USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 957 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: A1009 ASN : amide:sc= -0.455 K(o=-0.46,f=-1.7) USER MOD Set 1.2: A1010 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 975 HIS : no HE2:sc= 0.807 K(o=0.45,f=-5.5!) USER MOD Set 2.2: A 987 THR OG1 : rot 180:sc= -1.54 USER MOD Set 2.3: A 989 SER OG : rot -103:sc= 1.19 USER MOD Set 3.1: A 927 SER OG : rot -59:sc= 1.24 USER MOD Set 3.2: A 944 THR OG1 : rot 38:sc= 2.17 USER MOD Single : A 901 HIS : no HD1:sc= -0.149 K(o=-0.15,f=-1.1) USER MOD Single : A 903 GLN : amide:sc= -3.22! K(o=-3.2!,f=-0.63) USER MOD Single : A 907 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 912 LYS NZ :NH3+ 139:sc= 0.345 (180deg=-0.596) USER MOD Single : A 914 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 THR OG1 : rot 180:sc= 0 USER MOD Single : A 916 GLN : amide:sc= -4.06! C(o=-4.1!,f=-3!) USER MOD Single : A 917 THR OG1 : rot 180:sc= 0.548 USER MOD Single : A 918 THR OG1 : rot 180:sc= 0 USER MOD Single : A 920 SER OG : rot 180:sc= 0 USER MOD Single : A 926 THR OG1 : rot 92:sc= 0.282 USER MOD Single : A 929 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 930 TYR OH : rot 180:sc= -0.417 USER MOD Single : A 936 TYR OH : rot 180:sc= 0 USER MOD Single : A 937 TYR OH : rot 180:sc= 0 USER MOD Single : A 942 SER OG : rot 180:sc= 0 USER MOD Single : A 948 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 952 SER OG : rot 180:sc= 0 USER MOD Single : A 953 SER OG : rot 180:sc= 0 USER MOD Single : A 955 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 959 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 961 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 962 SER OG : rot 180:sc= 0 USER MOD Single : A 964 LYS NZ :NH3+ -165:sc= -0.0422 (180deg=-0.285) USER MOD Single : A 965 THR OG1 : rot 180:sc= -0.0214 USER MOD Single : A 971 ASN : amide:sc= -2.78! C(o=-2.8!,f=-1.6!) USER MOD Single : A 973 MET CE :methyl 157:sc= -0.143 (180deg=-0.671) USER MOD Single : A 978 THR OG1 : rot 180:sc= -0.236 USER MOD Single : A 981 GLN : amide:sc= -6.17! C(o=-6.2!,f=-6!) USER MOD Single : A 984 SER OG : rot -146:sc=0.000969 USER MOD Single : A 988 TYR OH : rot 69:sc= -1.12 USER MOD Single : A 991 THR OG1 : rot 180:sc= 0 USER MOD Single : A 992 THR OG1 : rot 180:sc= 0 USER MOD Single : A 994 HIS : no HD1:sc= -1.64 X(o=-1.6,f=-1.9!) USER MOD Single : A 999 HIS : no HD1:sc= -2.27! K(o=-2.3!,f=-1.3) USER MOD Single : A1000 SER OG : rot 180:sc= 0 USER MOD Single : A1001 SER OG : rot 167:sc= -2.25! USER MOD Single : A1007 SER OG : rot 180:sc= 0 USER MOD Single : A1012 HIS : no HE2:sc= -3.77! C(o=-3.8!,f=-8.7!) USER MOD Single : A1014 SER OG : rot 170:sc= 0.123 USER MOD Single : A1015 THR OG1 : rot -145:sc= -1.97! USER MOD Single : A1016 LYS NZ :NH3+ -165:sc= -0.019 (180deg=-0.288) USER MOD Single : A1021 GLN : amide:sc= -3.52! C(o=-3.5!,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 43 N ALA A 900 37.144 -6.304 -7.019 1.00 0.00 N ATOM 44 CA ALA A 900 36.112 -6.275 -5.989 1.00 0.00 C ATOM 45 C ALA A 900 35.224 -5.047 -6.130 1.00 0.00 C ATOM 46 O ALA A 900 34.877 -4.641 -7.239 1.00 0.00 O ATOM 47 CB ALA A 900 36.746 -6.324 -4.607 1.00 0.00 C ATOM 0 HA ALA A 900 35.481 -7.155 -6.117 1.00 0.00 H new ATOM 0 HB1 ALA A 900 35.965 -6.302 -3.847 1.00 0.00 H new ATOM 0 HB2 ALA A 900 37.325 -7.242 -4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 900 37.403 -5.464 -4.477 1.00 0.00 H new ATOM 53 N HIS A 901 34.856 -4.473 -4.992 1.00 0.00 N ATOM 54 CA HIS A 901 33.995 -3.294 -4.954 1.00 0.00 C ATOM 55 C HIS A 901 32.582 -3.640 -5.403 1.00 0.00 C ATOM 56 O HIS A 901 32.383 -4.242 -6.458 1.00 0.00 O ATOM 57 CB HIS A 901 34.566 -2.174 -5.830 1.00 0.00 C ATOM 58 CG HIS A 901 35.886 -1.653 -5.354 1.00 0.00 C ATOM 59 ND1 HIS A 901 37.009 -2.444 -5.233 1.00 0.00 N ATOM 60 CD2 HIS A 901 36.260 -0.411 -4.965 1.00 0.00 C ATOM 61 CE1 HIS A 901 38.016 -1.712 -4.790 1.00 0.00 C ATOM 62 NE2 HIS A 901 37.588 -0.475 -4.621 1.00 0.00 N ATOM 0 H HIS A 901 35.143 -4.808 -4.072 1.00 0.00 H new ATOM 0 HA HIS A 901 33.956 -2.943 -3.923 1.00 0.00 H new ATOM 0 HB2 HIS A 901 34.677 -2.543 -6.850 1.00 0.00 H new ATOM 0 HB3 HIS A 901 33.852 -1.352 -5.865 1.00 0.00 H new ATOM 0 HD2 HIS A 901 35.631 0.466 -4.932 1.00 0.00 H new ATOM 0 HE1 HIS A 901 39.018 -2.066 -4.599 1.00 0.00 H new ATOM 0 HE2 HIS A 901 38.152 0.307 -4.289 1.00 0.00 H new ATOM 71 N CYS A 902 31.604 -3.254 -4.593 1.00 0.00 N ATOM 72 CA CYS A 902 30.205 -3.519 -4.902 1.00 0.00 C ATOM 73 C CYS A 902 29.661 -2.473 -5.865 1.00 0.00 C ATOM 74 O CYS A 902 29.724 -1.273 -5.596 1.00 0.00 O ATOM 75 CB CYS A 902 29.379 -3.531 -3.614 1.00 0.00 C ATOM 76 SG CYS A 902 29.677 -2.095 -2.534 1.00 0.00 S ATOM 0 H CYS A 902 31.755 -2.756 -3.716 1.00 0.00 H new ATOM 0 HA CYS A 902 30.134 -4.496 -5.380 1.00 0.00 H new ATOM 0 HB2 CYS A 902 28.321 -3.565 -3.873 1.00 0.00 H new ATOM 0 HB3 CYS A 902 29.601 -4.443 -3.060 1.00 0.00 H new ATOM 81 N GLN A 903 29.129 -2.935 -6.992 1.00 0.00 N ATOM 82 CA GLN A 903 28.580 -2.037 -7.999 1.00 0.00 C ATOM 83 C GLN A 903 27.302 -1.379 -7.508 1.00 0.00 C ATOM 84 O GLN A 903 26.712 -1.795 -6.509 1.00 0.00 O ATOM 85 CB GLN A 903 28.295 -2.781 -9.302 1.00 0.00 C ATOM 86 CG GLN A 903 29.498 -3.516 -9.868 1.00 0.00 C ATOM 87 CD GLN A 903 30.633 -2.590 -10.278 1.00 0.00 C ATOM 88 OE1 GLN A 903 31.709 -3.049 -10.662 1.00 0.00 O ATOM 89 NE2 GLN A 903 30.401 -1.282 -10.215 1.00 0.00 N ATOM 0 H GLN A 903 29.067 -3.925 -7.230 1.00 0.00 H new ATOM 0 HA GLN A 903 29.328 -1.266 -8.184 1.00 0.00 H new ATOM 0 HB2 GLN A 903 27.491 -3.497 -9.131 1.00 0.00 H new ATOM 0 HB3 GLN A 903 27.935 -2.069 -10.044 1.00 0.00 H new ATOM 0 HG2 GLN A 903 29.866 -4.223 -9.124 1.00 0.00 H new ATOM 0 HG3 GLN A 903 29.184 -4.099 -10.734 1.00 0.00 H new ATOM 0 HE21 GLN A 903 29.496 -0.940 -9.891 1.00 0.00 H new ATOM 0 HE22 GLN A 903 31.128 -0.621 -10.490 1.00 0.00 H new ATOM 98 N ALA A 904 26.883 -0.351 -8.233 1.00 0.00 N ATOM 99 CA ALA A 904 25.670 0.385 -7.908 1.00 0.00 C ATOM 100 C ALA A 904 24.508 -0.565 -7.630 1.00 0.00 C ATOM 101 O ALA A 904 24.210 -1.443 -8.440 1.00 0.00 O ATOM 102 CB ALA A 904 25.323 1.325 -9.050 1.00 0.00 C ATOM 0 H ALA A 904 27.372 -0.005 -9.059 1.00 0.00 H new ATOM 0 HA ALA A 904 25.848 0.966 -7.003 1.00 0.00 H new ATOM 0 HB1 ALA A 904 24.415 1.875 -8.805 1.00 0.00 H new ATOM 0 HB2 ALA A 904 26.142 2.027 -9.205 1.00 0.00 H new ATOM 0 HB3 ALA A 904 25.163 0.748 -9.961 1.00 0.00 H new ATOM 108 N PRO A 905 23.829 -0.401 -6.482 1.00 0.00 N ATOM 109 CA PRO A 905 22.692 -1.250 -6.114 1.00 0.00 C ATOM 110 C PRO A 905 21.478 -0.995 -7.000 1.00 0.00 C ATOM 111 O PRO A 905 21.104 0.154 -7.235 1.00 0.00 O ATOM 112 CB PRO A 905 22.396 -0.847 -4.669 1.00 0.00 C ATOM 113 CG PRO A 905 22.911 0.546 -4.552 1.00 0.00 C ATOM 114 CD PRO A 905 24.109 0.623 -5.458 1.00 0.00 C ATOM 0 HA PRO A 905 22.917 -2.310 -6.232 1.00 0.00 H new ATOM 0 HB2 PRO A 905 21.328 -0.894 -4.456 1.00 0.00 H new ATOM 0 HB3 PRO A 905 22.892 -1.513 -3.963 1.00 0.00 H new ATOM 0 HG2 PRO A 905 22.151 1.269 -4.848 1.00 0.00 H new ATOM 0 HG3 PRO A 905 23.185 0.775 -3.522 1.00 0.00 H new ATOM 0 HD2 PRO A 905 24.216 1.614 -5.899 1.00 0.00 H new ATOM 0 HD3 PRO A 905 25.034 0.412 -4.921 1.00 0.00 H new ATOM 122 N ASP A 906 20.864 -2.069 -7.486 1.00 0.00 N ATOM 123 CA ASP A 906 19.692 -1.948 -8.343 1.00 0.00 C ATOM 124 C ASP A 906 18.537 -1.300 -7.603 1.00 0.00 C ATOM 125 O ASP A 906 18.438 -1.381 -6.379 1.00 0.00 O ATOM 126 CB ASP A 906 19.266 -3.309 -8.888 1.00 0.00 C ATOM 127 CG ASP A 906 17.873 -3.290 -9.485 1.00 0.00 C ATOM 128 OD1 ASP A 906 17.651 -2.531 -10.451 1.00 0.00 O ATOM 129 OD2 ASP A 906 17.004 -4.036 -8.987 1.00 0.00 O ATOM 0 H ASP A 906 21.157 -3.028 -7.302 1.00 0.00 H new ATOM 0 HA ASP A 906 19.967 -1.309 -9.182 1.00 0.00 H new ATOM 0 HB2 ASP A 906 19.978 -3.631 -9.648 1.00 0.00 H new ATOM 0 HB3 ASP A 906 19.303 -4.045 -8.085 1.00 0.00 H new ATOM 134 N HIS A 907 17.669 -0.654 -8.364 1.00 0.00 N ATOM 135 CA HIS A 907 16.512 0.024 -7.792 1.00 0.00 C ATOM 136 C HIS A 907 15.415 -0.970 -7.450 1.00 0.00 C ATOM 137 O HIS A 907 15.135 -1.895 -8.213 1.00 0.00 O ATOM 138 CB HIS A 907 15.953 1.065 -8.757 1.00 0.00 C ATOM 139 CG HIS A 907 16.981 1.995 -9.306 1.00 0.00 C ATOM 140 ND1 HIS A 907 17.802 2.776 -8.521 1.00 0.00 N ATOM 141 CD2 HIS A 907 17.311 2.268 -10.583 1.00 0.00 C ATOM 142 CE1 HIS A 907 18.596 3.491 -9.299 1.00 0.00 C ATOM 143 NE2 HIS A 907 18.318 3.200 -10.556 1.00 0.00 N ATOM 0 H HIS A 907 17.741 -0.583 -9.379 1.00 0.00 H new ATOM 0 HA HIS A 907 16.848 0.521 -6.882 1.00 0.00 H new ATOM 0 HB2 HIS A 907 15.462 0.552 -9.584 1.00 0.00 H new ATOM 0 HB3 HIS A 907 15.188 1.647 -8.244 1.00 0.00 H new ATOM 0 HD2 HIS A 907 16.865 1.834 -11.466 1.00 0.00 H new ATOM 0 HE1 HIS A 907 19.345 4.193 -8.963 1.00 0.00 H new ATOM 0 HE2 HIS A 907 18.777 3.602 -11.374 1.00 0.00 H new ATOM 152 N PHE A 908 14.785 -0.755 -6.308 1.00 0.00 N ATOM 153 CA PHE A 908 13.698 -1.613 -5.864 1.00 0.00 C ATOM 154 C PHE A 908 12.368 -1.085 -6.394 1.00 0.00 C ATOM 155 O PHE A 908 12.295 -0.623 -7.531 1.00 0.00 O ATOM 156 CB PHE A 908 13.674 -1.708 -4.335 1.00 0.00 C ATOM 157 CG PHE A 908 14.851 -2.444 -3.755 1.00 0.00 C ATOM 158 CD1 PHE A 908 16.149 -2.040 -4.029 1.00 0.00 C ATOM 159 CD2 PHE A 908 14.656 -3.545 -2.937 1.00 0.00 C ATOM 160 CE1 PHE A 908 17.228 -2.719 -3.497 1.00 0.00 C ATOM 