 CA SER A1012 1.932 29.737 -5.277 1.00 0.00 C ATOM 1468 C SER A1012 2.870 28.595 -5.675 1.00 0.00 C ATOM 1469 O SER A1012 2.517 27.742 -6.492 1.00 0.00 O ATOM 1470 CB SER A1012 2.218 30.973 -6.133 1.00 0.00 C ATOM 1471 OG SER A1012 1.765 30.783 -7.463 1.00 0.00 O ATOM 0 H SER A1012 2.850 30.652 -3.624 1.00 0.00 H new ATOM 0 HA SER A1012 0.908 29.407 -5.453 1.00 0.00 H new ATOM 0 HB2 SER A1012 1.727 31.843 -5.698 1.00 0.00 H new ATOM 0 HB3 SER A1012 3.288 31.179 -6.135 1.00 0.00 H new ATOM 0 HG SER A1012 1.957 31.586 -7.992 1.00 0.00 H new ATOM 1477 N LEU A1013 4.048 28.561 -5.068 1.00 0.00 N ATOM 1478 CA LEU A1013 5.105 27.644 -5.493 1.00 0.00 C ATOM 1479 C LEU A1013 4.966 26.262 -4.858 1.00 0.00 C ATOM 1480 O LEU A1013 5.659 25.324 -5.245 1.00 0.00 O ATOM 1481 CB LEU A1013 6.489 28.226 -5.175 1.00 0.00 C ATOM 1482 CG LEU A1013 6.942 29.397 -6.059 1.00 0.00 C ATOM 1483 CD1 LEU A1013 6.813 29.038 -7.530 1.00 0.00 C ATOM 1484 CD2 LEU A1013 6.158 30.664 -5.745 1.00 0.00 C ATOM 0 H LEU A1013 4.299 29.157 -4.279 1.00 0.00 H new ATOM 0 HA LEU A1013 5.001 27.524 -6.571 1.00 0.00 H new ATOM 0 HB2 LEU A1013 6.493 28.557 -4.136 1.00 0.00 H new ATOM 0 HB3 LEU A1013 7.226 27.427 -5.258 1.00 0.00 H new ATOM 0 HG LEU A1013 7.992 29.593 -5.841 1.00 0.00 H new ATOM 0 HD11 LEU A1013 7.139 29.881 -8.140 1.00 0.00 H new ATOM 0 HD12 LEU A1013 7.435 28.170 -7.749 1.00 0.00 H new ATOM 0 HD13 LEU A1013 5.773 28.806 -7.758 1.00 0.00 H new ATOM 0 HD21 LEU A1013 6.503 31.474 -6.388 1.00 0.00 H new ATOM 0 HD22 LEU A1013 5.097 30.488 -5.921 1.00 0.00 H new ATOM 0 HD23 LEU A1013 6.312 30.938 -4.701 1.00 0.00 H new ATOM 1496 N GLN A1014 4.072 26.135 -3.889 1.00 0.00 N ATOM 1497 CA GLN A1014 3.850 24.859 -3.215 1.00 0.00 C ATOM 1498 C GLN A1014 3.310 23.832 -4.202 1.00 0.00 C ATOM 1499 O GLN A1014 3.596 22.641 -4.091 1.00 0.00 O ATOM 1500 CB GLN A1014 2.882 25.047 -2.035 1.00 0.00 C ATOM 1501 CG GLN A1014 2.743 23.839 -1.118 1.00 0.00 C ATOM 1502 CD GLN A1014 1.543 22.977 -1.458 1.00 0.00 C ATOM 1503 OE1 GLN A1014 0.442 23.205 -0.968 1.00 0.00 O ATOM 1504 NE2 GLN A1014 1.747 21.977 -2.290 1.00 0.00 N ATOM 0 H GLN A1014 3.487 26.899 -3.550 1.00 0.00 H new ATOM 0 HA GLN A1014 4.799 24.492 -2.825 1.00 0.00 H new ATOM 0 HB2 GLN A1014 3.217 25.898 -1.442 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.898 25.301 -2.429 1.00 0.00 H new ATOM 0 HG2 GLN A1014 3.648 23.235 -1.181 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.659 24.180 -0.086 1.00 0.00 H new ATOM 0 HE21 GLN A1014 2.677 21.818 -2.678 1.00 0.00 H new ATOM 0 HE22 GLN A1014 0.975 21.361 -2.547 1.00 0.00 H new ATOM 1513 N GLN A1015 2.563 24.313 -5.190 1.00 0.00 N ATOM 1514 CA GLN A1015 1.925 23.444 -6.172 1.00 0.00 C ATOM 1515 C GLN A1015 2.951 22.647 -6.974 1.00 0.00 C ATOM 1516 O GLN A1015 2.677 21.526 -7.381 1.00 0.00 O ATOM 1517 CB GLN A1015 1.012 24.248 -7.100 1.00 0.00 C ATOM 1518 CG GLN A1015 -0.413 24.377 -6.579 1.00 0.00 C ATOM 1519 CD GLN A1015 -0.522 25.194 -5.303 1.00 0.00 C ATOM 1520 OE1 GLN A1015 -1.357 24.911 -4.446 1.00 0.00 O ATOM 1521 NE2 GLN A1015 0.285 26.240 -5.185 1.00 0.00 N ATOM 0 H GLN A1015 2.384 25.307 -5.332 1.00 0.00 H new ATOM 0 HA GLN A1015 1.312 22.728 -5.624 1.00 0.00 H new ATOM 0 HB2 GLN A1015 1.432 25.244 -7.238 1.00 0.00 H new ATOM 0 HB3 GLN A1015 0.991 23.772 -8.080 1.00 0.00 H new ATOM 0 HG2 GLN A1015 -1.032 24.837 -7.349 1.00 0.00 H new ATOM 0 HG3 GLN A1015 -0.817 23.381 -6.398 1.00 0.00 H new ATOM 0 HE21 GLN A1015 0.966 26.444 -5.917 1.00 0.00 H new ATOM 0 HE22 GLN A1015 0.225 26.840 -4.363 1.00 0.00 H new ATOM 1530 N GLU A1016 4.114 23.237 -7.223 1.00 0.00 N ATOM 1531 CA GLU A1016 5.242 22.484 -7.771 1.00 0.00 C ATOM 1532 C GLU A1016 5.490 21.198 -6.975 1.00 0.00 C ATOM 1533 O GLU A1016 5.606 20.116 -7.550 1.00 0.00 O ATOM 1534 CB GLU A1016 6.506 23.347 -7.785 1.00 0.00 C ATOM 1535 CG GLU A1016 7.743 22.591 -8.237 1.00 0.00 C ATOM 1536 CD GLU A1016 8.912 23.499 -8.534 1.00 0.00 C ATOM 1537 OE1 GLU A1016 9.693 23.801 -7.610 1.00 0.00 O ATOM 1538 OE2 GLU A1016 9.059 23.916 -9.707 1.00 0.00 O ATOM 0 H GLU A1016 4.303 24.226 -7.057 1.00 0.00 H new ATOM 0 HA GLU A1016 4.991 22.207 -8.795 1.00 0.00 H new ATOM 0 HB2 GLU A1016 6.348 24.200 -8.445 1.00 0.00 H new ATOM 0 HB3 GLU A1016 6.677 23.745 -6.785 1.00 0.00 H new ATOM 0 HG2 GLU A1016 8.030 21.879 -7.463 1.00 0.00 H new ATOM 0 HG3 GLU A1016 7.503 22.013 -9.129 1.00 0.00 H new ATOM 1545 N TYR A1017 5.525 21.311 -5.653 1.00 0.00 N ATOM 1546 CA TYR A1017 5.722 20.145 -4.797 1.00 0.00 C ATOM 1547 C TYR A1017 4.437 19.323 -4.708 1.00 0.00 C ATOM 1548 O TYR A1017 4.464 18.127 -4.418 1.00 0.00 O ATOM 1549 CB TYR A1017 6.195 20.567 -3.398 1.00 0.00 C ATOM 1550 CG TYR A1017 7.693 20.792 -3.299 1.00 0.00 C ATOM 1551 CD1 TYR A1017 8.461 21.033 -4.433 1.00 0.00 C ATOM 1552 CD2 TYR A1017 8.338 20.749 -2.069 1.00 0.00 C ATOM 1553 CE1 TYR A1017 9.826 21.223 -4.343 1.00 0.00 C ATOM 1554 CE2 TYR A1017 9.702 20.943 -1.973 1.00 0.00 C ATOM 1555 CZ TYR A1017 10.441 21.176 -3.111 1.00 0.00 C ATOM 1556 OH TYR A1017 11.801 21.360 -3.015 1.00 0.00 O ATOM 0 H TYR A1017 5.420 22.193 -5.151 1.00 0.00 H new ATOM 0 HA TYR A1017 6.498 19.523 -5.242 1.00 0.00 H new ATOM 0 HB2 TYR A1017 5.680 21.484 -3.112 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.904 19.800 -2.680 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.982 21.072 -5.400 1.00 0.00 H new ATOM 0 HD2 TYR A1017 7.764 20.561 -1.174 1.00 0.00 H new ATOM 0 HE1 TYR A1017 10.408 21.407 -5.234 1.00 0.00 H new ATOM 0 HE2 TYR A1017 10.187 20.912 -1.009 1.00 0.00 H new ATOM 0 HH TYR A1017 12.074 21.297 -2.076 1.00 0.00 H new ATOM 1566 N LYS A1018 3.317 19.974 -4.986 1.00 0.00 N ATOM 1567 CA LYS A1018 2.014 19.318 -4.988 1.00 0.00 C ATOM 1568 C LYS A1018 1.880 18.416 -6.215 1.00 0.00 C ATOM 1569 O LYS A1018 1.396 17.289 -6.127 1.00 0.00 O ATOM 1570 CB LYS A1018 0.910 20.383 -4.966 1.00 0.00 C ATOM 1571 CG LYS A1018 -0.502 19.831 -4.934 1.00 0.00 C ATOM 1572 CD LYS A1018 -1.489 20.877 -4.440 1.00 0.00 C ATOM 1573 CE LYS A1018 -2.888 20.301 -4.310 1.00 0.00 C ATOM 1574 NZ LYS A1018 -3.830 21.252 -3.655 1.00 0.00 N ATOM 0 H LYS A1018 3.283 20.967 -5.216 1.00 0.00 H new ATOM 0 HA LYS A1018 1.917 18.693 -4.100 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.056 21.020 -4.094 1.00 0.00 H new ATOM 0 HB3 LYS A1018 1.018 21.017 -5.846 1.00 0.00 H new ATOM 0 HG2 LYS A1018 -0.788 19.499 -5.932 1.00 0.00 H new ATOM 0 HG3 LYS A1018 -0.539 18.956 -4.284 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -1.161 21.261 -3.474 1.00 0.00 H new ATOM 0 HD3 LYS A1018 -1.504 21.720 -5.130 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -3.266 20.042 -5.299 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -2.847 19.378 -3.732 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -4.772 20.817 -3.588 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -3.485 21.480 -2.701 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -3.891 22.124 -4.219 1.00 0.00 H new ATOM 1588 N LYS A1019 2.342 18.916 -7.353 1.00 0.00 N ATOM 1589 CA LYS A1019 2.334 18.158 -8.597 1.00 0.00 C ATOM 1590 C LYS A1019 3.404 17.066 -8.550 1.00 0.00 C ATOM 1591 O LYS A1019 3.348 16.083 -9.291 1.00 0.00 O ATOM 1592 CB LYS A1019 2.565 19.092 -9.786 1.00 0.00 C ATOM 1593 CG LYS A1019 2.296 18.447 -11.135 1.00 0.00 C ATOM 1594 CD LYS A1019 0.859 17.966 -11.240 1.00 0.00 C ATOM 1595 CE LYS A1019 0.551 17.426 -12.624 1.00 0.00 C ATOM 1596 NZ LYS A1019 0.620 18.488 -13.663 1.00 0.00 N ATOM 0 H LYS A1019 2.731 19.855 -7.440 1.00 0.00 H new ATOM 0 HA LYS A1019 1.360 17.684 -8.719 1.00 0.00 H new ATOM 0 HB2 LYS A1019 1.924 19.967 -9.678 1.00 0.00 H new ATOM 0 HB3 LYS A1019 3.595 19.447 -9.762 1.00 0.00 H new ATOM 0 HG2 LYS A1019 2.501 19.164 -11.930 1.00 0.00 H new ATOM 0 HG3 LYS A1019 2.975 17.607 -11.280 1.00 0.00 H new ATOM 0 HD2 LYS A1019 0.680 17.189 -10.497 1.00 0.00 H new ATOM 0 HD3 LYS A1019 0.182 18.789 -11.011 1.00 0.00 H new ATOM 0 HE2 LYS A1019 1.257 16.632 -12.869 1.00 0.00 H new ATOM 0 HE3 LYS A1019 -0.444 16.980 -12.626 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 0.150 18.157 -14.530 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 0.143 19.345 -13.316 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 1.615 18.706 -13.871 1.00 0.00 H new ATOM 1610 N GLN A1020 4.350 17.241 -7.637 1.00 0.00 N ATOM 1611 CA GLN A1020 5.390 16.246 -7.419 1.00 0.00 C ATOM 1612 C GLN A1020 4.800 15.100 -6.616 1.00 0.00 C ATOM 1613 O GLN A1020 5.061 13.928 -6.886 1.00 0.00 O ATOM 1614 CB GLN A1020 6.594 16.841 -6.685 1.00 0.00 C ATOM 1615 CG GLN A1020 7.525 17.633 -7.585 1.00 0.00 C ATOM 1616 CD GLN A1020 8.698 18.228 -6.834 1.00 0.00 C ATOM 1617 OE1 GLN A1020 9.141 17.692 -5.817 1.00 0.00 O ATOM 1618 NE2 GLN A1020 9.220 19.332 -7.338 1.00 0.00 N ATOM 0 H GLN A1020 4.418 18.062 -7.036 1.00 0.00 H new ATOM 0 HA GLN A1020 5.746 15.889 -8.385 1.00 0.00 H new ATOM 0 HB2 GLN A1020 6.237 17.490 -5.885 1.00 0.00 H new ATOM 0 HB3 GLN A1020 7.156 16.035 -6.214 1.00 0.00 H new ATOM 0 HG2 GLN A1020 7.898 16.983 -8.377 1.00 0.00 H new ATOM 0 HG3 GLN A1020 6.964 18.433 -8.067 1.00 0.00 H new ATOM 0 HE21 GLN A1020 8.823 19.744 -8.182 1.00 0.00 H new ATOM 0 HE22 GLN A1020 10.020 19.772 -6.883 1.00 0.00 H new ATOM 1627 N MET A1021 3.980 15.461 -5.638 1.00 0.00 N ATOM 1628 CA MET A1021 3.243 14.491 -4.848 1.00 0.00 C ATOM 1629 C MET A1021 2.221 13.758 -5.705 1.00 0.00 C ATOM 1630 O MET A1021 2.024 12.561 -5.545 1.00 0.00 O ATOM 1631 CB MET A1021 2.560 15.187 -3.663 1.00 0.00 C ATOM 1632 CG MET A1021 1.438 14.382 -3.024 1.00 0.00 C ATOM 1633 SD MET A1021 -0.144 14.598 -3.871 1.00 0.00 S ATOM 1634 CE MET A1021 -1.183 13.474 -2.947 1.00 0.00 C ATOM 0 H MET A1021 3.809 16.431 -5.373 1.00 0.00 H new ATOM 0 HA MET A1021 3.946 13.753 -4.461 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.311 15.407 -2.904 1.00 0.00 H new ATOM 0 HB3 MET A1021 2.159 16.143 -4.000 1.00 0.00 H new ATOM 0 HG2 MET A1021 1.706 