161 CE2 PHE A 908 15.731 -4.229 -2.402 1.00 0.00 C ATOM 162 CZ PHE A 908 17.018 -3.815 -2.682 1.00 0.00 C ATOM 0 H PHE A 908 15.008 0.008 -5.669 1.00 0.00 H new ATOM 0 HA PHE A 908 13.858 -2.616 -6.260 1.00 0.00 H new ATOM 0 HB2 PHE A 908 13.645 -0.701 -3.918 1.00 0.00 H new ATOM 0 HB3 PHE A 908 12.756 -2.208 -4.025 1.00 0.00 H new ATOM 0 HD1 PHE A 908 16.318 -1.184 -4.666 1.00 0.00 H new ATOM 0 HD2 PHE A 908 13.651 -3.873 -2.715 1.00 0.00 H new ATOM 0 HE1 PHE A 908 18.234 -2.394 -3.718 1.00 0.00 H new ATOM 0 HE2 PHE A 908 15.565 -5.086 -1.766 1.00 0.00 H new ATOM 0 HZ PHE A 908 17.860 -4.347 -2.264 1.00 0.00 H new ATOM 172 N LEU A 909 11.326 -1.141 -5.568 1.00 0.00 N ATOM 173 CA LEU A 909 10.008 -0.657 -5.966 1.00 0.00 C ATOM 174 C LEU A 909 9.191 -0.234 -4.756 1.00 0.00 C ATOM 175 O LEU A 909 8.471 0.761 -4.802 1.00 0.00 O ATOM 176 CB LEU A 909 9.246 -1.726 -6.748 1.00 0.00 C ATOM 177 CG LEU A 909 9.790 -2.026 -8.143 1.00 0.00 C ATOM 178 CD1 LEU A 909 8.940 -3.089 -8.816 1.00 0.00 C ATOM 179 CD2 LEU A 909 9.827 -0.757 -8.983 1.00 0.00 C ATOM 0 H LEU A 909 11.369 -1.516 -4.621 1.00 0.00 H new ATOM 0 HA LEU A 909 10.161 0.211 -6.608 1.00 0.00 H new ATOM 0 HB2 LEU A 909 9.250 -2.649 -6.168 1.00 0.00 H new ATOM 0 HB3 LEU A 909 8.206 -1.413 -6.841 1.00 0.00 H new ATOM 0 HG LEU A 909 10.809 -2.403 -8.050 1.00 0.00 H new ATOM 0 HD11 LEU A 909 9.336 -3.296 -9.810 1.00 0.00 H new ATOM 0 HD12 LEU A 909 8.960 -4.002 -8.220 1.00 0.00 H new ATOM 0 HD13 LEU A 909 7.913 -2.734 -8.901 1.00 0.00 H new ATOM 0 HD21 LEU A 909 10.217 -0.988 -9.974 1.00 0.00 H new ATOM 0 HD22 LEU A 909 8.819 -0.352 -9.075 1.00 0.00 H new ATOM 0 HD23 LEU A 909 10.471 -0.021 -8.502 1.00 0.00 H new ATOM 191 N PHE A 910 9.304 -0.992 -3.675 1.00 0.00 N ATOM 192 CA PHE A 910 8.571 -0.682 -2.458 1.00 0.00 C ATOM 193 C PHE A 910 9.302 0.383 -1.651 1.00 0.00 C ATOM 194 O PHE A 910 8.789 0.876 -0.646 1.00 0.00 O ATOM 195 CB PHE A 910 8.356 -1.948 -1.621 1.00 0.00 C ATOM 196 CG PHE A 910 9.593 -2.784 -1.427 1.00 0.00 C ATOM 197 CD1 PHE A 910 10.742 -2.244 -0.871 1.00 0.00 C ATOM 198 CD2 PHE A 910 9.598 -4.121 -1.796 1.00 0.00 C ATOM 199 CE1 PHE A 910 11.871 -3.019 -0.687 1.00 0.00 C ATOM 200 CE2 PHE A 910 10.723 -4.901 -1.614 1.00 0.00 C ATOM 201 CZ PHE A 910 11.861 -4.349 -1.060 1.00 0.00 C ATOM 0 H PHE A 910 9.894 -1.822 -3.616 1.00 0.00 H new ATOM 0 HA PHE A 910 7.593 -0.288 -2.735 1.00 0.00 H new ATOM 0 HB2 PHE A 910 7.970 -1.661 -0.643 1.00 0.00 H new ATOM 0 HB3 PHE A 910 7.591 -2.559 -2.099 1.00 0.00 H new ATOM 0 HD1 PHE A 910 10.755 -1.205 -0.578 1.00 0.00 H new ATOM 0 HD2 PHE A 910 8.711 -4.557 -2.231 1.00 0.00 H new ATOM 0 HE1 PHE A 910 12.760 -2.586 -0.252 1.00 0.00 H new ATOM 0 HE2 PHE A 910 10.713 -5.941 -1.905 1.00 0.00 H new ATOM 0 HZ PHE A 910 12.743 -4.957 -0.918 1.00 0.00 H new ATOM 211 N ALA A 911 10.501 0.738 -2.104 1.00 0.00 N ATOM 212 CA ALA A 911 11.304 1.753 -1.430 1.00 0.00 C ATOM 213 C ALA A 911 12.329 2.367 -2.376 1.00 0.00 C ATOM 214 O ALA A 911 13.089 1.651 -3.030 1.00 0.00 O ATOM 215 CB ALA A 911 11.997 1.157 -0.216 1.00 0.00 C ATOM 0 H ALA A 911 10.938 0.338 -2.935 1.00 0.00 H new ATOM 0 HA ALA A 911 10.634 2.547 -1.101 1.00 0.00 H new ATOM 0 HB1 ALA A 911 12.592 1.926 0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 911 11.249 0.776 0.479 1.00 0.00 H new ATOM 0 HB3 ALA A 911 12.647 0.341 -0.532 1.00 0.00 H new ATOM 221 N LYS A 912 12.356 3.694 -2.437 1.00 0.00 N ATOM 222 CA LYS A 912 13.302 4.397 -3.297 1.00 0.00 C ATOM 223 C LYS A 912 14.508 4.879 -2.497 1.00 0.00 C ATOM 224 O LYS A 912 14.362 5.421 -1.398 1.00 0.00 O ATOM 225 CB LYS A 912 12.620 5.577 -3.993 1.00 0.00 C ATOM 226 CG LYS A 912 12.008 6.587 -3.036 1.00 0.00 C ATOM 227 CD LYS A 912 11.300 7.704 -3.786 1.00 0.00 C ATOM 228 CE LYS A 912 10.685 8.715 -2.832 1.00 0.00 C ATOM 229 NZ LYS A 912 11.716 9.385 -1.993 1.00 0.00 N ATOM 0 H LYS A 912 11.736 4.303 -1.903 1.00 0.00 H new ATOM 0 HA LYS A 912 13.652 3.699 -4.057 1.00 0.00 H new ATOM 0 HB2 LYS A 912 13.349 6.085 -4.624 1.00 0.00 H new ATOM 0 HB3 LYS A 912 11.839 5.196 -4.651 1.00 0.00 H new ATOM 0 HG2 LYS A 912 11.300 6.084 -2.377 1.00 0.00 H new ATOM 0 HG3 LYS A 912 12.788 7.009 -2.403 1.00 0.00 H new ATOM 0 HD2 LYS A 912 12.008 8.208 -4.444 1.00 0.00 H new ATOM 0 HD3 LYS A 912 10.521 7.281 -4.420 1.00 0.00 H new ATOM 0 HE2 LYS A 912 10.137 9.465 -3.402 1.00 0.00 H new ATOM 0 HE3 LYS A 912 9.963 8.214 -2.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 912 11.492 10.397 -1.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 912 11.727 8.954 -1.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 912 12.650 9.272 -2.435 1.00 0.00 H new ATOM 243 N LEU A 913 15.700 4.670 -3.052 1.00 0.00 N ATOM 244 CA LEU A 913 16.939 5.077 -2.397 1.00 0.00 C ATOM 245 C LEU A 913 16.862 6.519 -1.910 1.00 0.00 C ATOM 246 O LEU A 913 16.579 7.434 -2.684 1.00 0.00 O ATOM 247 CB LEU A 913 18.126 4.910 -3.348 1.00 0.00 C ATOM 248 CG LEU A 913 19.454 5.485 -2.842 1.00 0.00 C ATOM 249 CD1 LEU A 913 19.830 4.879 -1.499 1.00 0.00 C ATOM 250 CD2 LEU A 913 20.555 5.247 -3.860 1.00 0.00 C ATOM 0 H LEU A 913 15.833 4.219 -3.957 1.00 0.00 H new ATOM 0 HA LEU A 913 17.082 4.432 -1.530 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.262 3.848 -3.550 1.00 0.00 H new ATOM 0 HB3 LEU A 913 17.880 5.386 -4.297 1.00 0.00 H new ATOM 0 HG LEU A 913 19.331 6.560 -2.706 1.00 0.00 H new ATOM 0 HD11 LEU A 913 20.776 5.303 -1.161 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.051 5.101 -0.769 1.00 0.00 H new ATOM 0 HD13 LEU A 913 19.933 3.799 -1.603 1.00 0.00 H new ATOM 0 HD21 LEU A 913 21.492 5.661 -3.486 1.00 0.00 H new ATOM 0 HD22 LEU A 913 20.672 4.176 -4.026 1.00 0.00 H new ATOM 0 HD23 LEU A 913 20.293 5.733 -4.800 1.00 0.00 H new ATOM 262 N LYS A 914 17.125 6.713 -0.623 1.00 0.00 N ATOM 263 CA LYS A 914 17.096 8.041 -0.026 1.00 0.00 C ATOM 264 C LYS A 914 18.494 8.654 -0.014 1.00 0.00 C ATOM 265 O LYS A 914 18.673 9.831 -0.325 1.00 0.00 O ATOM 266 CB LYS A 914 16.546 7.964 1.399 1.00 0.00 C ATOM 267 CG LYS A 914 16.336 9.322 2.043 1.00 0.00 C ATOM 268 CD LYS A 914 15.775 9.192 3.448 1.00 0.00 C ATOM 269 CE LYS A 914 15.533 10.552 4.080 1.00 0.00 C ATOM 270 NZ LYS A 914 14.961 10.437 5.449 1.00 0.00 N ATOM 0 H LYS A 914 17.361 5.964 0.028 1.00 0.00 H new ATOM 0 HA LYS A 914 16.444 8.676 -0.626 1.00 0.00 H new ATOM 0 HB2 LYS A 914 15.597 7.427 1.385 1.00 0.00 H new ATOM 0 HB3 LYS A 914 17.233 7.382 2.014 1.00 0.00 H new ATOM 0 HG2 LYS A 914 17.283 9.860 2.077 1.00 0.00 H new ATOM 0 HG3 LYS A 914 15.655 9.914 1.432 1.00 0.00 H new ATOM 0 HD2 LYS A 914 14.840 8.633 3.417 1.00 0.00 H new ATOM 0 HD3 LYS A 914 16.468 8.621 4.066 1.00 0.00 H new ATOM 0 HE2 LYS A 914 16.472 11.103 4.125 1.00 0.00 H new ATOM 0 HE3 LYS A 914 14.855 11.129 3.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 914 14.811 11.387 5.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 914 14.052 9.934 5.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 914 15.619 9.909 6.057 1.00 0.00 H new ATOM 284 N THR A 915 19.479 7.839 0.352 1.00 0.00 N ATOM 285 CA THR A 915 20.869 8.282 0.413 1.00 0.00 C ATOM 286 C THR A 915 21.406 8.654 -0.965 1.00 0.00 C ATOM 287 O THR A 915 21.203 7.930 -1.940 1.00 0.00 O ATOM 288 CB THR A 915 21.772 7.190 1.022 1.00 0.00 C ATOM 289 OG1 THR A 915 21.444 6.996 2.403 1.00 0.00 O ATOM 290 CG2 THR A 915 23.243 7.558 0.889 1.00 0.00 C ATOM 0 H THR A 915 19.339 6.863 0.612 1.00 0.00 H new ATOM 0 HA THR A 915 20.886 9.168 1.048 1.00 0.00 H new ATOM 0 HB THR A 915 21.599 6.264 0.474 1.00 0.00 H new ATOM 0 HG1 THR A 915 22.021 6.300 2.782 1.00 0.00 H new ATOM 0 HG21 THR A 915 23.856 6.770 1.327 1.00 0.00 H new ATOM 0 HG22 THR A 915 23.496 7.671 -0.165 1.00 0.00 H new ATOM 0 HG23 THR A 915 23.432 8.497 1.410 1.00 0.00 H new ATOM 298 N GLN A 916 22.108 9.782 -1.033 1.00 0.00 N ATOM 299 CA GLN A 916 22.695 10.244 -2.285 1.00 0.00 C ATOM 300 C GLN A 916 23.750 9.254 -2.764 1.00 0.00 C ATOM 301 O GLN A 916 24.457 8.655 -1.953 1.00 0.00 O ATOM 302 CB GLN A 916 23.321 11.630 -2.112 1.00 0.00 C ATOM 303 CG GLN A 916 24.542 11.640 -1.210 1.00 0.00 C ATOM 304 CD GLN A 916 24.220 11.270 0.224 1.00 0.00 C ATOM 305 OE1 GLN A 916 23.429 11.942 0.887 1.00 0.00 O ATOM 306 NE2 GLN A 916 24.833 10.197 0.713 1.00 0.00 N ATOM 0 H GLN A 916 22.284 10.392 -0.235 1.00 0.00 H new ATOM 0 HA GLN A 916 21.903 10.313 -3.031 1.00 0.00 H new ATOM 0 HB2 GLN A 916 23.601 12.017 -3.092 1.00 0.00 H new ATOM 0 HB3 GLN A 916 22.572 12.309 -1.703 1.00 0.00 H new ATOM 0 HG2 GLN A 916 25.283 10.943 -1.602 1.00 0.00 H new ATOM 0 HG3 GLN A 916 24.995 12.631 -1.231 1.00 0.00 H new ATOM 0 HE21 GLN A 916 25.481 9.669 0.128 1.00 0.00 H new ATOM 0 HE22 GLN A 916 24.655 9.901 1.673 1.00 0.00 H new ATOM 315 N THR A 917 23.851 9.079 -4.079 1.00 0.00 N ATOM 316 CA THR A 917 24.820 8.148 -4.646 1.00 0.00 C ATOM 317 C THR A 917 25.277 8.595 -6.037 1.00 0.00 C ATOM 318 O THR A 917 26.285 9.290 -6.164 1.00 0.00 O ATOM 319 CB THR A 917 24.237 6.720 -4.731 1.00 0.00 C ATOM 320 OG1 THR A 917 23.009 6.729 -5.469 1.00 0.00 O ATOM 321 CG2 THR A 917 23.991 6.145 -3.344 1.00 0.00 C ATOM 0 H THR A 917 23.277 9.566 -4.767 1.00 0.00 H new ATOM 0 HA THR A 917 25.682 8.141 -3.979 1.00 0.00 H new ATOM 0 HB THR A 917 24.966 6.092 -5.244 1.00 0.00 H new ATOM 0 HG1 THR A 917 22.650 5.818 -5.518 1.00 0.00 H new ATOM 0 HG21 THR A 917 23.581 5.139 -3.435 1.00 0.00 H new ATOM 0 HG22 THR A 917 24.932 6.105 -2.795 1.00 0.00 H new ATOM 0 HG23 THR A 917 23.284 6.778 -2.808 1.00 0.00 H new ATOM 329 N THR A 918 24.528 8.200 -7.069 1.00 0.00 N ATOM 330 CA THR A 918 24.848 8.562 -8.452 1.00 0.00 C ATOM 331 C THR A 918 26.058 7.790 -8.989 1.00 0.00 C ATOM 332 O THR A 918 26.076 7.390 -10.152 1.00 0.00 O ATOM 333 CB THR A 918 25.111 10.075 -8.599 1.00 0.00 C ATOM 334 OG1 THR A 918 23.970 10.816 -8.150 1.00 0.00 O ATOM 335 CG2 THR A 918 25.416 10.437 -10.045 1.00 0.00 C ATOM 0 H THR A 918 23.691 7.626 -6.972 1.00 0.00 H new ATOM 0 HA THR A 918 23.972 8.290 -9.041 1.00 0.00 H new ATOM 0 HB THR A 918 25.976 10.330 -7.987 1.00 0.00 H new ATOM 0 HG1 THR A 918 24.145 11.776 -8.245 1.00 0.00 H new ATOM 0 HG21 THR A 918 25.598 11.509 -10.121 1.00 0.00 H new ATOM 0 HG22 THR A 918 26.301 9.895 -10.377 1.00 0.00 H new ATOM 0 HG23 THR A 918 24.568 10.167 -10.674 1.00 0.00 H new ATOM 343 N ALA A 919 27.067 7.587 -8.144 1.00 0.00 N ATOM 344 CA ALA A 919 28.273 6.871 -8.552 1.00 0.00 C ATOM 345 C ALA A 919 27.989 5.390 -8.782 1.00 0.00 C ATOM 346 O ALA A 919 27.286 4.755 -7.998 1.00 0.00 O ATOM 347 CB ALA A 919 29.365 7.043 -7.506 1.00 0.00 C ATOM 0 H ALA A 919 27.073 7.907 -7.176 1.00 0.00 H new ATOM 0 HA ALA A 919 28.614 7.296 -9.496 1.00 0.00 H new ATOM 0 HB1 ALA A 919 30.259 6.505 -7.821 1.00 0.00 H new ATOM 0 HB2 ALA A 919 29.599 8.102 -7.395 1.00 0.00 H new ATOM 0 HB3 ALA A 919 29.020 6.646 -6.551 1.00 0.00 H new ATOM 353 N SER A 920 28.536 4.848 -9.867 1.00 0.00 N ATOM 354 CA SER A 920 28.338 3.440 -10.203 1.00 0.00 C ATOM 355 C SER A 920 29.415 2.559 -9.570 1.00 0.00 C ATOM 356 O SER A 920 29.826 1.554 -10.151 1.00 0.00 O ATOM 357 CB SER A 920 28.343 3.254 -11.722 1.00 0.00 C ATOM 358 OG SER A 920 29.571 3.681 -12.285 1.00 0.00 O ATOM 0 H SER A 920 29.119 5.361 -10.528 1.00 0.00 H new ATOM 0 HA SER A 920 27.371 3.135 -9.803 1.00 0.00 H new ATOM 0 HB2 SER A 920 28.174 2.205 -11.963 1.00 0.00 H new ATOM 0 HB3 SER A 920 27.522 3.819 -12.163 1.00 0.00 H new ATOM 0 HG SER A 920 29.549 3.550 -13.256 1.00 0.00 H new ATOM 364 N ASP A 921 29.860 2.935 -8.376 1.00 0.00 N ATOM 365 CA ASP A 921 30.882 2.171 -7.663 1.00 0.00 C ATOM 366 C ASP A 921 30.824 2.451 -6.166 1.00 0.00 C ATOM 367 O ASP A 921 30.690 3.601 -5.745 1.00 0.00 O ATOM 368 CB ASP A 921 32.275 2.493 -8.209 1.00 0.00 C ATOM 369 CG ASP A 921 32.565 3.981 -8.236 1.00 0.00 C ATOM 370 OD1 ASP A 921 32.576 4.606 -7.155 1.00 0.00 O ATOM 371 OD2 ASP A 921 32.782 4.523 -9.341 1.00 0.00 O ATOM 0 H ASP A 921 29.531 3.763 -7.880 1.00 0.00 H new ATOM 0 HA ASP A 921 30.682 1.111 -7.822 1.00 0.00 H new ATOM 0 HB2 ASP A 921 33.025 1.992 -7.597 1.00 0.00 H new ATOM 0 HB3 ASP A 921 32.367 2.091 -9.218 1.00 0.00 H new ATOM 376 N PHE A 922 30.918 1.395 -5.363 1.00 0.00 N ATOM 377 CA PHE A 922 30.869 1.538 -3.912 1.00 0.00 C ATOM 378 C PHE A 922 31.805 0.560 -3.212 1.00 0.00 C ATOM 379 O PHE A 922 31.887 -0.611 -3.581 1.00 0.00 O ATOM 380 CB PHE A 922 29.446 1.328 -3.390 1.00 0.00 C ATOM 381 CG PHE A 922 28.493 2.420 -3.770 1.00 0.00 C ATOM 382 CD1 PHE A 922 27.909 2.447 -5.026 1.00 0.00 C ATOM 383 CD2 PHE A 922 28.177 3.416 -2.864 1.00 0.00 C ATOM 384 CE1 PHE A 922 27.028 3.452 -5.370 1.00 0.00 C ATOM 385 CE2 PHE A 922 27.297 4.423 -3.202 1.00 0.00 C ATOM 386 CZ PHE A 922 26.722 4.441 -4.457 1.00 0.00 C ATOM 0 H PHE A 922 31.028 0.435 -5.691 1.00 0.00 H new ATOM 0 HA PHE A 922 31.196 2.553 -3.687 1.00 0.00 H new ATOM 0 HB2 PHE A 922 29.066 0.379 -3.770 1.00 0.00 H new ATOM 0 HB3 PHE A 922 29.476 1.247 -2.303 1.00 0.00 H new ATOM 0 HD1 PHE A 922 28.145 1.674 -5.743 1.00 0.00 H new ATOM 0 HD2 PHE A 922 28.624 3.405 -1.881 1.00 0.00 H new ATOM 0 HE1 PHE A 922 26.579 3.465 -6.352 1.00 0.00 H new ATOM 0 HE2 PHE A 922 27.058 5.196 -2.486 1.00 0.00 H new ATOM 0 HZ PHE A 922 26.033 5.229 -4.724 1.00 0.00 H new ATOM 396 N PRO A 923 32.511 1.032 -2.172 1.00 0.00 N ATOM 397 CA PRO A 923 33.427 0.203 -1.393 1.00 0.00 C ATOM 398 C PRO A 923 32.681 -0.622 -0.350 1.00 0.00 C ATOM 399 O PRO A 923 31.739 -0.131 0.274 1.00 0.00 O ATOM 400 CB PRO A 923 34.325 1.235 -0.719 1.00 0.00 C ATOM 401 CG PRO A 923 33.434 2.413 -0.508 1.00 0.00 C ATOM 402 CD PRO A 923 32.456 2.417 -1.658 1.00 0.00 C ATOM 0 HA PRO A 923 33.969 -0.520 -2.002 1.00 0.00 H new ATOM 0 HB2 PRO A 923 34.722 0.862 0.225 1.00 0.00 H new ATOM 0 HB3 PRO A 923 35.180 1.489 -1.346 1.00 0.00 H new ATOM 0 HG2 PRO A 923 32.912 2.339 0.446 1.00 0.00 H new ATOM 0 HG3 PRO A 923 34.011 3.338 -0.485 1.00 0.00 H new ATOM 0 HD2 PRO A 923 31.451 2.682 -1.328 1.00 0.00 H new ATOM 0 HD3 PRO A 923 32.741 3.139 -2.423 1.00 0.00 H new ATOM 410 N ILE A 924 33.097 -1.871 -0.159 1.00 0.00 N ATOM 411 CA ILE A 924 32.448 -2.741 0.818 1.00 0.00 C ATOM 412 C ILE A 924 32.357 -2.051 2.172 1.00 0.00 C ATOM 413 O ILE A 924 33.268 -1.330 2.578 1.00 0.00 O ATOM 414 CB ILE A 924 33.186 -4.080 0.978 1.00 0.00 C ATOM 415 CG1 ILE A 924 33.476 -4.695 -0.394 1.00 0.00 C ATOM 416 CG2 ILE A 924 32.341 -5.023 1.816 1.00 0.00 C ATOM 417 CD1 ILE A 924 34.260 -5.988 -0.328 1.00 0.00 C ATOM 0 H ILE A 924 33.873 -2.301 -0.662 1.00 0.00 H new ATOM 0 HA ILE A 924 31.446 -2.947 0.442 1.00 0.00 H new ATOM 0 HB ILE A 924 34.138 -3.910 1.481 1.00 0.00 H new ATOM 0 HG12 ILE A 924 32.532 -4.879 -0.907 1.00 0.00 H new ATOM 0 HG13 ILE A 924 34.030 -3.975 -0.995 1.00 0.00 H new ATOM 0 HG21 ILE A 924 32.862 -5.973 1.931 1.00 0.00 H new ATOM 0 HG22 ILE A 924 32.169 -4.582 2.798 1.00 0.00 H new ATOM 0 HG23 ILE A 924 31.384 -5.191 1.321 1.00 0.00 H new ATOM 0 HD11 ILE A 924 34.427 -6.364 -1.337 1.00 0.00 H new ATOM 0 HD12 ILE A 924 35.220 -5.807 0.156 1.00 0.00 H new ATOM 0 HD13 ILE A 924 33.698 -6.725 0.245 1.00 0.00 H new ATOM 429 N GLY A 925 31.235 -2.255 2.852 1.00 0.00 N ATOM 430 CA GLY A 925 31.020 -1.625 4.138 1.00 0.00 C ATOM 431 C GLY A 925 30.025 -0.491 4.019 1.00 0.00 C ATOM 432 O GLY A 925 29.301 -0.176 4.963 1.00 0.00 O ATOM 0 H GLY A 925 30.469 -2.848 2.533 1.00 0.00 H new ATOM 0 HA2 GLY A 925 30.655 -2.362 4.853 1.00 0.00 H new ATOM 0 HA3 GLY A 925 31.966 -1.246 4.526 1.00 0.00 H new ATOM 436 N THR A 926 29.997 0.113 2.836 1.00 0.00 N ATOM 437 CA THR A 926 29.093 1.215 2.543 1.00 0.00 C ATOM 438 C THR A 926 27.640 0.828 2.809 1.00 0.00 C ATOM 439 O THR A 926 27.220 -0.290 2.512 1.00 0.00 O ATOM 440 CB THR A 926 29.238 1.661 1.075 1.00 0.00 C ATOM 441 OG1 THR A 926 30.523 2.260 0.867 1.00 0.00 O ATOM 442 CG2 THR A 926 28.144 2.642 0.689 1.00 0.00 C ATOM 0 H THR A 926 30.600 -0.148 2.056 1.00 0.00 H new ATOM 0 HA THR A 926 29.363 2.040 3.203 1.00 0.00 H new ATOM 0 HB THR A 926 29.144 0.777 0.444 1.00 0.00 H new ATOM 0 HG1 THR A 926 31.158 1.576 0.568 1.00 0.00 H new ATOM 0 HG21 THR A 926 28.272 2.939 -0.352 1.00 0.00 H new ATOM 0 HG22 THR A 926 27.170 2.169 0.814 1.00 0.00 H new ATOM 0 HG23 THR A 926 28.204 3.523 1.328 1.00 0.00 H new ATOM 450 N SER A 927 26.881 1.763 3.373 1.00 0.00 N ATOM 451 CA SER A 927 25.476 1.527 3.682 1.00 0.00 C ATOM 452 C SER A 927 24.581 2.533 2.967 1.00 0.00 C ATOM 453 O SER A 927 24.908 3.717 2.877 1.00 0.00 O ATOM 454 CB SER A 927 25.243 1.613 5.193 1.00 0.00 C ATOM 455 OG SER A 927 26.033 0.665 5.887 1.00 0.00 O ATOM 0 H SER A 927 27.217 2.692 3.625 1.00 0.00 H new ATOM 0 HA SER A 927 25.220 0.526 3.333 1.00 0.00 H new ATOM 0 HB2 SER A 927 25.482 2.617 5.544 1.00 0.00 H new ATOM 0 HB3 SER A 927 24.189 1.442 5.412 1.00 0.00 H new ATOM 0 HG SER A 927 25.810 -0.237 5.576 1.00 0.00 H new ATOM 461 N LEU A 928 23.443 2.056 2.471 1.00 0.00 N ATOM 462 CA LEU A 928 22.491 2.915 1.775 1.00 0.00 C ATOM 463 C LEU A 928 21.081 2.675 2.300 1.00 0.00 C ATOM 464 O LEU A 928 20.556 1.566 2.215 1.00 0.00 O ATOM 465 CB LEU A 928 22.535 2.659 0.266 1.00 0.00 C ATOM 466 CG LEU A 928 23.868 2.981 -0.413 1.00 0.00 C ATOM 467 CD1 LEU A 928 23.791 2.682 -1.902 1.00 0.00 C ATOM 468 CD2 LEU A 928 24.250 4.435 -0.180 1.00 0.00 C ATOM 0 H LEU A 928 23.158 1.079 2.538 1.00 0.00 H new ATOM 0 HA LEU A 928 22.768 3.953 1.961 1.00 0.00 H new ATOM 0 HB2 LEU A 928 22.298 1.611 0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 928 21.752 3.250 -0.209 1.00 0.00 H new ATOM 0 HG LEU A 928 24.640 2.349 0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 928 24.747 2.916 -2.370 1.00 0.00 H new ATOM 0 HD12 LEU A 928 23.564 1.626 -2.050 1.00 0.00 H new ATOM 0 HD13 LEU A 928 23.007 3.289 -2.355 1.00 0.00 H new ATOM 0 HD21 LEU A 928 25.201 4.645 -0.670 1.00 0.00 H new ATOM 0 HD22 LEU A 928 23.478 5.085 -0.592 1.00 0.00 H new ATOM 0 HD23 LEU A 928 24.346 4.619 0.890 1.00 0.00 H new ATOM 480 N LYS A 929 20.478 3.720 2.855 1.00 0.00 N ATOM 481 CA LYS A 929 19.134 3.623 3.410 1.00 0.00 C ATOM 482 C LYS A 929 18.073 3.921 2.355 1.00 0.00 C ATOM 483 O LYS A 929 18.121 4.951 1.683 1.00 0.00 O ATOM 484 CB LYS A 929 18.986 4.584 4.590 1.00 0.00 C ATOM 485 CG LYS A 929 17.627 4.522 5.268 1.00 0.00 C ATOM 486 CD LYS A 929 17.584 5.394 6.512 1.00 0.00 C ATOM 487 CE LYS A 929 18.597 4.936 7.551 1.00 0.00 C ATOM 488 NZ LYS A 929 18.569 5.788 8.772 1.00 0.00 N ATOM 0 H LYS A 929 20.900 4.645 2.932 1.00 0.00 H new ATOM 0 HA LYS A 929 18.985 2.600 3.755 1.00 0.00 H new ATOM 0 HB2 LYS A 929 19.759 4.362 5.326 1.00 0.00 H new ATOM 0 HB3 LYS A 929 19.161 5.602 4.241 1.00 0.00 H new ATOM 0 HG2 LYS A 929 16.856 4.845 4.569 1.00 0.00 H new ATOM 0 HG3 LYS A 929 17.401 3.490 5.538 1.00 0.00 H new ATOM 0 HD2 LYS A 929 17.785 6.430 6.238 1.00 0.00 H new ATOM 0 HD3 LYS A 929 16.583 5.367 6.942 1.00 0.00 H new ATOM 0 HE2 LYS A 929 18.391 3.902 7.826 1.00 0.00 H new ATOM 0 HE3 LYS A 929 19.597 4.958 7.