13.326 -3.028 1.00 0.00 H new ATOM 0 HG3 MET A1021 1.331 14.680 -1.981 1.00 0.00 H new ATOM 0 HE1 MET A1021 -2.198 13.869 -2.904 1.00 0.00 H new ATOM 0 HE2 MET A1021 -1.193 12.501 -3.438 1.00 0.00 H new ATOM 0 HE3 MET A1021 -0.792 13.366 -1.935 1.00 0.00 H new ATOM 1644 N LEU A1022 1.579 14.485 -6.615 1.00 0.00 N ATOM 1645 CA LEU A1022 0.557 13.910 -7.489 1.00 0.00 C ATOM 1646 C LEU A1022 1.120 12.712 -8.250 1.00 0.00 C ATOM 1647 O LEU A1022 0.535 11.626 -8.244 1.00 0.00 O ATOM 1648 CB LEU A1022 0.037 14.985 -8.459 1.00 0.00 C ATOM 1649 CG LEU A1022 -1.244 14.638 -9.237 1.00 0.00 C ATOM 1650 CD1 LEU A1022 -1.916 15.910 -9.722 1.00 0.00 C ATOM 1651 CD2 LEU A1022 -0.944 13.735 -10.427 1.00 0.00 C ATOM 0 H LEU A1022 1.749 15.479 -6.768 1.00 0.00 H new ATOM 0 HA LEU A1022 -0.277 13.559 -6.882 1.00 0.00 H new ATOM 0 HB2 LEU A1022 -0.144 15.899 -7.893 1.00 0.00 H new ATOM 0 HB3 LEU A1022 0.825 15.207 -9.179 1.00 0.00 H new ATOM 0 HG LEU A1022 -1.911 14.103 -8.561 1.00 0.00 H new ATOM 0 HD11 LEU A1022 -2.822 15.656 -10.272 1.00 0.00 H new ATOM 0 HD12 LEU A1022 -2.174 16.534 -8.866 1.00 0.00 H new ATOM 0 HD13 LEU A1022 -1.235 16.454 -10.376 1.00 0.00 H new ATOM 0 HD21 LEU A1022 -1.870 13.509 -10.955 1.00 0.00 H new ATOM 0 HD22 LEU A1022 -0.255 14.241 -11.103 1.00 0.00 H new ATOM 0 HD23 LEU A1022 -0.491 12.808 -10.075 1.00 0.00 H new ATOM 1663 N THR A1023 2.267 12.911 -8.882 1.00 0.00 N ATOM 1664 CA THR A1023 2.926 11.852 -9.631 1.00 0.00 C ATOM 1665 C THR A1023 3.432 10.755 -8.691 1.00 0.00 C ATOM 1666 O THR A1023 3.392 9.561 -9.011 1.00 0.00 O ATOM 1667 CB THR A1023 4.106 12.426 -10.441 1.00 0.00 C ATOM 1668 OG1 THR A1023 3.680 13.604 -11.146 1.00 0.00 O ATOM 1669 CG2 THR A1023 4.630 11.405 -11.438 1.00 0.00 C ATOM 0 H THR A1023 2.763 13.802 -8.891 1.00 0.00 H new ATOM 0 HA THR A1023 2.197 11.417 -10.315 1.00 0.00 H new ATOM 0 HB THR A1023 4.908 12.677 -9.746 1.00 0.00 H new ATOM 0 HG1 THR A1023 3.683 14.370 -10.535 1.00 0.00 H new ATOM 0 HG21 THR A1023 5.462 11.835 -11.996 1.00 0.00 H new ATOM 0 HG22 THR A1023 4.971 10.518 -10.905 1.00 0.00 H new ATOM 0 HG23 THR A1023 3.833 11.129 -12.129 1.00 0.00 H new ATOM 1677 N ALA A1024 3.861 11.169 -7.508 1.00 0.00 N ATOM 1678 CA ALA A1024 4.448 10.253 -6.545 1.00 0.00 C ATOM 1679 C ALA A1024 3.380 9.382 -5.895 1.00 0.00 C ATOM 1680 O ALA A1024 3.602 8.200 -5.640 1.00 0.00 O ATOM 1681 CB ALA A1024 5.224 11.023 -5.491 1.00 0.00 C ATOM 0 H ALA A1024 3.813 12.138 -7.192 1.00 0.00 H new ATOM 0 HA ALA A1024 5.137 9.596 -7.076 1.00 0.00 H new ATOM 0 HB1 ALA A1024 5.658 10.324 -4.776 1.00 0.00 H new ATOM 0 HB2 ALA A1024 6.020 11.594 -5.970 1.00 0.00 H new ATOM 0 HB3 ALA A1024 4.552 11.704 -4.970 1.00 0.00 H new ATOM 1687 N ALA A1025 2.218 9.966 -5.636 1.00 0.00 N ATOM 1688 CA ALA A1025 1.123 9.250 -4.999 1.00 0.00 C ATOM 1689 C ALA A1025 0.601 8.154 -5.907 1.00 0.00 C ATOM 1690 O ALA A1025 0.154 7.111 -5.438 1.00 0.00 O ATOM 1691 CB ALA A1025 0.003 10.206 -4.620 1.00 0.00 C ATOM 0 H ALA A1025 2.010 10.939 -5.859 1.00 0.00 H new ATOM 0 HA ALA A1025 1.503 8.789 -4.087 1.00 0.00 H new ATOM 0 HB1 ALA A1025 -0.805 9.650 -4.145 1.00 0.00 H new ATOM 0 HB2 ALA A1025 0.384 10.956 -3.926 1.00 0.00 H new ATOM 0 HB3 ALA A1025 -0.373 10.699 -5.516 1.00 0.00 H new ATOM 1697 N HIS A1026 0.665 8.387 -7.213 1.00 0.00 N ATOM 1698 CA HIS A1026 0.287 7.363 -8.173 1.00 0.00 C ATOM 1699 C HIS A1026 1.273 6.207 -8.103 1.00 0.00 C ATOM 1700 O HIS A1026 0.901 5.056 -8.301 1.00 0.00 O ATOM 1701 CB HIS A1026 0.219 7.934 -9.598 1.00 0.00 C ATOM 1702 CG HIS A1026 -0.102 6.913 -10.656 1.00 0.00 C ATOM 1703 ND1 HIS A1026 0.592 6.815 -11.846 1.00 0.00 N ATOM 1704 CD2 HIS A1026 -1.054 5.947 -10.701 1.00 0.00 C ATOM 1705 CE1 HIS A1026 0.084 5.835 -12.570 1.00 0.00 C ATOM 1706 NE2 HIS A1026 -0.914 5.294 -11.900 1.00 0.00 N ATOM 0 H HIS A1026 0.972 9.268 -7.626 1.00 0.00 H new ATOM 0 HA HIS A1026 -0.708 6.999 -7.919 1.00 0.00 H new ATOM 0 HB2 HIS A1026 -0.535 8.720 -9.627 1.00 0.00 H new ATOM 0 HB3 HIS A1026 1.175 8.400 -9.837 1.00 0.00 H new ATOM 0 HD2 HIS A1026 -1.785 5.732 -9.936 1.00 0.00 H new ATOM 0 HE1 HIS A1026 0.428 5.528 -13.547 1.00 0.00 H new ATOM 0 HE2 HIS A1026 -1.490 4.515 -12.221 1.00 0.00 H new ATOM 1715 N ALA A1027 2.524 6.523 -7.800 1.00 0.00 N ATOM 1716 CA ALA A1027 3.544 5.499 -7.641 1.00 0.00 C ATOM 1717 C ALA A1027 3.267 4.641 -6.412 1.00 0.00 C ATOM 1718 O ALA A1027 3.210 3.423 -6.514 1.00 0.00 O ATOM 1719 CB ALA A1027 4.923 6.131 -7.560 1.00 0.00 C ATOM 0 H ALA A1027 2.855 7.477 -7.660 1.00 0.00 H new ATOM 0 HA ALA A1027 3.515 4.849 -8.516 1.00 0.00 H new ATOM 0 HB1 ALA A1027 5.675 5.351 -7.441 1.00 0.00 H new ATOM 0 HB2 ALA A1027 5.122 6.690 -8.475 1.00 0.00 H new ATOM 0 HB3 ALA A1027 4.964 6.807 -6.706 1.00 0.00 H new ATOM 1725 N LEU A1028 3.043 5.283 -5.262 1.00 0.00 N ATOM 1726 CA LEU A1028 2.807 4.546 -4.019 1.00 0.00 C ATOM 1727 C LEU A1028 1.470 3.794 -4.091 1.00 0.00 C ATOM 1728 O LEU A1028 1.293 2.746 -3.472 1.00 0.00 O ATOM 1729 CB LEU A1028 2.909 5.485 -2.784 1.00 0.00 C ATOM 1730 CG LEU A1028 1.712 5.529 -1.816 1.00 0.00 C ATOM 1731 CD1 LEU A1028 2.112 6.236 -0.539 1.00 0.00 C ATOM 1732 CD2 LEU A1028 0.517 6.252 -2.424 1.00 0.00 C ATOM 0 H LEU A1028 3.020 6.298 -5.166 1.00 0.00 H new ATOM 0 HA LEU A1028 3.589 3.796 -3.896 1.00 0.00 H new ATOM 0 HB2 LEU A1028 3.791 5.194 -2.213 1.00 0.00 H new ATOM 0 HB3 LEU A1028 3.084 6.498 -3.147 1.00 0.00 H new ATOM 0 HG LEU A1028 1.422 4.499 -1.609 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.262 6.265 0.143 1.00 0.00 H new ATOM 0 HD12 LEU A1028 2.936 5.699 -0.069 1.00 0.00 H new ATOM 0 HD13 LEU A1028 2.426 7.254 -0.770 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -0.305 6.261 -1.709 1.00 0.00 H new ATOM 0 HD22 LEU A1028 0.797 7.277 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A1028 0.203 5.737 -3.332 1.00 0.00 H new ATOM 1744 N ALA A1029 0.521 4.361 -4.834 1.00 0.00 N ATOM 1745 CA ALA A1029 -0.721 3.662 -5.158 1.00 0.00 C ATOM 1746 C ALA A1029 -0.432 2.335 -5.852 1.00 0.00 C ATOM 1747 O ALA A1029 -1.074 1.324 -5.564 1.00 0.00 O ATOM 1748 CB ALA A1029 -1.615 4.529 -6.032 1.00 0.00 C ATOM 0 H ALA A1029 0.588 5.302 -5.223 1.00 0.00 H new ATOM 0 HA ALA A1029 -1.243 3.456 -4.224 1.00 0.00 H new ATOM 0 HB1 ALA A1029 -2.534 3.989 -6.261 1.00 0.00 H new ATOM 0 HB2 ALA A1029 -1.858 5.450 -5.503 1.00 0.00 H new ATOM 0 HB3 ALA A1029 -1.095 4.769 -6.959 1.00 0.00 H new ATOM 1754 N VAL A1030 0.536 2.342 -6.764 1.00 0.00 N ATOM 1755 CA VAL A1030 0.942 1.125 -7.457 1.00 0.00 C ATOM 1756 C VAL A1030 1.590 0.144 -6.486 1.00 0.00 C ATOM 1757 O VAL A1030 1.476 -1.066 -6.652 1.00 0.00 O ATOM 1758 CB VAL A1030 1.907 1.427 -8.630 1.00 0.00 C ATOM 1759 CG1 VAL A1030 2.363 0.145 -9.308 1.00 0.00 C ATOM 1760 CG2 VAL A1030 1.243 2.343 -9.646 1.00 0.00 C ATOM 0 H VAL A1030 1.053 3.177 -7.040 1.00 0.00 H new ATOM 0 HA VAL A1030 0.041 0.673 -7.872 1.00 0.00 H new ATOM 0 HB VAL A1030 2.783 1.929 -8.219 1.00 0.00 H new ATOM 0 HG11 VAL A1030 3.039 0.388 -10.128 1.00 0.00 H new ATOM 0 HG12 VAL A1030 2.881 -0.485 -8.585 1.00 0.00 H new ATOM 0 HG13 VAL A1030 1.496 -0.388 -9.699 1.00 0.00 H new ATOM 0 HG21 VAL A1030 1.936 2.544 -10.463 1.00 0.00 H new ATOM 0 HG22 VAL A1030 0.348 1.861 -10.040 1.00 0.00 H new ATOM 0 HG23 VAL A1030 0.968 3.281 -9.165 1.00 0.00 H new ATOM 1770 N ASP A1031 2.251 0.669 -5.464 1.00 0.00 N ATOM 1771 CA ASP A1031 2.837 -0.175 -4.427 1.00 0.00 C ATOM 1772 C ASP A1031 1.752 -1.010 -3.762 1.00 0.00 C ATOM 1773 O ASP A1031 1.890 -2.229 -3.608 1.00 0.00 O ATOM 1774 CB ASP A1031 3.528 0.662 -3.354 1.00 0.00 C ATOM 1775 CG ASP A1031 4.740 1.412 -3.844 1.00 0.00 C ATOM 1776 OD1 ASP A1031 4.851 1.660 -5.061 1.00 0.00 O ATOM 1777 OD2 ASP A1031 5.588 1.749 -3.003 1.00 0.00 O ATOM 0 H ASP A1031 2.396 1.670 -5.329 1.00 0.00 H new ATOM 0 HA ASP A1031 3.574 -0.819 -4.906 1.00 0.00 H new ATOM 0 HB2 ASP A1031 2.812 1.376 -2.948 1.00 0.00 H new ATOM 0 HB3 ASP A1031 3.826 0.008 -2.534 1.00 0.00 H new ATOM 1782 N ALA A1032 0.654 -0.350 -3.398 1.00 0.00 N ATOM 1783 CA ALA A1032 -0.494 -1.034 -2.824 1.00 0.00 C ATOM 1784 C ALA A1032 -1.100 -2.007 -3.835 1.00 0.00 C ATOM 1785 O ALA A1032 -1.379 -3.160 -3.513 1.00 0.00 O ATOM 1786 CB ALA A1032 -1.535 -0.024 -2.368 1.00 0.00 C ATOM 0 H ALA A1032 0.539 0.659 -3.492 1.00 0.00 H new ATOM 0 HA ALA A1032 -0.160 -1.605 -1.958 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -2.389 -0.549 -1.940 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -1.099 0.633 -1.615 1.00 0.00 H new ATOM 0 HB3 ALA A1032 -1.864 0.569 -3.221 1.00 0.00 H new ATOM 1792 N LYS A1033 -1.277 -1.543 -5.070 1.00 0.00 N ATOM 1793 CA LYS A1033 -1.872 -2.363 -6.123 1.00 0.00 C ATOM 1794 C LYS A1033 -1.005 -3.582 -6.436 1.00 0.00 C ATOM 1795 O LYS A1033 -1.512 -4.671 -6.707 1.00 0.00 O ATOM 1796 CB LYS A1033 -2.071 -1.531 -7.394 1.00 0.00 C ATOM 1797 CG LYS A1033 -3.113 -0.429 -7.252 1.00 0.00 C ATOM 1798 CD LYS A1033 -4.529 -0.986 -7.184 1.00 0.00 C ATOM 1799 CE LYS A1033 -4.935 -1.636 -8.498 1.00 0.00 C ATOM 1800 NZ LYS A1033 -6.347 -2.102 -8.478 1.00 0.00 N ATOM 0 H LYS A1033 -1.017 -0.602 -5.366 1.00 0.00 H new ATOM 0 HA LYS A1033 -2.839 -2.714 -5.764 1.00 0.00 H new ATOM 0 HB2 LYS A1033 -1.118 -1.083 -7.676 1.00 0.00 H new ATOM 0 HB3 LYS A1033 -2.365 -2.193 -8.208 1.00 0.00 H new ATOM 0 HG2 LYS A1033 -2.908 0.150 -6.351 1.00 0.00 H new ATOM 0 HG3 LYS A1033 -3.033 0.256 -8.096 1.00 0.00 H new ATOM 0 HD2 LYS A1033 -4.595 -1.718 -6.379 1.00 0.00 H new ATOM 0 HD3 LYS A1033 -5.226 -0.183 -6.943 1.00 0.00 H new ATOM 0 HE2 LYS A1033 -4.800 -0.923 -9.312 1.00 0.00 H new ATOM 0 HE3 LYS A1033 -4.278 -2.481 -8.702 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 -6.582 -2.538 -9.392 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 -6.471 -2.802 -7.719 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 -6.977 -1.292 -8.309 1.00 0.00 H new ATOM 1814 N ASN A1034 0.301 -3.401 -6.385 1.00 0.00 N ATOM 1815 CA ASN A1034 1.221 -4.477 -6.709 1.00 0.00 C ATOM 1816 C ASN A1034 1.159 -5.567 -5.645 1.00 0.00 C ATOM 1817 O ASN A1034 1.175 -6.750 -5.965 1.00 0.00 O ATOM 1818 CB ASN A1034 2.654 -3.949 -6.837 1.00 0.00 C ATOM 1819 CG ASN A1034 3.509 -4.812 -7.745 1.00 0.00 C ATOM 1820 OD1 ASN A1034 3.626 -4.546 -8.943 1.00 0.00 O ATOM 1821 ND2 ASN A1034 4.091 -5.864 -7.195 1.00 0.00 N ATOM 0 H ASN A1034 0.749 -2.523 -6.123 1.00 0.00 H new ATOM 0 HA ASN A1034 0.922 -4.901 -7.668 1.00 0.00 H new ATOM 0 HB2 ASN A1034 2.630 -2.931 -7.225 1.00 0.00 H new ATOM 0 HB3 ASN A1034 3.111 -3.903 -5.848 1.00 0.00 H new ATOM 0 HD21 ASN A1034 4.660 -6.488 -7.766 1.00 0.00 H new ATOM 0 HD22 ASN A1034 3.971 -6.051 -6.200 1.00 0.00 H new ATOM 1828 N LEU A1035 1.050 -5.166 -4.378 1.00 0.00 N ATOM 1829 CA LEU A1035 1.042 -6.127 -3.276 1.00 0.00 C ATOM 1830 C LEU A1035 -0.330 -6.784 -3.137 1.00 0.00 C ATOM 1831 O LEU A1035 -0.427 -7.872 -2.593 1.00 0.00 O ATOM 1832 CB LEU A1035 1.434 -5.468 -1.944 1.00 0.00 C ATOM 1833 CG LEU A1035 1.635 -6.448 -0.784 1.00 0.00 C ATOM 1834 CD1 LEU A1035 3.020 -7.067 -0.827 1.00 0.00 C ATOM 1835 CD2 LEU A1035 1.410 -5.764 0.544 1.00 0.00 C ATOM 0 H LEU A1035 0.967 -4.191 -4.091 1.00 0.00 H new ATOM 0 HA LEU A1035 1.784 -6.890 -3.513 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.355 -4.904 -2.090 1.00 0.00 H new ATOM 0 HB3 LEU A1035 0.661 -4.751 -1.667 1.00 0.00 H new ATOM 0 HG LEU A1035 0.899 -7.245 -0.893 1.00 0.00 H new ATOM 0 HD11 LEU A1035 3.136 -7.758 0.008 1.00 0.00 H new ATOM 0 HD12 LEU A1035 3.149 -7.606 -1.765 1.00 0.00 H new ATOM 0 HD13 LEU A1035 3.772 -6.281 -0.754 1.00 0.00 H new ATOM 0 HD21 LEU A1035 1.558 -6.480 1.352 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.117 -4.941 0.654 1.00 0.00 H new ATOM 0 HD23 LEU A1035 0.392 -5.376 0.586 1.00 0.00 H new ATOM 1847 N LEU A1036 -1.390 -6.150 -3.638 1.00 0.00 N ATOM 1848 CA LEU A1036 -2.713 -6.769 -3.569 1.00 0.00 C ATOM 1849 C LEU A1036 -2.740 -7.986 -4.474 1.00 0.00 C ATOM 1850 O LEU A1036 -3.415 -8.962 -4.200 1.00 0.00 O ATOM 1851 CB LEU A1036 -3.860 -5.779 -3.898 1.00 0.00 C ATOM 1852 CG LEU A1036 -3.955 -5.222 -5.321 1.00 0.00 C ATOM 1853 CD1 LEU A1036 -4.589 -6.224 -6.277 1.00 0.00 C ATOM 1854 CD2 LEU A1036 -4.756 -3.933 -5.309 1.00 0.00 C ATOM 0 H LEU A1036 -1.362 -5.233 -4.084 1.00 0.00 H new ATOM 0 HA LEU A1036 -2.890 -7.081 -2.540 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -4.803 -6.277 -3.673 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -3.775 -4.933 -3.215 1.00 0.00 H new ATOM 0 HG LEU A1036 -2.944 -5.024 -5.676 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -4.639 -5.792 -7.276 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -3.987 -7.132 -6.304 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -5.596 -6.466 -5.936 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -4.823 -3.537 -6.322 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -5.758 -4.131 -4.930 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -4.262 -3.204 -4.667 1.00 0.00 H new ATOM 1866 N ASP A1037 -1.977 -7.907 -5.543 1.00 0.00 N ATOM 1867 CA ASP A1037 -1.743 -9.054 -6.418 1.00 0.00 C ATOM 1868 C ASP A1037 -0.758 -10.008 -5.754 1.00 0.00 C ATOM 1869 O ASP A1037 -0.826 -11.214 -5.929 1.00 0.00 O ATOM 1870 CB ASP A1037 -1.192 -8.596 -7.774 1.00 0.00 C ATOM 1871 CG ASP A1037 -0.924 -9.756 -8.720 1.00 0.00 C ATOM 1872 OD1 ASP A1037 -1.892 -10.271 -9.322 1.00 0.00 O ATOM 1873 OD2 ASP A1037 0.254 -10.148 -8.876 1.00 0.00 O ATOM 0 H ASP A1037 -1.500 -7.054 -5.836 1.00 0.00 H new ATOM 0 HA ASP A1037 -2.690 -9.566 -6.586 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -1.902 -7.911 -8.238 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -0.268 -8.039 -7.617 1.00 0.00 H new ATOM 1878 N VAL A1038 0.149 -9.436 -4.978 1.00 0.00 N ATOM 1879 CA VAL A1038 1.153 -10.194 -4.234 1.00 0.00 C ATOM 1880 C VAL A1038 0.528 -11.103 -3.179 1.00 0.00 C ATOM 1881 O VAL A1038 0.595 -12.324 -3.265 1.00 0.00 O ATOM 1882 CB VAL A1038 2.134 -9.241 -3.517 1.00 0.00 C ATOM 1883 CG1 VAL A1038 2.948 -9.978 -2.464 1.00 0.00 C ATOM 1884 CG2 VAL A1038 3.049 -8.553 -4.513 1.00 0.00 C ATOM 0 H VAL A1038 0.213 -8.427 -4.843 1.00 0.00 H new ATOM 0 HA VAL A1038 1.676 -10.807 -4.968 1.00 0.00 H new ATOM 0 HB VAL A1038 1.542 -8.478 -3.012 1.00 0.00 H new ATOM 0 HG11 VAL A1038 3.629 -9.280 -1.977 1.00 0.00 H new ATOM 0 HG12 VAL A1038 2.277 -10.409 -1.721 1.00 0.00 H new ATOM 0 HG13 VAL A1038 3.522 -10.774 -2.939 1.00 0.00 H new ATOM 0 HG21 VAL A1038 3.730 -7.888 -3.982 1.00 0.00 H new ATOM 0 HG22 VAL A1038 3.624 -9.302 -5.057 1.00 0.00 H new ATOM 0 HG23 VAL A1038 2.451 -7.974 -5.217 1.00 0.00 H new ATOM 1894 N ILE A1039 -0.053 -10.473 -2.178 1.00 0.00 N ATOM 1895 CA ILE A1039 -0.519 -11.148 -0.973 1.00 0.00 C ATOM 1896 C ILE A1039 -1.877 -11.818 -1.151 1.00 0.00 C ATOM 1897 O ILE A1039 -2.148 -12.834 -0.508 1.00 0.00 O ATOM 1898 CB ILE A1039 -0.555 -10.190 0.235 1.00 0.00 C ATOM 1899 CG1 ILE A1039 -1.398 -8.953 -0.080 