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 19.274 5.441 9.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 18.790 6.771 8.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 17.623 5.748 9.202 1.00 0.00 H new ATOM 502 N TYR A 930 17.105 3.017 2.229 1.00 0.00 N ATOM 503 CA TYR A 930 16.017 3.185 1.271 1.00 0.00 C ATOM 504 C TYR A 930 14.704 3.439 1.999 1.00 0.00 C ATOM 505 O TYR A 930 14.335 2.693 2.907 1.00 0.00 O ATOM 506 CB TYR A 930 15.882 1.948 0.376 1.00 0.00 C ATOM 507 CG TYR A 930 17.016 1.763 -0.608 1.00 0.00 C ATOM 508 CD1 TYR A 930 18.341 1.779 -0.191 1.00 0.00 C ATOM 509 CD2 TYR A 930 16.756 1.567 -1.958 1.00 0.00 C ATOM 510 CE1 TYR A 930 19.374 1.606 -1.091 1.00 0.00 C ATOM 511 CE2 TYR A 930 17.784 1.392 -2.865 1.00 0.00 C ATOM 512 CZ TYR A 930 19.090 1.413 -2.427 1.00 0.00 C ATOM 513 OH TYR A 930 20.117 1.240 -3.326 1.00 0.00 O ATOM 0 H TYR A 930 17.052 2.160 2.779 1.00 0.00 H new ATOM 0 HA TYR A 930 16.250 4.045 0.644 1.00 0.00 H new ATOM 0 HB2 TYR A 930 15.817 1.062 1.008 1.00 0.00 H new ATOM 0 HB3 TYR A 930 14.945 2.015 -0.176 1.00 0.00 H new ATOM 0 HD1 TYR A 930 18.567 1.929 0.854 1.00 0.00 H new ATOM 0 HD2 TYR A 930 15.733 1.551 -2.305 1.00 0.00 H new ATOM 0 HE1 TYR A 930 20.399 1.622 -0.751 1.00 0.00 H new ATOM 0 HE2 TYR A 930 17.565 1.240 -3.911 1.00 0.00 H new ATOM 0 HH TYR A 930 19.747 1.115 -4.225 1.00 0.00 H new ATOM 523 N GLU A 931 13.998 4.491 1.598 1.00 0.00 N ATOM 524 CA GLU A 931 12.725 4.828 2.221 1.00 0.00 C ATOM 525 C GLU A 931 11.554 4.293 1.403 1.00 0.00 C ATOM 526 O GLU A 931 11.475 4.514 0.195 1.00 0.00 O ATOM 527 CB GLU A 931 12.605 6.344 2.402 1.00 0.00 C ATOM 528 CG GLU A 931 12.848 7.137 1.128 1.00 0.00 C ATOM 529 CD GLU A 931 12.726 8.634 1.342 1.00 0.00 C ATOM 530 OE1 GLU A 931 12.429 9.050 2.481 1.00 0.00 O ATOM 531 OE2 GLU A 931 12.928 9.390 0.369 1.00 0.00 O ATOM 0 H GLU A 931 14.284 5.121 0.849 1.00 0.00 H new ATOM 0 HA GLU A 931 12.693 4.355 3.202 1.00 0.00 H new ATOM 0 HB2 GLU A 931 11.609 6.577 2.779 1.00 0.00 H new ATOM 0 HB3 GLU A 931 13.317 6.667 3.161 1.00 0.00 H new ATOM 0 HG2 GLU A 931 13.843 6.908 0.746 1.00 0.00 H new ATOM 0 HG3 GLU A 931 12.134 6.823 0.367 1.00 0.00 H new ATOM 538 N CYS A 932 10.645 3.590 2.074 1.00 0.00 N ATOM 539 CA CYS A 932 9.472 3.024 1.414 1.00 0.00 C ATOM 540 C CYS A 932 8.674 4.119 0.714 1.00 0.00 C ATOM 541 O CYS A 932 8.806 5.299 1.039 1.00 0.00 O ATOM 542 CB CYS A 932 8.577 2.299 2.426 1.00 0.00 C ATOM 543 SG CYS A 932 9.408 0.982 3.378 1.00 0.00 S ATOM 0 H CYS A 932 10.698 3.399 3.074 1.00 0.00 H new ATOM 0 HA CYS A 932 9.817 2.305 0.671 1.00 0.00 H new ATOM 0 HB2 CYS A 932 8.173 3.033 3.124 1.00 0.00 H new ATOM 0 HB3 CYS A 932 7.730 1.865 1.895 1.00 0.00 H new ATOM 548 N ARG A 933 7.842 3.726 -0.244 1.00 0.00 N ATOM 549 CA ARG A 933 7.021 4.679 -0.981 1.00 0.00 C ATOM 550 C ARG A 933 5.770 5.039 -0.180 1.00 0.00 C ATOM 551 O ARG A 933 5.372 4.297 0.718 1.00 0.00 O ATOM 552 CB ARG A 933 6.637 4.112 -2.351 1.00 0.00 C ATOM 553 CG ARG A 933 7.820 3.944 -3.292 1.00 0.00 C ATOM 554 CD ARG A 933 7.388 3.417 -4.653 1.00 0.00 C ATOM 555 NE ARG A 933 8.489 3.406 -5.611 1.00 0.00 N ATOM 556 CZ ARG A 933 9.118 4.502 -6.029 1.00 0.00 C ATOM 557 NH1 ARG A 933 8.750 5.696 -5.585 1.00 0.00 N ATOM 558 NH2 ARG A 933 10.116 4.404 -6.898 1.00 0.00 N ATOM 0 H ARG A 933 7.718 2.754 -0.528 1.00 0.00 H new ATOM 0 HA ARG A 933 7.604 5.587 -1.137 1.00 0.00 H new ATOM 0 HB2 ARG A 933 6.153 3.145 -2.212 1.00 0.00 H new ATOM 0 HB3 ARG A 933 5.904 4.772 -2.816 1.00 0.00 H new ATOM 0 HG2 ARG A 933 8.325 4.902 -3.416 1.00 0.00 H new ATOM 0 HG3 ARG A 933 8.542 3.258 -2.849 1.00 0.00 H new ATOM 0 HD2 ARG A 933 6.994 2.407 -4.542 1.00 0.00 H new ATOM 0 HD3 ARG A 933 6.577 4.034 -5.040 1.00 0.00 H new ATOM 0 HE ARG A 933 8.794 2.506 -5.982 1.00 0.00 H new ATOM 0 HH11 ARG A 933 7.981 5.778 -4.920 1.00 0.00 H new ATOM 0 HH12 ARG A 933 9.236 6.532 -5.909 1.00 0.00 H new ATOM 0 HH21 ARG A 933 10.401 3.489 -7.246 1.00 0.00 H new ATOM 0 HH22 ARG A 933 10.598 5.244 -7.218 1.00 0.00 H new ATOM 572 N PRO A 934 5.147 6.196 -0.478 1.00 0.00 N ATOM 573 CA PRO A 934 3.953 6.663 0.231 1.00 0.00 C ATOM 574 C PRO A 934 2.974 5.541 0.567 1.00 0.00 C ATOM 575 O PRO A 934 2.614 5.355 1.730 1.00 0.00 O ATOM 576 CB PRO A 934 3.333 7.633 -0.769 1.00 0.00 C ATOM 577 CG PRO A 934 4.500 8.220 -1.489 1.00 0.00 C ATOM 578 CD PRO A 934 5.568 7.154 -1.521 1.00 0.00 C ATOM 0 HA PRO A 934 4.198 7.102 1.198 1.00 0.00 H new ATOM 0 HB2 PRO A 934 2.660 7.120 -1.456 1.00 0.00 H new ATOM 0 HB3 PRO A 934 2.748 8.403 -0.266 1.00 0.00 H new ATOM 0 HG2 PRO A 934 4.221 8.519 -2.499 1.00 0.00 H new ATOM 0 HG3 PRO A 934 4.860 9.114 -0.979 1.00 0.00 H new ATOM 0 HD2 PRO A 934 5.628 6.678 -2.500 1.00 0.00 H new ATOM 0 HD3 PRO A 934 6.553 7.569 -1.308 1.00 0.00 H new ATOM 586 N GLU A 935 2.545 4.796 -0.448 1.00 0.00 N ATOM 587 CA GLU A 935 1.610 3.697 -0.241 1.00 0.00 C ATOM 588 C GLU A 935 2.297 2.479 0.382 1.00 0.00 C ATOM 589 O GLU A 935 1.965 1.340 0.058 1.00 0.00 O ATOM 590 CB GLU A 935 0.940 3.312 -1.562 1.00 0.00 C ATOM 591 CG GLU A 935 1.921 2.977 -2.672 1.00 0.00 C ATOM 592 CD GLU A 935 1.231 2.592 -3.966 1.00 0.00 C ATOM 593 OE1 GLU A 935 0.465 1.605 -3.959 1.00 0.00 O ATOM 594 OE2 GLU A 935 1.455 3.278 -4.985 1.00 0.00 O ATOM 0 H GLU A 935 2.829 4.933 -1.418 1.00 0.00 H new ATOM 0 HA GLU A 935 0.847 4.040 0.458 1.00 0.00 H new ATOM 0 HB2 GLU A 935 0.290 2.453 -1.392 1.00 0.00 H new ATOM 0 HB3 GLU A 935 0.303 4.134 -1.889 1.00 0.00 H new ATOM 0 HG2 GLU A 935 2.568 3.836 -2.851 1.00 0.00 H new ATOM 0 HG3 GLU A 935 2.563 2.157 -2.349 1.00 0.00 H new ATOM 601 N TYR A 936 3.250 2.725 1.282 1.00 0.00 N ATOM 602 CA TYR A 936 3.976 1.647 1.956 1.00 0.00 C ATOM 603 C TYR A 936 4.260 2.005 3.414 1.00 0.00 C ATOM 604 O TYR A 936 4.400 3.179 3.761 1.00 0.00 O ATOM 605 CB TYR A 936 5.292 1.329 1.240 1.00 0.00 C ATOM 606 CG TYR A 936 5.114 0.733 -0.136 1.00 0.00 C ATOM 607 CD1 TYR A 936 4.765 1.527 -1.218 1.00 0.00 C ATOM 608 CD2 TYR A 936 5.285 -0.629 -0.351 1.00 0.00 C ATOM 609 CE1 TYR A 936 4.595 0.986 -2.476 1.00 0.00 C ATOM 610 CE2 TYR A 936 5.116 -1.179 -1.608 1.00 0.00 C ATOM 611 CZ TYR A 936 4.771 -0.367 -2.667 1.00 0.00 C ATOM 612 OH TYR A 936 4.603 -0.910 -3.919 1.00 0.00 O ATOM 0 H TYR A 936 3.538 3.663 1.562 1.00 0.00 H new ATOM 0 HA TYR A 936 3.339 0.763 1.925 1.00 0.00 H new ATOM 0 HB2 TYR A 936 5.878 2.244 1.155 1.00 0.00 H new ATOM 0 HB3 TYR A 936 5.869 0.637 1.853 1.00 0.00 H new ATOM 0 HD1 TYR A 936 4.624 2.588 -1.073 1.00 0.00 H new ATOM 0 HD2 TYR A 936 5.554 -1.268 0.477 1.00 0.00 H new ATOM 0 HE1 TYR A 936 4.325 1.620 -3.307 1.00 0.00 H new ATOM 0 HE2 TYR A 936 5.254 -2.239 -1.759 1.00 0.00 H new ATOM 0 HH TYR A 936 4.765 -1.876 -3.881 1.00 0.00 H new ATOM 622 N TYR A 937 4.343 0.981 4.259 1.00 0.00 N ATOM 623 CA TYR A 937 4.608 1.170 5.680 1.00 0.00 C ATOM 624 C TYR A 937 5.455 0.020 6.219 1.00 0.00 C ATOM 625 O TYR A 937 5.196 -1.147 5.921 1.00 0.00 O ATOM 626 CB TYR A 937 3.285 1.269 6.456 1.00 0.00 C ATOM 627 CG TYR A 937 2.484 -0.019 6.497 1.00 0.00 C ATOM 628 CD1 TYR A 937 2.767 -1.008 7.433 1.00 0.00 C ATOM 629 CD2 TYR A 937 1.446 -0.250 5.598 1.00 0.00 C ATOM 630 CE1 TYR A 937 2.043 -2.185 7.473 1.00 0.00 C ATOM 631 CE2 TYR A 937 0.719 -1.425 5.634 1.00 0.00 C ATOM 632 CZ TYR A 937 1.021 -2.387 6.572 1.00 0.00 C ATOM 633 OH TYR A 937 0.297 -3.558 6.609 1.00 0.00 O ATOM 0 H TYR A 937 4.230 0.006 3.981 1.00 0.00 H new ATOM 0 HA TYR A 937 5.162 2.099 5.813 1.00 0.00 H new ATOM 0 HB2 TYR A 937 3.500 1.582 7.478 1.00 0.00 H new ATOM 0 HB3 TYR A 937 2.672 2.050 6.006 1.00 0.00 H new ATOM 0 HD1 TYR A 937 3.567 -0.854 8.142 1.00 0.00 H new ATOM 0 HD2 TYR A 937 1.205 0.501 4.861 1.00 0.00 H new ATOM 0 HE1 TYR A 937 2.277 -2.942 8.207 1.00 0.00 H new ATOM 0 HE2 TYR A 937 -0.083 -1.588 4.929 1.00 0.00 H new ATOM 0 HH TYR A 937 -0.387 -3.542 5.908 1.00 0.00 H new ATOM 643 N GLY A 938 6.470 0.348 7.014 1.00 0.00 N ATOM 644 CA GLY A 938 7.324 -0.681 7.576 1.00 0.00 C ATOM 645 C GLY A 938 8.723 -0.191 7.885 1.00 0.00 C ATOM 646 O GLY A 938 9.677 -0.967 7.861 1.00 0.00 O ATOM 0 H GLY A 938 6.715 1.303 7.277 1.00 0.00 H new ATOM 0 HA2 GLY A 938 6.869 -1.062 8.490 1.00 0.00 H new ATOM 0 HA3 GLY A 938 7.384 -1.516 6.878 1.00 0.00 H new ATOM 650 N ARG A 939 8.837 1.096 8.184 1.00 0.00 N ATOM 651 CA ARG A 939 10.122 1.704 8.511 1.00 0.00 C ATOM 652 C ARG A 939 11.118 1.602 7.361 1.00 0.00 C ATOM 653 O ARG A 939 11.113 0.642 6.590 1.00 0.00 O ATOM 654 CB ARG A 939 10.717 1.067 9.763 1.00 0.00 C ATOM 655 CG ARG A 939 9.890 1.311 11.009 1.00 0.00 C ATOM 656 CD ARG A 939 10.585 0.765 12.241 1.00 0.00 C ATOM 657 NE ARG A 939 11.839 1.461 12.517 1.00 0.00 N ATOM 658 CZ ARG A 939 12.630 1.175 13.547 1.00 0.00 C ATOM 659 NH1 ARG A 939 12.296 0.210 14.394 1.00 0.00 N ATOM 660 NH2 ARG A 939 13.754 1.853 13.731 1.00 0.00 N ATOM 0 H ARG A 939 8.050 1.744 8.207 1.00 0.00 H new ATOM 0 HA ARG A 939 9.932 2.761 8.696 1.00 0.00 H new ATOM 0 HB2 ARG A 939 10.815 -0.007 9.605 1.00 0.00 H new ATOM 0 HB3 ARG A 939 11.722 1.459 9.919 1.00 0.00 H new ATOM 0 HG2 ARG A 939 9.716 2.380 11.130 1.00 0.00 H new ATOM 0 HG3 ARG A 939 8.914 0.839 10.899 1.00 0.00 H new ATOM 0 HD2 ARG A 939 9.922 0.857 