1.00 0.00 C ATOM 1900 CG2 ILE A1039 0.860 -9.796 0.634 1.00 0.00 C ATOM 1901 CD1 ILE A1039 -1.298 -7.868 0.966 1.00 0.00 C ATOM 0 H ILE A1039 -0.219 -9.467 -2.174 1.00 0.00 H new ATOM 0 HA ILE A1039 0.208 -11.936 -0.777 1.00 0.00 H new ATOM 0 HB ILE A1039 -1.020 -10.706 1.075 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -1.086 -8.547 -1.043 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.441 -9.252 -0.183 1.00 0.00 H new ATOM 0 HG21 ILE A1039 0.822 -9.120 1.488 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.424 -10.689 0.903 1.00 0.00 H new ATOM 0 HG23 ILE A1039 1.348 -9.297 -0.203 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -1.922 -7.023 0.675 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -1.638 -8.256 1.926 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.262 -7.541 1.053 1.00 0.00 H new ATOM 1913 N ASP A1040 -2.751 -11.257 -1.978 1.00 0.00 N ATOM 1914 CA ASP A1040 -3.924 -12.021 -2.399 1.00 0.00 C ATOM 1915 C ASP A1040 -3.444 -13.327 -3.004 1.00 0.00 C ATOM 1916 O ASP A1040 -3.907 -14.409 -2.640 1.00 0.00 O ATOM 1917 CB ASP A1040 -4.792 -11.261 -3.403 1.00 0.00 C ATOM 1918 CG ASP A1040 -5.914 -12.115 -3.958 1.00 0.00 C ATOM 1919 OD1 ASP A1040 -6.460 -12.950 -3.212 1.00 0.00 O ATOM 1920 OD2 ASP A1040 -6.244 -11.971 -5.152 1.00 0.00 O ATOM 0 H ASP A1040 -2.679 -10.314 -2.359 1.00 0.00 H new ATOM 0 HA ASP A1040 -4.551 -12.202 -1.526 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -5.214 -10.380 -2.920 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -4.168 -10.907 -4.224 1.00 0.00 H new ATOM 1925 N GLN A1041 -2.438 -13.223 -3.863 1.00 0.00 N ATOM 1926 CA GLN A1041 -1.836 -14.405 -4.442 1.00 0.00 C ATOM 1927 C GLN A1041 -1.104 -15.189 -3.380 1.00 0.00 C ATOM 1928 O GLN A1041 -0.978 -16.383 -3.509 1.00 0.00 O ATOM 1929 CB GLN A1041 -0.861 -14.080 -5.564 1.00 0.00 C ATOM 1930 CG GLN A1041 -1.422 -14.295 -6.962 1.00 0.00 C ATOM 1931 CD GLN A1041 -2.807 -13.713 -7.145 1.00 0.00 C ATOM 1932 OE1 GLN A1041 -3.806 -14.398 -6.946 1.00 0.00 O ATOM 1933 NE2 GLN A1041 -2.877 -12.449 -7.521 1.00 0.00 N ATOM 0 H GLN A1041 -2.029 -12.340 -4.168 1.00 0.00 H new ATOM 0 HA GLN A1041 -2.652 -14.992 -4.863 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -0.547 -13.041 -5.467 1.00 0.00 H new ATOM 0 HB3 GLN A1041 0.031 -14.695 -5.444 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -0.747 -13.846 -7.690 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -1.453 -15.364 -7.173 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -2.022 -11.915 -7.676 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -3.786 -12.007 -7.657 1.00 0.00 H new ATOM 1942 N ALA A1042 -0.606 -14.511 -2.342 1.00 0.00 N ATOM 1943 CA ALA A1042 0.048 -15.183 -1.231 1.00 0.00 C ATOM 1944 C ALA A1042 -0.837 -16.280 -0.658 1.00 0.00 C ATOM 1945 O ALA A1042 -0.417 -17.418 -0.526 1.00 0.00 O ATOM 1946 CB ALA A1042 0.404 -14.199 -0.134 1.00 0.00 C ATOM 0 H ALA A1042 -0.647 -13.496 -2.254 1.00 0.00 H new ATOM 0 HA ALA A1042 0.963 -15.631 -1.617 1.00 0.00 H new ATOM 0 HB1 ALA A1042 0.892 -14.728 0.685 1.00 0.00 H new ATOM 0 HB2 ALA A1042 1.080 -13.441 -0.530 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -0.503 -13.720 0.233 1.00 0.00 H new ATOM 1952 N ARG A1043 -2.062 -15.932 -0.311 1.00 0.00 N ATOM 1953 CA ARG A1043 -3.013 -16.932 0.168 1.00 0.00 C ATOM 1954 C ARG A1043 -3.151 -18.090 -0.839 1.00 0.00 C ATOM 1955 O ARG A1043 -3.281 -19.250 -0.451 1.00 0.00 O ATOM 1956 CB ARG A1043 -4.370 -16.295 0.464 1.00 0.00 C ATOM 1957 CG ARG A1043 -4.931 -16.680 1.826 1.00 0.00 C ATOM 1958 CD ARG A1043 -4.022 -16.218 2.956 1.00 0.00 C ATOM 1959 NE ARG A1043 -4.581 -16.534 4.274 1.00 0.00 N ATOM 1960 CZ ARG A1043 -3.902 -16.485 5.426 1.00 0.00 C ATOM 1961 NH1 ARG A1043 -2.596 -16.211 5.439 1.00 0.00 N ATOM 1962 NH2 ARG A1043 -4.534 -16.734 6.568 1.00 0.00 N ATOM 0 H ARG A1043 -2.424 -14.979 -0.349 1.00 0.00 H new ATOM 0 HA ARG A1043 -2.627 -17.346 1.100 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -4.274 -15.211 0.412 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -5.079 -16.590 -0.310 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -5.920 -16.240 1.951 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -5.055 -17.762 1.877 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -3.046 -16.692 2.853 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -3.864 -15.142 2.878 1.00 0.00 H new ATOM 0 HE ARG A1043 -5.561 -16.812 4.316 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -2.103 -16.036 4.563 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -2.091 -16.177 6.324 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -5.529 -16.960 6.562 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -4.025 -16.699 7.451 1.00 0.00 H new ATOM 1976 N LEU A1044 -3.100 -17.781 -2.132 1.00 0.00 N ATOM 1977 CA LEU A1044 -3.088 -18.829 -3.168 1.00 0.00 C ATOM 1978 C LEU A1044 -1.711 -19.488 -3.285 1.00 0.00 C ATOM 1979 O LEU A1044 -1.605 -20.628 -3.717 1.00 0.00 O ATOM 1980 CB LEU A1044 -3.521 -18.263 -4.518 1.00 0.00 C ATOM 1981 CG LEU A1044 -3.169 -19.097 -5.754 1.00 0.00 C ATOM 1982 CD1 LEU A1044 -4.024 -20.353 -5.821 1.00 0.00 C ATOM 1983 CD2 LEU A1044 -3.337 -18.270 -7.018 1.00 0.00 C ATOM 0 H LEU A1044 -3.066 -16.827 -2.492 1.00 0.00 H new ATOM 0 HA LEU A1044 -3.802 -19.595 -2.865 1.00 0.00 H new ATOM 0 HB2 LEU A1044 -4.602 -18.122 -4.498 1.00 0.00 H new ATOM 0 HB3 LEU A1044 -3.073 -17.276 -4.634 1.00 0.00 H new ATOM 0 HG LEU A1044 -2.125 -19.401 -5.674 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -3.756 -20.929 -6.707 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -3.853 -20.957 -4.930 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -5.076 -20.074 -5.874 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -3.083 -18.877 -7.887 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -4.371 -17.935 -7.099 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -2.678 -17.403 -6.976 1.00 0.00 H new ATOM 1995 N LYS A1045 -0.663 -18.767 -2.899 1.00 0.00 N ATOM 1996 CA LYS A1045 0.682 -19.327 -2.809 1.00 0.00 C ATOM 1997 C LYS A1045 0.680 -20.413 -1.763 1.00 0.00 C ATOM 1998 O LYS A1045 1.535 -21.288 -1.745 1.00 0.00 O ATOM 1999 CB LYS A1045 1.714 -18.262 -2.415 1.00 0.00 C ATOM 2000 CG LYS A1045 1.873 -17.137 -3.412 1.00 0.00 C ATOM 2001 CD LYS A1045 2.204 -17.656 -4.805 1.00 0.00 C ATOM 2002 CE LYS A1045 1.861 -16.641 -5.890 1.00 0.00 C ATOM 2003 NZ LYS A1045 2.678 -15.403 -5.790 1.00 0.00 N ATOM 0 H LYS A1045 -0.721 -17.782 -2.641 1.00 0.00 H new ATOM 0 HA LYS A1045 0.957 -19.721 -3.787 1.00 0.00 H new ATOM 0 HB2 LYS A1045 1.429 -17.838 -1.452 1.00 0.00 H new ATOM 0 HB3 LYS A1045 2.681 -18.746 -2.277 1.00 0.00 H new ATOM 0 HG2 LYS A1045 0.953 -16.554 -3.451 1.00 0.00 H new ATOM 0 HG3 LYS A1045 2.663 -16.465 -3.078 1.00 0.00 H new ATOM 0 HD2 LYS A1045 3.265 -17.899 -4.858 1.00 0.00 H new ATOM 0 HD3 LYS A1045 1.656 -18.580 -4.987 1.00 0.00 H new ATOM 0 HE2 LYS A1045 2.014 -17.095 -6.869 1.00 0.00 H new ATOM 0 HE3 LYS A1045 0.805 -16.382 -5.820 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 2.850 -15.022 -6.743 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 2.169 -14.696 -5.221 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 3.587 -15.623 -5.336 1.00 0.00 H new ATOM 2017 N MET A1046 -0.300 -20.334 -0.890 1.00 0.00 N ATOM 2018 CA MET A1046 -0.478 -21.346 0.130 1.00 0.00 C ATOM 2019 C MET A1046 -1.063 -22.598 -0.513 1.00 0.00 C ATOM 2020 O MET A1046 -0.612 -23.717 -0.250 1.00 0.00 O ATOM 2021 CB MET A1046 -1.370 -20.809 1.245 1.00 0.00 C ATOM 2022 CG MET A1046 -1.430 -21.691 2.482 1.00 0.00 C ATOM 2023 SD MET A1046 -2.420 -23.183 2.255 1.00 0.00 S ATOM 2024 CE MET A1046 -3.998 -22.479 1.779 1.00 0.00 C ATOM 0 H MET A1046 -0.986 -19.580 -0.865 1.00 0.00 H new ATOM 0 HA MET A1046 0.481 -21.606 0.578 1.00 0.00 H new ATOM 0 HB2 MET A1046 -1.013 -19.821 1.535 1.00 0.00 H new ATOM 0 HB3 MET A1046 -2.380 -20.681 0.856 1.00 0.00 H new ATOM 0 HG2 MET A1046 -0.417 -21.976 2.765 1.00 0.00 H new ATOM 0 HG3 MET A1046 -1.841 -21.114 3.310 1.00 0.00 H new ATOM 0 HE1 MET A1046 -4.805 -23.108 2.155 1.00 0.00 H new ATOM 0 HE2 MET A1046 -4.092 -21.478 2.200 1.00 0.00 H new ATOM 0 HE3 MET A1046 -4.058 -22.422 0.692 1.00 0.00 H new ATOM 2034 N ILE A1047 -2.055 -22.407 -1.380 1.00 0.00 N ATOM 2035 CA ILE A1047 -2.547 -23.499 -2.204 1.00 0.00 C ATOM 2036 C ILE A1047 -1.427 -24.017 -3.101 1.00 0.00 C ATOM 2037 O ILE A1047 -1.234 -25.224 -3.262 1.00 0.00 O ATOM 2038 CB ILE A1047 -3.754 -23.074 -3.065 1.00 0.00 C ATOM 2039 CG1 ILE A1047 -4.946 -22.818 -2.158 1.00 0.00 C ATOM 2040 CG2 ILE A1047 -4.094 -24.134 -4.107 1.00 0.00 C ATOM 2041 CD1 ILE A1047 -5.099 -21.384 -1.740 1.00 0.00 C ATOM 0 H ILE A1047 -2.527 -21.515 -1.527 1.00 0.00 H new ATOM 0 HA ILE A1047 -2.882 -24.292 -1.535 1.00 0.00 H new ATOM 0 HB ILE A1047 -3.498 -22.161 -3.602 1.00 0.00 H new ATOM 0 HG12 ILE A1047 -5.854 -23.135 -2.671 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -4.851 -23.437 -1.266 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -4.949 -23.803 -4.697 1.00 0.00 H new ATOM 0 HG22 ILE A1047 -3.237 -24.287 -4.764 1.00 0.00 H new ATOM 0 HG23 ILE A1047 -4.339 -25.071 -3.607 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -5.972 -21.284 -1.095 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -4.209 -21.066 -1.198 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -5.228 -20.759 -2.624 1.00 0.00 H new ATOM 2053 N SER A1048 -0.669 -23.071 -3.641 1.00 0.00 N ATOM 2054 CA SER A1048 0.452 -23.357 -4.521 1.00 0.00 C ATOM 2055 C SER A1048 1.602 -24.009 -3.753 1.00 0.00 C ATOM 2056 O SER A1048 2.548 -24.524 -4.350 1.00 0.00 O ATOM 2057 CB SER A1048 0.912 -22.053 -5.176 1.00 0.00 C ATOM 2058 OG SER A1048 -0.164 -21.427 -5.862 1.00 0.00 O ATOM 0 H SER A1048 -0.818 -22.075 -3.478 1.00 0.00 H new ATOM 0 HA SER A1048 0.133 -24.061 -5.290 1.00 0.00 H new ATOM 0 HB2 SER A1048 1.307 -21.378 -4.416 