13.102 1.00 0.00 H new ATOM 0 HD3 ARG A 939 10.783 -0.298 12.104 1.00 0.00 H new ATOM 0 HE ARG A 939 12.124 2.208 11.884 1.00 0.00 H new ATOM 0 HH11 ARG A 939 11.432 -0.314 14.256 1.00 0.00 H new ATOM 0 HH12 ARG A 939 12.904 -0.008 15.184 1.00 0.00 H new ATOM 0 HH21 ARG A 939 14.014 2.596 13.082 1.00 0.00 H new ATOM 0 HH22 ARG A 939 14.359 1.632 14.522 1.00 0.00 H new ATOM 674 N PRO A 940 11.997 2.607 7.247 1.00 0.00 N ATOM 675 CA PRO A 940 13.024 2.660 6.208 1.00 0.00 C ATOM 676 C PRO A 940 14.175 1.700 6.493 1.00 0.00 C ATOM 677 O PRO A 940 14.812 1.781 7.543 1.00 0.00 O ATOM 678 CB PRO A 940 13.525 4.114 6.256 1.00 0.00 C ATOM 679 CG PRO A 940 12.665 4.823 7.258 1.00 0.00 C ATOM 680 CD PRO A 940 12.064 3.767 8.135 1.00 0.00 C ATOM 0 HA PRO A 940 12.629 2.367 5.235 1.00 0.00 H new ATOM 0 HB2 PRO A 940 14.575 4.154 6.547 1.00 0.00 H new ATOM 0 HB3 PRO A 940 13.448 4.584 5.276 1.00 0.00 H new ATOM 0 HG2 PRO A 940 13.256 5.525 7.847 1.00 0.00 H new ATOM 0 HG3 PRO A 940 11.887 5.401 6.760 1.00 0.00 H new ATOM 0 HD2 PRO A 940 12.681 3.570 9.012 1.00 0.00 H new ATOM 0 HD3 PRO A 940 11.078 4.056 8.498 1.00 0.00 H new ATOM 688 N PHE A 941 14.445 0.798 5.555 1.00 0.00 N ATOM 689 CA PHE A 941 15.529 -0.165 5.719 1.00 0.00 C ATOM 690 C PHE A 941 16.829 0.390 5.154 1.00 0.00 C ATOM 691 O PHE A 941 16.961 1.597 4.947 1.00 0.00 O ATOM 692 CB PHE A 941 15.174 -1.492 5.042 1.00 0.00 C ATOM 693 CG PHE A 941 14.984 -1.394 3.553 1.00 0.00 C ATOM 694 CD1 PHE A 941 16.070 -1.460 2.694 1.00 0.00 C ATOM 695 CD2 PHE A 941 13.718 -1.237 3.016 1.00 0.00 C ATOM 696 CE1 PHE A 941 15.895 -1.373 1.326 1.00 0.00 C ATOM 697 CE2 PHE A 941 13.537 -1.149 1.649 1.00 0.00 C ATOM 698 CZ PHE A 941 14.626 -1.218 0.803 1.00 0.00 C ATOM 0 H PHE A 941 13.931 0.713 4.678 1.00 0.00 H new ATOM 0 HA PHE A 941 15.668 -0.347 6.785 1.00 0.00 H new ATOM 0 HB2 PHE A 941 15.963 -2.215 5.249 1.00 0.00 H new ATOM 0 HB3 PHE A 941 14.259 -1.881 5.489 1.00 0.00 H new ATOM 0 HD1 PHE A 941 17.064 -1.581 3.098 1.00 0.00 H new ATOM 0 HD2 PHE A 941 12.862 -1.183 3.673 1.00 0.00 H new ATOM 0 HE1 PHE A 941 16.749 -1.426 0.667 1.00 0.00 H new ATOM 0 HE2 PHE A 941 12.544 -1.026 1.242 1.00 0.00 H new ATOM 0 HZ PHE A 941 14.486 -1.151 -0.266 1.00 0.00 H new ATOM 708 N SER A 942 17.785 -0.495 4.901 1.00 0.00 N ATOM 709 CA SER A 942 19.072 -0.086 4.355 1.00 0.00 C ATOM 710 C SER A 942 19.930 -1.291 3.990 1.00 0.00 C ATOM 711 O SER A 942 20.032 -2.252 4.753 1.00 0.00 O ATOM 712 CB SER A 942 19.818 0.794 5.359 1.00 0.00 C ATOM 713 OG SER A 942 20.050 0.102 6.573 1.00 0.00 O ATOM 0 H SER A 942 17.694 -1.498 5.065 1.00 0.00 H new ATOM 0 HA SER A 942 18.880 0.484 3.446 1.00 0.00 H new ATOM 0 HB2 SER A 942 20.769 1.113 4.931 1.00 0.00 H new ATOM 0 HB3 SER A 942 19.239 1.696 5.556 1.00 0.00 H new ATOM 0 HG SER A 942 20.530 0.687 7.196 1.00 0.00 H new ATOM 719 N ILE A 943 20.556 -1.221 2.820 1.00 0.00 N ATOM 720 CA ILE A 943 21.424 -2.291 2.345 1.00 0.00 C ATOM 721 C ILE A 943 22.867 -2.023 2.752 1.00 0.00 C ATOM 722 O ILE A 943 23.172 -0.968 3.309 1.00 0.00 O ATOM 723 CB ILE A 943 21.333 -2.455 0.817 1.00 0.00 C ATOM 724 CG1 ILE A 943 21.345 -1.086 0.127 1.00 0.00 C ATOM 725 CG2 ILE A 943 20.084 -3.237 0.445 1.00 0.00 C ATOM 726 CD1 ILE A 943 21.209 -1.165 -1.378 1.00 0.00 C ATOM 0 H ILE A 943 20.477 -0.430 2.181 1.00 0.00 H new ATOM 0 HA ILE A 943 21.086 -3.219 2.806 1.00 0.00 H new ATOM 0 HB ILE A 943 22.203 -3.014 0.474 1.00 0.00 H new ATOM 0 HG12 ILE A 943 20.531 -0.480 0.526 1.00 0.00 H new ATOM 0 HG13 ILE A 943 22.275 -0.573 0.373 1.00 0.00 H new ATOM 0 HG21 ILE A 943 20.032 -3.346 -0.638 1.00 0.00 H new ATOM 0 HG22 ILE A 943 20.121 -4.223 0.907 1.00 0.00 H new ATOM 0 HG23 ILE A 943 19.202 -2.703 0.799 1.00 0.00 H new ATOM 0 HD11 ILE A 943 21.225 -0.159 -1.798 1.00 0.00 H new ATOM 0 HD12 ILE A 943 22.037 -1.743 -1.788 1.00 0.00 H new ATOM 0 HD13 ILE A 943 20.267 -1.649 -1.633 1.00 0.00 H new ATOM 738 N THR A 944 23.749 -2.986 2.505 1.00 0.00 N ATOM 739 CA THR A 944 25.146 -2.832 2.891 1.00 0.00 C ATOM 740 C THR A 944 26.064 -3.833 2.199 1.00 0.00 C ATOM 741 O THR A 944 25.806 -5.037 2.204 1.00 0.00 O ATOM 742 CB THR A 944 25.293 -2.996 4.421 1.00 0.00 C ATOM 743 OG1 THR A 944 25.135 -1.729 5.070 1.00 0.00 O ATOM 744 CG2 THR A 944 26.635 -3.613 4.796 1.00 0.00 C ATOM 0 H THR A 944 23.526 -3.869 2.046 1.00 0.00 H new ATOM 0 HA THR A 944 25.447 -1.832 2.579 1.00 0.00 H new ATOM 0 HB THR A 944 24.510 -3.675 4.758 1.00 0.00 H new ATOM 0 HG1 THR A 944 24.442 -1.210 4.610 1.00 0.00 H new ATOM 0 HG21 THR A 944 26.700 -3.712 5.880 1.00 0.00 H new ATOM 0 HG22 THR A 944 26.724 -4.597 4.336 1.00 0.00 H new ATOM 0 HG23 THR A 944 27.442 -2.972 4.441 1.00 0.00 H new ATOM 752 N CYS A 945 27.170 -3.327 1.650 1.00 0.00 N ATOM 753 CA CYS A 945 28.156 -4.185 1.012 1.00 0.00 C ATOM 754 C CYS A 945 28.880 -4.950 2.109 1.00 0.00 C ATOM 755 O CYS A 945 29.577 -4.363 2.935 1.00 0.00 O ATOM 756 CB CYS A 945 29.130 -3.354 0.180 1.00 0.00 C ATOM 757 SG CYS A 945 28.305 -2.299 -1.056 1.00 0.00 S ATOM 0 H CYS A 945 27.400 -2.333 1.637 1.00 0.00 H new ATOM 0 HA CYS A 945 27.673 -4.885 0.330 1.00 0.00 H new ATOM 0 HB2 CYS A 945 29.722 -2.726 0.846 1.00 0.00 H new ATOM 0 HB3 CYS A 945 29.824 -4.023 -0.329 1.00 0.00 H new ATOM 762 N LEU A 946 28.641 -6.246 2.165 1.00 0.00 N ATOM 763 CA LEU A 946 29.199 -7.078 3.220 1.00 0.00 C ATOM 764 C LEU A 946 30.617 -7.558 2.984 1.00 0.00 C ATOM 765 O LEU A 946 31.477 -7.399 3.852 1.00 0.00 O ATOM 766 CB LEU A 946 28.259 -8.245 3.456 1.00 0.00 C ATOM 767 CG LEU A 946 26.893 -7.791 3.949 1.00 0.00 C ATOM 768 CD1 LEU A 946 25.949 -8.959 4.131 1.00 0.00 C ATOM 769 CD2 LEU A 946 27.068 -7.018 5.240 1.00 0.00 C ATOM 0 H LEU A 946 28.063 -6.749 1.492 1.00 0.00 H new ATOM 0 HA LEU A 946 29.282 -6.449 4.107 1.00 0.00 H new ATOM 0 HB2 LEU A 946 28.141 -8.807 2.530 1.00 0.00 H new ATOM 0 HB3 LEU A 946 28.700 -8.923 4.186 1.00 0.00 H new ATOM 0 HG LEU A 946 26.442 -7.142 3.198 1.00 0.00 H new ATOM 0 HD11 LEU A 946 24.984 -8.595 4.484 1.00 0.00 H new ATOM 0 HD12 LEU A 946 25.817 -9.472 3.178 1.00 0.00 H new ATOM 0 HD13 LEU A 946 26.365 -9.652 4.862 1.00 0.00 H new ATOM 0 HD21 LEU A 946 26.094 -6.688 5.601 1.00 0.00 H new ATOM 0 HD22 LEU A 946 27.534 -7.659 5.988 1.00 0.00 H new ATOM 0 HD23 LEU A 946 27.702 -6.149 5.061 1.00 0.00 H new ATOM 781 N ASP A 947 30.855 -8.168 1.842 1.00 0.00 N ATOM 782 CA ASP A 947 32.175 -8.707 1.538 1.00 0.00 C ATOM 783 C ASP A 947 32.157 -9.479 0.231 1.00 0.00 C ATOM 784 O ASP A 947 33.098 -9.401 -0.560 1.00 0.00 O ATOM 785 CB ASP A 947 32.619 -9.624 2.678 1.00 0.00 C ATOM 786 CG ASP A 947 33.935 -10.327 2.398 1.00 0.00 C ATOM 787 OD1 ASP A 947 33.996 -11.119 1.435 1.00 0.00 O ATOM 788 OD2 ASP A 947 34.907 -10.083 3.144 1.00 0.00 O ATOM 0 H ASP A 947 30.159 -8.305 1.109 1.00 0.00 H new ATOM 0 HA ASP A 947 32.877 -7.880 1.434 1.00 0.00 H new ATOM 0 HB2 ASP A 947 32.714 -9.038 3.592 1.00 0.00 H new ATOM 0 HB3 ASP A 947 31.846 -10.371 2.858 1.00 0.00 H new ATOM 793 N ASN A 948 31.077 -10.212 -0.005 1.00 0.00 N ATOM 794 CA ASN A 948 30.942 -10.977 -1.232 1.00 0.00 C ATOM 795 C ASN A 948 30.428 -10.066 -2.334 1.00 0.00 C ATOM 796 O ASN A 948 29.707 -10.498 -3.235 1.00 0.00 O ATOM 797 CB ASN A 948 29.987 -12.156 -1.030 1.00 0.00 C ATOM 798 CG ASN A 948 30.467 -13.114 0.042 1.00 0.00 C ATOM 799 OD1 ASN A 948 31.549 -13.692 -0.065 1.00 0.00 O ATOM 800 ND2 ASN A 948 29.663 -13.289 1.084 1.00 0.00 N ATOM 0 H ASN A 948 30.287 -10.291 0.635 1.00 0.00 H new ATOM 0 HA ASN A 948 31.916 -11.376 -1.514 1.00 0.00 H new ATOM 0 HB2 ASN A 948 29.001 -11.778 -0.760 1.00 0.00 H new ATOM 0 HB3 ASN A 948 29.876 -12.695 -1.971 1.00 0.00 H new ATOM 0 HD21 ASN A 948 29.934 -13.923 1.836 1.00 0.00 H new ATOM 0 HD22 ASN A 948 28.775 -12.790 1.132 1.00 0.00 H new ATOM 807 N LEU A 949 30.814 -8.794 -2.244 1.00 0.00 N ATOM 808 CA LEU A 949 30.410 -7.792 -3.214 1.00 0.00 C ATOM 809 C LEU A 949 28.900 -7.820 -3.416 1.00 0.00 C ATOM 810 O LEU A 949 28.411 -7.731 -4.542 1.00 0.00 O ATOM 811 CB LEU A 949 31.132 -8.031 -4.540 1.00 0.00 C ATOM 812 CG LEU A 949 32.660 -8.059 -4.437 1.00 0.00 C ATOM 813 CD1 LEU A 949 33.282 -8.358 -5.793 1.00 0.00 C ATOM 814 CD2 LEU A 949 33.184 -6.741 -3.888 1.00 0.00 C ATOM 0 H LEU A 949 31.412 -8.436 -1.499 1.00 0.00 H new ATOM 0 HA LEU A 949 30.684 -6.807 -2.836 1.00 0.00 H new ATOM 0 HB2 LEU A 949 30.792 -8.978 -4.959 1.00 0.00 H new ATOM 0 HB3 LEU A 949 30.842 -7.250 -5.243 1.00 0.00 H new ATOM 0 HG LEU A 949 32.942 -8.854 -3.747 1.00 0.00 H new ATOM 0 HD11 LEU A 949 34.368 -8.374 -5.700 1.00 0.00 H new ATOM 0 HD12 LEU A 949 32.934 -9.328 -6.147 1.00 0.00 H new ATOM 0 HD13 LEU A 949 32.990 -7.586 -6.505 1.00 0.00 H new ATOM 0 HD21 LEU A 949 34.271 -6.781 -3.822 1.00 0.00 H new ATOM 0 HD22 LEU A 949 32.890 -5.928 -4.552 1.00 0.00 H new ATOM 0 HD23 LEU A 949 32.767 -6.568 -2.896 1.00 0.00 H new ATOM 826 N VAL A 950 28.163 -7.950 -2.312 1.00 0.00 N ATOM 827 CA VAL A 950 26.711 -7.998 -2.377 1.00 0.00 C ATOM 828 C VAL A 950 26.059 -7.172 -1.290 1.00 0.00 C ATOM 829 O VAL A 950 26.597 -7.006 -0.194 1.00 0.00 O ATOM 830 CB VAL A 950 26.173 -9.425 -2.255 1.00 0.00 C ATOM 831 CG1 VAL A 950 26.557 -10.238 -3.467 1.00 0.00 C ATOM 832 CG2 VAL A 950 26.665 -10.066 -0.971 1.00 0.00 C ATOM 0 H VAL A 950 28.549 -8.023 -1.371 1.00 0.00 H new ATOM 0 HA VAL A 950 26.461 -7.587 -3.355 1.00 0.00 H new ATOM 0 HB VAL A 950 25.084 -9.392 -2.212 1.00 0.00 H new ATOM 0 HG11 VAL A 950 26.167 -11.251 -3.364 1.00 0.00 H new ATOM 0 HG12 VAL A 950 26.139 -9.777 -4.362 1.00 0.00 H new ATOM 0 HG13 VAL A 950 27.643 -10.275 -3.551 1.00 0.00 H new ATOM 0 HG21 VAL A 950 26.274 -11.081 -0.898 1.00 0.00 H new ATOM 0 HG22 VAL A 950 27.755 -10.096 -0.974 1.00 0.00 H new ATOM 0 HG23 VAL A 950 26.320 -9.482 -0.118 1.00 0.00 H new ATOM 842 N TRP A 951 24.879 -6.683 -1.612 1.00 0.00 N ATOM 843 CA TRP A 951 24.092 -5.891 -0.685 1.00 0.00 C ATOM 844 C TRP A 951 23.155 -6.786 0.111 1.00 0.00 C ATOM 845 O TRP A 951 22.359 -7.527 -0.465 1.00 0.00 O ATOM 846 CB TRP A 951 23.286 -4.830 -1.436 1.00 0.00 C ATOM 847 CG TRP A 951 24.141 -3.901 -2.245 1.00 0.00 C ATOM 848 CD1 TRP A 951 24.662 -4.133 -3.487 1.00 0.00 C ATOM 849 CD2 TRP A 951 24.595 -2.602 -1.857 1.00 0.00 C ATOM 850 NE1 TRP A 951 25.397 -3.047 -3.901 1.00 0.00 N ATOM 851 CE2 TRP A 951 25.373 -2.096 -2.915 1.00 0.00 C ATOM 852 CE3 TRP A 951 24.414 -1.816 -0.718 1.00 0.00 C ATOM 853 CZ2 TRP A 951 25.968 -0.837 -2.864 1.00 0.00 C ATOM 854 CZ3 TRP A 951 25.003 -0.570 -0.667 1.00 0.00 C ATOM 855 CH2 TRP A 951 25.773 -0.089 -1.734 1.00 0.00 C ATOM 0 H TRP A 951 24.438 -6.822 -2.521 1.00 0.00 H new ATOM 0 HA TRP A 951 24.774 -5.391 0.003 1.00 0.00 H new ATOM 0 HB2 TRP A 951 22.573 -5.324 -2.096 1.00 0.00 H new ATOM 0 HB3 TRP A 951 22.707 -4.248 -0.719 1.00 0.00 H new ATOM 0 HD1 TRP A 951 24.518 -5.037 -4.060 1.00 0.00 H new ATOM 0 HE1 TRP A 951 25.881 -2.963 -4.795 1.00 0.00 H new ATOM 0 HE3 TRP A 951 23.822 -2.178 0.110 1.00 0.00 H new ATOM 0 HZ2 TRP A 951 26.561 -0.465 -3.686 1.00 0.00 H new ATOM 0 HZ3 TRP A 951 24.868 0.045 0.210 1.00 0.00 H new ATOM 0 HH2 TRP A 951 26.222 0.891 -1.664 1.00 0.00 H new ATOM 866 N SER A 952 23.246 -6.704 1.432 1.00 0.00 N ATOM 867 CA SER A 952 22.392 -7.500 2.308 1.00 0.00 C ATOM 868 C SER A 952 20.958 -7.488 1.788 1.00 0.00 C ATOM 869 O SER A 952 20.485 -6.475 1.275 1.00 0.00 O ATOM 870 CB SER A 952 22.437 -6.957 3.738 1.00 0.00 C ATOM 871 OG SER A 952 21.605 -7.716 4.599 1.00 0.00 O ATOM 0 H SER A 952 23.902 -6.095 1.922 1.00 0.00 H new ATOM 0 HA SER A 952 22.760 -8.526 2.315 1.00 0.00 H new ATOM 0 HB2 SER A 952 23.463 -6.979 4.106 1.00 0.00 H new ATOM 0 HB3 SER A 952 22.118 -5.915 3.745 1.00 0.00 H new ATOM 0 HG SER A 952 21.653 -7.350 5.507 1.00 0.00 H new ATOM 877 N SER A 953 20.277 -8.623 1.898 1.00 0.00 N ATOM 878 CA SER A 953 18.909 -8.733 1.408 1.00 0.00 C ATOM 879 C SER A 953 17.907 -8.129 2.390 1.00 0.00 C ATOM 880 O SER A 953 17.708 -8.647 3.489 1.00 0.00 O ATOM 881 CB SER A 953 18.562 -10.200 1.150 1.00 0.00 C ATOM 882 OG SER A 953 17.220 -10.339 0.716 1.00 0.00 O ATOM 0 H SER A 953 20.647 -9.475 2.319 1.00 0.00 H new ATOM 0 HA SER A 953 18.845 -8.171 0.476 1.00 0.00 H new ATOM 0 HB2 SER A 953 19.235 -10.609 0.396 1.00 0.00 H new ATOM 0 HB3 SER A 953 18.714 -10.778 2.061 1.00 0.00 H new ATOM 0 HG SER A 953 17.024 -11.286 0.557 1.00 0.00 H new ATOM 888 N PRO A 954 17.255 -7.020 1.990 1.00 0.00 N ATOM 889 CA PRO A 954 16.257 -6.328 2.811 1.00 0.00 C ATOM 890 C PRO A 954 14.934 -7.083 2.848 1.00 0.00 C ATOM 891 O PRO A 954 13.927 -6.622 2.311 1.00 0.00 O ATOM 892 CB PRO A 954 16.080 -4.970 2.110 1.00 0.00 C ATOM 893 CG PRO A 954 17.142 -4.920 1.062 1.00 0.00 C ATOM 894 CD PRO A 954 17.431 -6.344 0.702 1.00 0.00 C ATOM 0 HA PRO A 954 16.574 -6.239 3.850 1.00 0.00 H new ATOM 0 HB2 PRO A 954 15.088 -4.883 1.667 1.00 0.00 H new ATOM 0 HB3 PRO A 954 16.187 -4.147 2.817 1.00 0.00 H new ATOM 0 HG2 PRO A 954 16.805 -4.358 0.191 1.00 0.00 H new ATOM 0 HG3 PRO A 954 18.037 -4.422 1.436 1.00 0.00 H new ATOM 0 HD2 PRO A 954 16.744 -6.722 -0.055 1.00 0.00 H new ATOM 0 HD3 PRO A 954 18.440 -6.470 0.309 1.00 0.00 H new ATOM 902 N LYS A 955 14.951 -8.254 3.471 1.00 0.00 N ATOM 903 CA LYS A 955 13.757 -9.087 3.564 1.00 0.00 C ATOM 904 C LYS A 955 12.787 -8.550 4.612 1.00 0.00 C ATOM 905 O LYS A 955 13.178 -8.240 5.737 1.00 0.00 O ATOM 906 CB LYS A 955 14.147 -10.528 3.901 1.00 0.00 C ATOM 907 CG LYS A 955 14.924 -10.661 5.202 1.00 0.00 C ATOM 908 CD LYS A 955 15.341 -12.101 5.464 1.00 0.00 C ATOM 909 CE LYS A 955 14.137 -13.016 5.619 1.00 0.00 C ATOM 910 NZ LYS A 955 14.540 -14.428 5.863 1.00 0.00 N ATOM 0 H LYS A 955 15.777 -8.649 3.920 1.00 0.00 H new ATOM 0 HA LYS A 955 13.255 -9.066 2.597 1.00 0.00 H new ATOM 0 HB2 LYS A 955 13.244 -11.135 3.964 1.00 0.00 H new ATOM 0 HB3 LYS A 955 14.747 -10.933 3.086 1.00 0.00 H new ATOM 0 HG2 LYS A 955 15.810 -10.027 5.163 1.00 0.00 H new ATOM 0 HG3 LYS A 955 14.312 -10.303 6.030 1.00 0.00 H new ATOM 0 HD2 LYS A 955 15.963 -12.455 4.642 1.00 0.00 H new ATOM 0 HD3 LYS A 955 15.950 -12.145 6.367 1.00 0.00 H new ATOM 0 HE2 LYS A 955 13.520 -12.667 6.447 1.00 0.00 H new ATOM 0 HE3 LYS A 955 13.523 -12.964 4.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 13.690 -15.019 5.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 15.108 -14.770 5.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 15.104 -14.482 6.735 1.00 0.00 H new ATOM 924 N ASP A 956 11.518 -8.443 4.225 1.00 0.00 N ATOM 925 CA ASP A 956 10.473 -7.944 5.114 1.00 0.00 C ATOM 926 C ASP A 956 10.807 -6.542 5.614 1.00 0.00 C ATOM 927 O ASP A 956 11.539 -6.378 6.590 1.00 0.00 O ATOM 928 CB ASP A 956 10.285 -8.895 6.299 1.00 0.00 C ATOM 929 CG ASP A 956 9.156 -8.467 7.218 1.00 0.00 C ATOM 930 OD1 ASP A 956 9.247 -7.366 7.800 1.00 0.00 O ATOM 931 OD2 ASP A 956 8.179 -9.233 7.353 1.00 0.00 O ATOM 0 H ASP A 956 11.187 -8.698 3.294 1.00 0.00 H new ATOM 0 HA ASP A 956 9.542 -7.894 4.549 1.00 0.00 H new ATOM 0 HB2 ASP A 956 10.084 -9.899 5.926 1.00 0.00 H new ATOM 0 HB3 ASP A 956 11.213 -8.947 6.869 1.00 0.00 H new ATOM 936 N VAL A 957 10.256 -5.533 4.942 1.00 0.00 N ATOM 937 CA VAL A 957 10.491 -4.143 5.318 1.00 0.00 C ATOM 938 C VAL A 957 9.327 -3.244 4.906 1.00 0.00 C ATOM 939 O VAL A 957 8.572 -2.769 5.753 1.00 0.00 O ATOM 940 CB VAL A 957 11.803 -3.610 4.704 1.00 0.00 C ATOM 941 CG1 VAL A 957 13.001 -4.076 5.516 1.00 0.00 C ATOM 942 CG2 VAL A 957 11.940 -4.040 3.250 1.00 0.00 C ATOM 0 H VAL A 957 9.644 -5.653 4.135 1.00 0.00 H new ATOM 0 HA VAL A 957 10.577 -4.121 6.404 1.00 0.00 H new ATOM 0 HB VAL A 957 11.770 -2.521 4.731 1.00 0.00 H new ATOM 0 HG11 VAL A 957 13.917 -3.690 5.068 1.00 0.00 H new ATOM 0 HG12 VAL A 957 12.914 -3.707 6.538 1.00 0.00 H new ATOM 0 HG13 VAL A 957 13.033 -5.166 5.525 1.00 0.00 H new ATOM 0 HG21 VAL A 957 12.873 -3.651 2.842 1.00 0.00 H new ATOM 0 HG22 VAL A 957 11.944 -5.128 3.191 1.00 0.00 H new ATOM 0 HG23 VAL A 957 11.101 -3.649 2.674 1.00 0.00 H new ATOM 952 N CYS A 958 9.182 -3.021 3.608 1.00 0.00 N ATOM 953 CA CYS A 958 8.103 -2.184 3.088 1.00 0.00 C ATOM 954 C CYS A 958 6.847 -3.014 2.827 1.00 0.00 C ATOM 955 O CYS A 958 6.929 -4.142 2.341 1.00 0.00 O ATOM 956 CB CYS A 958 8.536 -1.480 1.799 1.00 0.00 C ATOM 957 SG CYS A 958 9.978 -0.377 1.978 1.00 0.00 S ATOM 0 H CYS A 958 9.797 -3.407 2.892 1.00 0.00 H new ATOM 0 HA CYS A 958 7.874 -1.431 3.842 1.00 0.00 H new ATOM 0 HB2 CYS A 958 8.765 -2.236 1.048 1.00 0.00 H new ATOM 0 HB3 CYS A 958 7.696 -0.898 1.419 1.00 0.00 H new ATOM 962 N LYS A 959 5.687 -2.442 3.142 1.00 0.00 N ATOM 963 CA LYS A 959 4.410 -3.121 2.933 1.00 0.00 C ATOM 964 C LYS A 959 3.348 -2.120 2.489 1.00 0.00 C ATOM 965 O LYS A 959 3.148 -1.096 3.134 1.00 0.00 O ATOM 966 CB LYS A 959 3.959 -3.825 4.217 1.00 0.00 C ATOM 967 CG LYS A 959 4.909 -4.917 4.683 1.00 0.00 C ATOM 968 CD LYS A 959 5.006 -6.044 3.668 1.00 0.00 C ATOM 969 CE LYS A 959 5.981 -7.120 4.118 1.00 0.00 C ATOM 970 NZ LYS A 959 6.087 -8.225 3.126 1.00 0.00 N ATOM 0 H LYS A 959 5.605 -1.508 3.544 1.00 0.00 H new ATOM 0 HA LYS A 959 4.542 -3.870 2.152 1.00 0.00 H new ATOM 0 HB2 LYS A 959 3.855 -3.084 5.010 1.00 0.00 H new ATOM 0 HB3 LYS A 959 2.972 -4.259 4.055 1.00 0.00 H new ATOM 0 HG2 LYS A 959 5.898 -4.492 4.851 1.00 0.00 H new ATOM 0 HG3 LYS A 959 4.566 -5.315 5.638 1.00 0.00 H new ATOM 0 HD2 LYS A 959 4.021 -6.485 3.518 1.00 0.00 H new ATOM 0 HD3 LYS A 959 5.325 -5.642 2.706 1.00 0.00 H new ATOM 0 HE2 LYS A 959 6.964 -6.676 4.273 1.00 0.00 H new ATOM 0 HE3 LYS A 959 5.658 -7.524 5.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 6.762 -8.938 3.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 5.154 -8.666 2.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 6.420 -7.845 2.217 1.00 0.00 H new ATOM 984 N ARG A 960 2.678 -2.411 1.380 1.00 0.00 N ATOM 985 CA ARG A 960 1.656 -1.512 0.857 1.00 0.00 C ATOM 986 C ARG A 960 0.609 -1.162 1.909 1.00 0.00 C ATOM 987 O ARG A 960 0.143 -2.023 2.655 1.00 0.00 O ATOM 988 CB ARG A 960 0.969 -2.112 -0.368 1.00 0.00 C ATOM 989 CG ARG A 960 -0.163 -1.242 -0.892 1.00 0.00 C ATOM 990 CD ARG A 960 -0.771 -1.805 -2.162 1.00 0.00 C ATOM 991 NE ARG A 960 -1.223 -3.183 -1.990 1.00 0.00 N ATOM 992 CZ ARG A 960 -1.763 -3.908 -2.964 1.00 0.00 C ATOM 993 NH1 ARG A 960 -1.921 -3.389 -4.175 1.00 0.00 N ATOM 994 NH2 ARG A 960 -2.144 -5.157 -2.729 1.00 0.00 N ATOM 0 H ARG A 960 2.823 -3.257 0.829 1.00 0.00 H new ATOM 0 HA ARG A 960 2.168 -0.595 0.567 1.00 0.00 H new ATOM 0 HB2 ARG A 960 1.706 -2.257 -1.158 1.00 0.00 H new ATOM 0 HB3 ARG A 960 0.577 -3.097 -0.114 1.00 0.00 H new ATOM 0 HG2 ARG A 960 -0.936 -1.154 -0.128 1.00 0.00 H new ATOM 0 HG3 ARG A 960 0.212 -0.237 -1.084 1.00 0.00 H new ATOM 0 HD2 ARG A 960 -1.613 -1.183 -2.467 1.00 0.00 H new ATOM 0 HD3 ARG A 960 -0.036 -1.763 -2.965 1.00 0.00 H new ATOM 0 HE ARG A 960 -1.118 -3.613 -1.071 1.00 0.00 H new ATOM 0 HH11 ARG A 960 -1.627 -2.430 -4.361 1.00 0.00 H new ATOM 0 HH12 ARG A 960 -2.336 -3.949 -4.920 1.00 0.00 H new ATOM 0 HH21 ARG A 960 -2.022 -5.561 -1.800 1.00 0.00 H new ATOM 0 HH22 ARG A 960 -2.558 -5.713 -3.477 1.00 0.00 H new ATOM 1008 N LYS A 961 0.242 0.117 1.944 1.00 0.00 N ATOM 1009 CA LYS A 961 -0.757 0.619 2.879 1.00 0.00 C ATOM 1010 C LYS A 961 -2.071 -0.139 2.738 1.00 0.00 C ATOM 1011 O LYS A 961 -2.251 -0.924 1.807 1.00 0.00 O ATOM 1012 CB LYS A 961 -0.999 2.111 2.635 1.00 0.00 C ATOM 1013 CG LYS A 961 0.209 2.989 2.931 1.00 0.00 C ATOM 1014 CD LYS A 961 0.625 2.904 4.392 1.00 0.00 C ATOM 1015 CE LYS A 961 -0.472 3.407 5.319 1.00 0.00 C ATOM 1016 NZ LYS A 961 -0.075 3.317 6.751 1.00 0.00 N ATOM 0 H LYS A 961 0.628 0.831 1.326 1.00 0.00 H new ATOM 0 HA LYS A 961 -0.378 0.469 3.890 1.00 0.00 H new ATOM 0 HB2 LYS A 961 -1.295 2.256 1.596 1.00 0.00 H new ATOM 0 HB3 LYS A 961 -1.835 2.439 3.253 1.00 0.00 H new ATOM 0 HG2 LYS A 961 1.043 2.686 2.298 1.00 0.00 H new ATOM 0 HG3 LYS A 961 -0.023 4.024 2.679 1.00 0.00 H new ATOM 0 HD2 LYS A 961 0.868 1.871 4.642 1.00 0.00 H new ATOM 0 HD3 LYS A 961 1.530 3.491 4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 961 -0.709 4.442 5.073 1.00 0.00 H new ATOM 0 HE3 LYS A 961 -1.379 2.825 5.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 -0.850 3.669 7.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 0.127 2.326 6.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 0.776 3.893 6.912 1.00 0.00 H new ATOM 1030 N SER A 962 -2.989 0.104 3.667 1.00 0.00 N ATOM 1031 CA SER A 962 -4.290 -0.552 3.643 1.00 0.00 C ATOM 1032 C SER A 962 -5.361 0.333 4.266 1.00 0.00 C ATOM 1033 O SER A 962 -5.161 0.914 5.333 1.00 0.00 O ATOM 1034 CB SER A 962 -4.229 -1.886 4.387 1.00 0.00 C ATOM 1035 OG SER A 962 -3.800 -1.707 5.726 1.00 0.00 O ATOM 0 H SER A 962 -2.856 0.750 4.445 1.00 0.00 H new ATOM 0 HA SER A 962 -4.552 -0.733 2.601 1.00 0.00 H new ATOM 0 HB2 SER A 962 -5.212 -2.356 4.377 1.00 0.00 H new ATOM 0 HB3 SER A 962 -3.547 -2.562 3.871 1.00 0.00 H new ATOM 0 HG SER A 962 -3.772 -2.575 6.179 1.00 0.00 H new ATOM 1041 N CYS A 963 -6.505 0.421 3.597 1.00 0.00 N ATOM 1042 CA CYS A 963 -7.617 1.224 4.087 1.00 0.00 C ATOM 1043 C CYS A 963 -8.402 0.446 5.136 1.00 0.00 C ATOM 1044 O CYS A 963 -8.548 -0.772 5.032 1.00 0.00 O ATOM 1045 CB CYS A 963 -8.541 1.621 2.934 1.00 0.00 C ATOM 1046 SG CYS A 963 -7.731 2.603 1.630 1.00 0.00 S ATOM 0 H CYS A 963 -6.686 -0.055 2.713 1.00 0.00 H new ATOM 0 HA CYS A 963 -7.215 2.130 4.541 1.00 0.00 H new ATOM 0 HB2 CYS A 963 -8.955 0.717 2.488 1.00 0.00 H new ATOM 0 HB3 CYS A 963 -9.379 2.191 3.335 1.00 0.00 H new ATOM 1051 N LYS A 964 -8.903 1.147 6.145 1.00 0.00 N ATOM 1052 CA LYS A 964 -9.667 0.504 7.204 1.00 0.00 C ATOM 1053 C LYS A 964 -10.970 -0.057 6.654 1.00 0.00 C ATOM 1054 O LYS A 964 -11.670 0.608 5.890 1.00 0.00 O ATOM 1055 CB LYS A 964 -9.961 1.499 8.326 1.00 0.00 C ATOM 1056 CG LYS A 964 -10.785 0.908 9.455 1.00 0.00 C ATOM 1057 CD LYS A 964 -11.054 1.931 10.544 1.00 0.00 C ATOM 1058 CE LYS A 964 -11.903 1.343 11.656 1.00 0.00 C ATOM 1059 NZ LYS A 964 -13.240 0.909 11.165 1.00 0.00 N ATOM 0 H LYS A 964 -8.795 2.156 6.252 1.00 0.00 H new ATOM 0 HA LYS A 964 -9.073 -0.317 7.606 1.00 0.00 H new ATOM 0 HB2 LYS A 964 -9.019 1.869 8.729 1.00 0.00 H new ATOM 0 HB3 LYS A 964 -10.489 2.357 7.911 1.00 0.00 H new ATOM 0 HG2 LYS A 964 -11.731 0.538 9.061 1.00 0.00 H new ATOM 0 HG3 LYS A 964 -10.260 0.052 9.880 1.00 0.00 H new ATOM 0 HD2 LYS A 964 -10.108 2.286 10.954 1.00 0.00 H new ATOM 0 HD3 LYS A 964 -11.560 2.796 10.116 1.00 0.00 H new ATOM 0 HE2 LYS A 964 -11.384 0.492 12.097 1.00 0.00 H new ATOM 0 HE3 LYS A 964 -12.029 2.083 12.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 -13.874 0.754 11.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 -13.639 1.645 10.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 -13.142 0.024 10.628 1.00 0.00 H new ATOM 1073 N THR A 965 -11.288 -1.288 7.042 1.00 0.00 N ATOM 1074 CA THR A 965 -12.505 -1.939 6.582 1.00 0.00 C ATOM 1075 C THR A 965 -13.727 -1.076 6.874 1.00 0.00 C ATOM 1076 O THR A 965 -14.042 -0.806 8.033 1.00 0.00 O ATOM 1077 CB THR A 965 -12.693 -3.314 7.249 1.00 0.00 C ATOM 1078 OG1 THR A 965 -11.544 -4.136 7.010 1.00 0.00 O ATOM 1079 CG2 THR A 965 -13.937 -4.010 6.718 1.00 0.00 C ATOM 0 H THR A 965 -10.719 -1.852 7.673 1.00 0.00 H new ATOM 0 HA THR A 965 -12.405 -2.077 5.505 1.00 0.00 H new ATOM 0 HB THR A 965 -12.813 -3.158 8.321 1.00 0.00 H new ATOM 0 HG1 THR A 965 -11.671 -5.008 7.439 1.00 0.00 H new ATOM 0 HG21 THR A 965 -14.047 -4.979 7.205 1.00 0.00 H new ATOM 0 HG22 THR A 965 -14.814 -3.397 6.927 1.00 0.00 H new ATOM 0 HG23 THR A 965 -13.842 -4.153 5.642 1.00 0.00 H new ATOM 1087 N PRO A 966 -14.442 -0.635 5.824 1.00 0.00 N ATOM 1088 CA PRO A 966 -15.637 0.195 5.982 1.00 0.00 C ATOM 1089 C PRO A 966 -16.815 -0.605 6.524 1.00 0.00 C ATOM 1090 O PRO A 966 -17.138 -1.673 6.003 1.00 0.00 O ATOM 1091 CB PRO A 966 -15.924 0.670 4.557 1.00 0.00 C ATOM 1092 CG PRO A 966 -15.361 -0.399 3.687 1.00 0.00 C ATOM 1093 CD PRO A 966 -14.144 -0.914 4.406 1.00 0.00 C ATOM 0 HA PRO A 966 -15.487 1.007 6.693 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -16.993 0.796 4.389 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -15.454 1.633 4.357 1.00 0.00 H new ATOM 0 HG2 PRO A 966 -16.087 -1.196 3.527 1.00 0.00 H new ATOM 0 HG3 PRO A 966 -15.098 -0.006 2.705 1.00 0.00 H new ATOM 0 HD2 PRO A 966 -13.993 -1.979 4.229 1.00 0.00 H new ATOM 0 HD3 PRO A 966 -13.238 -0.405 4.078 1.00 0.00 H new ATOM 1101 N PRO A 967 -17.481 -0.102 7.579 1.00 0.00 N ATOM 1102 CA PRO A 967 -18.628 -0.789 8.174 1.00 0.00 C ATOM 1103 C PRO A 967 -19.714 -1.060 7.141 1.00 0.00 C ATOM 1104 O PRO A 967 -20.178 -0.144 6.461 1.00 0.00 O ATOM 1105 CB PRO A 967 -19.129 0.195 9.236 1.00 0.00 C ATOM 1106 CG PRO A 967 -17.949 1.049 9.549 1.00 0.00 C ATOM 1107 CD PRO A 967 -17.174 1.163 8.267 1.00 0.00 C ATOM 0 HA PRO A 967 -18.361 -1.763 8.583 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -19.961 0.791 8.862 1.00 0.00 H new ATOM 0 HB3 PRO A 967 -19.486 -0.328 10.123 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -18.261 2.031 9.906 1.00 0.00 H new ATOM 0 HG3 PRO A 967 -17.341 0.602 10.335 1.00 0.00 H new ATOM 0 HD2 PRO A 967 -17.488 2.027 7.681 1.00 0.00 H new ATOM 0 HD3 PRO A 967 -16.105 1.273 8.450 1.00 0.00 H new ATOM 1115 N ASP A 968 -20.110 -2.322 7.020 1.00 0.00 N ATOM 1116 CA ASP A 968 -21.134 -2.706 6.060 1.00 0.00 C ATOM 1117 C ASP A 968 -22.440 -1.964 6.334 1.00 0.00 C ATOM 1118 O ASP A 968 -22.959 -1.995 7.450 1.00 0.00 O ATOM 1119 CB ASP A 968 -21.368 -4.217 6.107 1.00 0.00 C ATOM 1120 CG ASP A 968 -20.128 -5.008 5.736 1.00 0.00 C ATOM 1121 OD1 ASP A 968 -19.088 -4.381 5.442 1.00 0.00 O ATOM 1122 OD2 ASP A 968 -20.197 -6.255 5.740 1.00 0.00 O ATOM 0 H ASP A 968 -19.738 -3.094 7.574 1.00 0.00 H new ATOM 0 HA ASP A 968 -20.785 -2.434 5.064 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -21.690 -4.501 7.109 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -22.178 -4.477 5.426 1.00 0.00 H new ATOM 1127 N PRO A 969 -22.992 -1.287 5.311 1.00 0.00 N ATOM 1128 CA PRO A 969 -24.246 -0.540 5.445 1.00 0.00 C ATOM 1129 C PRO A 969 -25.421 -1.449 5.757 1.00 0.00 C ATOM 1130 O PRO A 969 -25.509 -2.567 5.248 1.00 0.00 O ATOM 1131 CB PRO A 969 -24.427 0.121 4.074 1.00 0.00 C ATOM 1132 CG PRO A 969 -23.609 -0.702 3.140 1.00 0.00 C ATOM 1133 CD PRO A 969 -22.444 -1.202 3.945 1.00 0.00 C ATOM 0 HA PRO A 969 -24.207 0.174 6.268 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -25.475 0.132 3.776 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -24.089 1.157 4.087 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -24.191 -1.531 2.738 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -23.271 -0.109 2.290 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -22.095 -2.172 3.590 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -21.596 -0.520 3.893 1.00 0.00 H new ATOM 1141 N VAL A 970 -26.321 -0.958 6.599 1.00 0.00 N ATOM 1142 CA VAL A 970 -27.495 -1.706 6.988 1.00 0.00 C ATOM 1143 C VAL A 970 -28.181 -2.319 5.771 1.00 0.00 C ATOM 1144 O VAL A 970 -28.446 -1.632 4.787 1.00 0.00 O ATOM 1145 CB VAL A 970 -28.473 -0.794 7.734 1.00 0.00 C ATOM 1146 CG1 VAL A 970 -28.647 0.503 6.976 1.00 0.00 C ATOM 1147 CG2 VAL A 970 -29.795 -1.488 7.944 1.00 0.00 C ATOM 0 H VAL A 970 -26.253 -0.034 7.026 1.00 0.00 H new ATOM 0 HA VAL A 970 -27.181 -2.515 7.647 1.00 0.00 H new ATOM 0 HB VAL A 970 -28.064 -0.564 8.718 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -29.344 1.147 7.512 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -27.683 1.005 6.888 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -29.039 0.293 5.981 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -30.475 -0.822 8.476 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -30.226 -1.750 6.978 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -29.641 -2.394 8.531 1.00 0.00 H new ATOM 1157 N ASN A 971 -28.452 -3.620 5.845 1.00 0.00 N ATOM 1158 CA ASN A 971 -29.095 -4.334 4.746 1.00 0.00 C ATOM 1159 C ASN A 971 -28.205 -4.332 3.503 1.00 0.00 C ATOM 1160 O ASN A 971 -28.667 -4.048 2.397 1.00 0.00 O ATOM 1161 CB ASN A 971 -30.457 -3.716 4.420 1.00 0.00 C ATOM 1162 CG ASN A 971 -31.425 -3.796 5.584 