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.724 -22.258 -5.873 1.00 0.00 H new ATOM 0 HG SER A1048 -0.804 -21.070 -5.211 1.00 0.00 H new ATOM 2064 N GLN A1049 1.522 -23.969 -2.429 1.00 0.00 N ATOM 2065 CA GLN A1049 2.499 -24.629 -1.582 1.00 0.00 C ATOM 2066 C GLN A1049 2.279 -26.132 -1.661 1.00 0.00 C ATOM 2067 O GLN A1049 3.086 -26.849 -2.251 1.00 0.00 O ATOM 2068 CB GLN A1049 2.369 -24.127 -0.134 1.00 0.00 C ATOM 2069 CG GLN A1049 3.556 -24.434 0.780 1.00 0.00 C ATOM 2070 CD GLN A1049 3.706 -25.905 1.120 1.00 0.00 C ATOM 2071 OE1 GLN A1049 3.095 -26.402 2.068 1.00 0.00 O ATOM 2072 NE2 GLN A1049 4.545 -26.603 0.372 1.00 0.00 N ATOM 0 H GLN A1049 0.785 -23.482 -1.919 1.00 0.00 H new ATOM 0 HA GLN A1049 3.508 -24.397 -1.924 1.00 0.00 H new ATOM 0 HB2 GLN A1049 2.219 -23.048 -0.155 1.00 0.00 H new ATOM 0 HB3 GLN A1049 1.473 -24.565 0.305 1.00 0.00 H new ATOM 0 HG2 GLN A1049 4.471 -24.087 0.300 1.00 0.00 H new ATOM 0 HG3 GLN A1049 3.446 -23.867 1.704 1.00 0.00 H new ATOM 0 HE21 GLN A1049 5.031 -26.154 -0.404 1.00 0.00 H new ATOM 0 HE22 GLN A1049 4.706 -27.590 0.571 1.00 0.00 H new ATOM 2081 N SER A1050 1.168 -26.598 -1.097 1.00 0.00 N ATOM 2082 CA SER A1050 0.853 -28.023 -1.106 1.00 0.00 C ATOM 2083 C SER A1050 -0.517 -28.279 -0.474 1.00 0.00 C ATOM 2084 O SER A1050 -0.766 -29.348 0.086 1.00 0.00 O ATOM 2085 CB SER A1050 1.938 -28.807 -0.353 1.00 0.00 C ATOM 2086 OG SER A1050 1.884 -30.191 -0.658 1.00 0.00 O ATOM 0 H SER A1050 0.474 -26.013 -0.631 1.00 0.00 H new ATOM 0 HA SER A1050 0.822 -28.363 -2.141 1.00 0.00 H new ATOM 0 HB2 SER A1050 2.920 -28.414 -0.614 1.00 0.00 H new ATOM 0 HB3 SER A1050 1.813 -28.665 0.720 1.00 0.00 H new ATOM 0 HG SER A1050 0.961 -30.509 -0.571 1.00 0.00 H new ATOM 2092 N ARG A1051 -1.418 -27.314 -0.580 1.00 0.00 N ATOM 2093 CA ARG A1051 -2.742 -27.470 0.004 1.00 0.00 C ATOM 2094 C ARG A1051 -3.802 -26.801 -0.857 1.00 0.00 C ATOM 2095 O ARG A1051 -3.993 -25.592 -0.790 1.00 0.00 O ATOM 2096 CB ARG A1051 -2.788 -26.908 1.428 1.00 0.00 C ATOM 2097 CG ARG A1051 -4.161 -27.025 2.069 1.00 0.00 C ATOM 2098 CD ARG A1051 -4.171 -26.545 3.509 1.00 0.00 C ATOM 2099 NE ARG A1051 -5.519 -26.582 4.075 1.00 0.00 N ATOM 2100 CZ ARG A1051 -5.799 -26.500 5.373 1.00 0.00 C ATOM 2101 NH1 ARG A1051 -4.826 -26.456 6.276 1.00 0.00 N ATOM 2102 NH2 ARG A1051 -7.065 -26.487 5.769 1.00 0.00 N ATOM 0 H ARG A1051 -1.261 -26.427 -1.058 1.00 0.00 H new ATOM 0 HA ARG A1051 -2.955 -28.538 0.048 1.00 0.00 H new ATOM 0 HB2 ARG A1051 -2.059 -27.435 2.044 1.00 0.00 H new ATOM 0 HB3 ARG A1051 -2.490 -25.860 1.409 1.00 0.00 H new ATOM 0 HG2 ARG A1051 -4.880 -26.444 1.491 1.00 0.00 H new ATOM 0 HG3 ARG A1051 -4.488 -28.064 2.033 1.00 0.00 H new ATOM 0 HD2 ARG A1051 -3.507 -27.169 4.107 1.00 0.00 H new ATOM 0 HD3 ARG A1051 -3.782 -25.528 3.558 1.00 0.00 H new ATOM 0 HE ARG A1051 -6.301 -26.678 3.428 1.00 0.00 H new ATOM 0 HH11 ARG A1051 -3.851 -26.485 5.977 1.00 0.00 H new ATOM 0 HH12 ARG A1051 -5.054 -26.393 7.268 1.00 0.00 H new ATOM 0 HH21 ARG A1051 -7.815 -26.540 5.080 1.00 0.00 H new ATOM 0 HH22 ARG A1051 -7.288 -26.424 6.762 1.00 0.00 H new ATOM 2116 N PRO A1052 -4.492 -27.586 -1.698 1.00 0.00 N ATOM 2117 CA PRO A1052 -5.589 -27.085 -2.530 1.00 0.00 C ATOM 2118 C PRO A1052 -6.798 -26.688 -1.688 1.00 0.00 C ATOM 2119 O PRO A1052 -7.590 -25.830 -2.084 1.00 0.00 O ATOM 2120 CB PRO A1052 -5.940 -28.273 -3.436 1.00 0.00 C ATOM 2121 CG PRO A1052 -4.798 -29.224 -3.303 1.00 0.00 C ATOM 2122 CD PRO A1052 -4.250 -29.015 -1.923 1.00 0.00 C ATOM 0 HA PRO A1052 -5.304 -26.190 -3.083 1.00 0.00 H new ATOM 0 HB2 PRO A1052 -6.877 -28.738 -3.128 1.00 0.00 H new ATOM 0 HB3 PRO A1052 -6.067 -27.954 -4.470 1.00 0.00 H new ATOM 0 HG2 PRO A1052 -5.129 -30.254 -3.441 1.00 0.00 H new ATOM 0 HG3 PRO A1052 -4.037 -29.030 -4.059 1.00 0.00 H new ATOM 0 HD2 PRO A1052 -4.761 -29.634 -1.186 1.00 0.00 H new ATOM 0 HD3 PRO A1052 -3.190 -29.261 -1.866 1.00 0.00 H new ATOM 2130 N HIS A1053 -6.927 -27.322 -0.530 1.00 0.00 N ATOM 2131 CA HIS A1053 -8.022 -27.059 0.388 1.00 0.00 C ATOM 2132 C HIS A1053 -7.687 -27.641 1.752 1.00 0.00 C ATOM 2133 O HIS A1053 -7.884 -26.951 2.770 1.00 0.00 O ATOM 2134 CB HIS A1053 -9.332 -27.658 -0.136 1.00 0.00 C ATOM 2135 CG HIS A1053 -10.510 -27.389 0.751 1.00 0.00 C ATOM 2136 ND1 HIS A1053 -11.318 -28.382 1.250 1.00 0.00 N ATOM 2137 CD2 HIS A1053 -11.018 -26.224 1.218 1.00 0.00 C ATOM 2138 CE1 HIS A1053 -12.268 -27.844 1.988 1.00 0.00 C ATOM 2139 NE2 HIS A1053 -12.114 -26.535 1.987 1.00 0.00 N ATOM 2140 OXT HIS A1053 -7.195 -28.784 1.796 1.00 0.00 O ATOM 0 H HIS A1053 -6.274 -28.033 -0.202 1.00 0.00 H new ATOM 0 HA HIS A1053 -8.157 -25.981 0.474 1.00 0.00 H new ATOM 0 HB2 HIS A1053 -9.535 -27.255 -1.128 1.00 0.00 H new ATOM 0 HB3 HIS A1053 -9.210 -28.735 -0.248 1.00 0.00 H new ATOM 0 HD2 HIS A1053 -10.633 -25.234 1.023 1.00 0.00 H new ATOM 0 HE1 HIS A1053 -13.044 -28.386 2.508 1.00 0.00 H new ATOM 0 HE2 HIS A1053 -12.708 -25.865 2.475 1.00 0.00 H new TER 2149 HIS A1053