1.00 0.00 C ATOM 1163 OD1 ASN A 971 -31.727 -4.881 6.081 1.00 0.00 O ATOM 1164 ND2 ASN A 971 -31.923 -2.645 6.020 1.00 0.00 N ATOM 0 H ASN A 971 -28.236 -4.201 6.655 1.00 0.00 H new ATOM 0 HA ASN A 971 -29.248 -5.366 5.061 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -30.320 -2.672 4.137 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -30.887 -4.227 3.558 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -32.584 -2.637 6.797 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -31.645 -1.769 5.578 1.00 0.00 H new ATOM 1171 N GLY A 972 -26.927 -4.653 3.695 1.00 0.00 N ATOM 1172 CA GLY A 972 -25.993 -4.685 2.581 1.00 0.00 C ATOM 1173 C GLY A 972 -24.686 -5.368 2.940 1.00 0.00 C ATOM 1174 O GLY A 972 -24.645 -6.195 3.851 1.00 0.00 O ATOM 0 H GLY A 972 -26.522 -4.891 4.600 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -26.452 -5.205 1.740 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -25.789 -3.666 2.252 1.00 0.00 H new ATOM 1178 N MET A 973 -23.616 -5.022 2.219 1.00 0.00 N ATOM 1179 CA MET A 973 -22.298 -5.611 2.461 1.00 0.00 C ATOM 1180 C MET A 973 -21.284 -5.129 1.425 1.00 0.00 C ATOM 1181 O MET A 973 -21.605 -5.008 0.241 1.00 0.00 O ATOM 1182 CB MET A 973 -22.386 -7.140 2.420 1.00 0.00 C ATOM 1183 CG MET A 973 -22.812 -7.689 1.067 1.00 0.00 C ATOM 1184 SD MET A 973 -23.087 -9.470 1.089 1.00 0.00 S ATOM 1185 CE MET A 973 -24.500 -9.582 2.186 1.00 0.00 C ATOM 0 H MET A 973 -23.638 -4.337 1.463 1.00 0.00 H new ATOM 0 HA MET A 973 -21.964 -5.293 3.449 1.00 0.00 H new ATOM 0 HB2 MET A 973 -21.415 -7.559 2.683 1.00 0.00 H new ATOM 0 HB3 MET A 973 -23.094 -7.475 3.178 1.00 0.00 H new ATOM 0 HG2 MET A 973 -23.727 -7.189 0.749 1.00 0.00 H new ATOM 0 HG3 MET A 973 -22.047 -7.454 0.327 1.00 0.00 H new ATOM 0 HE1 MET A 973 -25.037 -10.511 1.994 1.00 0.00 H new ATOM 0 HE2 MET A 973 -24.159 -9.567 3.221 1.00 0.00 H new ATOM 0 HE3 MET A 973 -25.165 -8.736 2.011 1.00 0.00 H new ATOM 1195 N VAL A 974 -20.056 -4.860 1.871 1.00 0.00 N ATOM 1196 CA VAL A 974 -19.005 -4.404 0.965 1.00 0.00 C ATOM 1197 C VAL A 974 -18.170 -5.575 0.463 1.00 0.00 C ATOM 1198 O VAL A 974 -17.773 -6.445 1.240 1.00 0.00 O ATOM 1199 CB VAL A 974 -18.060 -3.375 1.627 1.00 0.00 C ATOM 1200 CG1 VAL A 974 -17.213 -4.023 2.714 1.00 0.00 C ATOM 1201 CG2 VAL A 974 -17.161 -2.743 0.578 1.00 0.00 C ATOM 0 H VAL A 974 -19.768 -4.949 2.845 1.00 0.00 H new ATOM 0 HA VAL A 974 -19.515 -3.922 0.131 1.00 0.00 H new ATOM 0 HB VAL A 974 -18.674 -2.603 2.090 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -16.559 -3.274 3.161 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -17.864 -4.441 3.482 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -16.609 -4.819 2.278 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -16.499 -2.020 1.054 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -16.565 -3.517 0.095 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -17.773 -2.238 -0.169 1.00 0.00 H new ATOM 1211 N HIS A 975 -17.891 -5.587 -0.833 1.00 0.00 N ATOM 1212 CA HIS A 975 -17.082 -6.645 -1.419 1.00 0.00 C ATOM 1213 C HIS A 975 -15.625 -6.218 -1.480 1.00 0.00 C ATOM 1214 O HIS A 975 -15.254 -5.364 -2.286 1.00 0.00 O ATOM 1215 CB HIS A 975 -17.555 -6.999 -2.830 1.00 0.00 C ATOM 1216 CG HIS A 975 -18.989 -7.410 -2.915 1.00 0.00 C ATOM 1217 ND1 HIS A 975 -19.576 -8.301 -2.041 1.00 0.00 N ATOM 1218 CD2 HIS A 975 -19.950 -7.064 -3.801 1.00 0.00 C ATOM 1219 CE1 HIS A 975 -20.838 -8.485 -2.388 1.00 0.00 C ATOM 1220 NE2 HIS A 975 -21.089 -7.745 -3.451 1.00 0.00 N ATOM 0 H HIS A 975 -18.211 -4.880 -1.495 1.00 0.00 H new ATOM 0 HA HIS A 975 -17.188 -7.525 -0.785 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -17.397 -6.138 -3.480 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -16.934 -7.808 -3.216 1.00 0.00 H new ATOM 0 HD1 HIS A 975 -19.110 -8.748 -1.251 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -19.842 -6.380 -4.629 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -21.544 -9.131 -1.887 1.00 0.00 H new ATOM 1229 N VAL A 976 -14.802 -6.828 -0.642 1.00 0.00 N ATOM 1230 CA VAL A 976 -13.383 -6.521 -0.620 1.00 0.00 C ATOM 1231 C VAL A 976 -12.747 -6.944 -1.937 1.00 0.00 C ATOM 1232 O VAL A 976 -11.703 -6.430 -2.338 1.00 0.00 O ATOM 1233 CB VAL A 976 -12.682 -7.217 0.561 1.00 0.00 C ATOM 1234 CG1 VAL A 976 -11.200 -6.881 0.585 1.00 0.00 C ATOM 1235 CG2 VAL A 976 -13.347 -6.819 1.870 1.00 0.00 C ATOM 0 H VAL A 976 -15.093 -7.538 0.031 1.00 0.00 H new ATOM 0 HA VAL A 976 -13.264 -5.445 -0.491 1.00 0.00 H new ATOM 0 HB VAL A 976 -12.777 -8.295 0.435 1.00 0.00 H new ATOM 0 HG11 VAL A 976 -10.726 -7.384 1.428 1.00 0.00 H new ATOM 0 HG12 VAL A 976 -10.736 -7.214 -0.344 1.00 0.00 H new ATOM 0 HG13 VAL A 976 -11.073 -5.803 0.688 1.00 0.00 H new ATOM 0 HG21 VAL A 976 -12.844 -7.316 2.699 1.00 0.00 H new ATOM 0 HG22 VAL A 976 -13.278 -5.739 1.999 1.00 0.00 H new ATOM 0 HG23 VAL A 976 -14.396 -7.116 1.851 1.00 0.00 H new ATOM 1245 N ILE A 977 -13.418 -7.885 -2.601 1.00 0.00 N ATOM 1246 CA ILE A 977 -12.990 -8.427 -3.889 1.00 0.00 C ATOM 1247 C ILE A 977 -11.796 -9.359 -3.713 1.00 0.00 C ATOM 1248 O ILE A 977 -11.818 -10.506 -4.160 1.00 0.00 O ATOM 1249 CB ILE A 977 -12.622 -7.315 -4.898 1.00 0.00 C ATOM 1250 CG1 ILE A 977 -13.581 -6.122 -4.785 1.00 0.00 C ATOM 1251 CG2 ILE A 977 -12.644 -7.871 -6.314 1.00 0.00 C ATOM 1252 CD1 ILE A 977 -15.017 -6.437 -5.149 1.00 0.00 C ATOM 0 H ILE A 977 -14.285 -8.297 -2.255 1.00 0.00 H new ATOM 0 HA ILE A 977 -13.837 -8.984 -4.289 1.00 0.00 H new ATOM 0 HB ILE A 977 -11.617 -6.963 -4.664 1.00 0.00 H new ATOM 0 HG12 ILE A 977 -13.553 -5.744 -3.763 1.00 0.00 H new ATOM 0 HG13 ILE A 977 -13.223 -5.321 -5.431 1.00 0.00 H new ATOM 0 HG21 ILE A 977 -12.384 -7.081 -7.019 1.00 0.00 H new ATOM 0 HG22 ILE A 977 -11.923 -8.684 -6.397 1.00 0.00 H new ATOM 0 HG23 ILE A 977 -13.642 -8.247 -6.542 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -15.625 -5.539 -5.041 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -15.063 -6.785 -6.181 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -15.398 -7.215 -4.487 1.00 0.00 H new ATOM 1264 N THR A 978 -10.764 -8.859 -3.043 1.00 0.00 N ATOM 1265 CA THR A 978 -9.556 -9.635 -2.779 1.00 0.00 C ATOM 1266 C THR A 978 -8.909 -9.179 -1.477 1.00 0.00 C ATOM 1267 O THR A 978 -8.711 -9.970 -0.555 1.00 0.00 O ATOM 1268 CB THR A 978 -8.531 -9.500 -3.923 1.00 0.00 C ATOM 1269 OG1 THR A 978 -8.170 -8.125 -4.100 1.00 0.00 O ATOM 1270 CG2 THR A 978 -9.090 -10.053 -5.225 1.00 0.00 C ATOM 0 H THR A 978 -10.740 -7.910 -2.669 1.00 0.00 H new ATOM 0 HA THR A 978 -9.854 -10.681 -2.701 1.00 0.00 H new ATOM 0 HB THR A 978 -7.646 -10.077 -3.654 1.00 0.00 H new ATOM 0 HG1 THR A 978 -7.518 -8.049 -4.827 1.00 0.00 H new ATOM 0 HG21 THR A 978 -8.347 -9.945 -6.015 1.00 0.00 H new ATOM 0 HG22 THR A 978 -9.334 -11.108 -5.097 1.00 0.00 H new ATOM 0 HG23 THR A 978 -9.991 -9.503 -5.497 1.00 0.00 H new ATOM 1278 N ASP A 979 -8.600 -7.886 -1.412 1.00 0.00 N ATOM 1279 CA ASP A 979 -7.987 -7.282 -0.231 1.00 0.00 C ATOM 1280 C ASP A 979 -8.269 -5.786 -0.218 1.00 0.00 C ATOM 1281 O ASP A 979 -8.550 -5.191 -1.258 1.00 0.00 O ATOM 1282 CB ASP A 979 -6.474 -7.505 -0.202 1.00 0.00 C ATOM 1283 CG ASP A 979 -6.083 -8.963 -0.348 1.00 0.00 C ATOM 1284 OD1 ASP A 979 -6.428 -9.763 0.547 1.00 0.00 O ATOM 1285 OD2 ASP A 979 -5.432 -9.304 -1.357 1.00 0.00 O ATOM 0 H ASP A 979 -8.767 -7.229 -2.174 1.00 0.00 H new ATOM 0 HA ASP A 979 -8.420 -7.759 0.648 1.00 0.00 H new ATOM 0 HB2 ASP A 979 -6.013 -6.930 -1.005 1.00 0.00 H new ATOM 0 HB3 ASP A 979 -6.074 -7.120 0.736 1.00 0.00 H new ATOM 1290 N ILE A 980 -8.195 -5.183 0.958 1.00 0.00 N ATOM 1291 CA ILE A 980 -8.448 -3.753 1.090 1.00 0.00 C ATOM 1292 C ILE A 980 -7.153 -2.946 1.054 1.00 0.00 C ATOM 1293 O ILE A 980 -7.045 -1.894 1.683 1.00 0.00 O ATOM 1294 CB ILE A 980 -9.231 -3.429 2.378 1.00 0.00 C ATOM 1295 CG1 ILE A 980 -8.543 -4.041 3.600 1.00 0.00 C ATOM 1296 CG2 ILE A 980 -10.663 -3.930 2.262 1.00 0.00 C ATOM 1297 CD1 ILE A 980 -9.290 -3.801 4.894 1.00 0.00 C ATOM 0 H ILE A 980 -7.963 -5.656 1.831 1.00 0.00 H new ATOM 0 HA ILE A 980 -9.058 -3.466 0.234 1.00 0.00 H new ATOM 0 HB ILE A 980 -9.250 -2.347 2.508 1.00 0.00 H new ATOM 0 HG12 ILE A 980 -8.433 -5.115 3.446 1.00 0.00 H new ATOM 0 HG13 ILE A 980 -7.538 -3.627 3.687 1.00 0.00 H new ATOM 0 HG21 ILE A 980 -11.206 -3.695 3.178 1.00 0.00 H new ATOM 0 HG22 ILE A 980 -11.151 -3.445 1.417 1.00 0.00 H new ATOM 0 HG23 ILE A 980 -10.660 -5.009 2.109 1.00 0.00 H new ATOM 0 HD11 ILE A 980 -8.746 -4.262 5.719 1.00 0.00 H new ATOM 0 HD12 ILE A 980 -9.377 -2.729 5.071 1.00 0.00 H new ATOM 0 HD13 ILE A 980 -10.286 -4.239 4.826 1.00 0.00 H new ATOM 1309 N GLN A 981 -6.180 -3.438 0.290 1.00 0.00 N ATOM 1310 CA GLN A 981 -4.897 -2.760 0.140 1.00 0.00 C ATOM 1311 C GLN A 981 -5.015 -1.607 -0.851 1.00 0.00 C ATOM 1312 O GLN A 981 -5.843 -1.650 -1.762 1.00 0.00 O ATOM 1313 CB GLN A 981 -3.820 -3.741 -0.329 1.00 0.00 C ATOM 1314 CG GLN A 981 -2.998 -4.346 0.800 1.00 0.00 C ATOM 1315 CD GLN A 981 -3.849 -4.978 1.881 1.00 0.00 C ATOM 1316 OE1 GLN A 981 -4.666 -5.859 1.611 1.00 0.00 O ATOM 1317 NE2 GLN A 981 -3.654 -4.536 3.118 1.00 0.00 N ATOM 0 H GLN A 981 -6.258 -4.308 -0.237 1.00 0.00 H new ATOM 0 HA GLN A 981 -4.609 -2.362 1.113 1.00 0.00 H new ATOM 0 HB2 GLN A 981 -4.296 -4.546 -0.890 1.00 0.00 H new ATOM 0 HB3 GLN A 981 -3.149 -3.226 -1.017 1.00 0.00 H new ATOM 0 HG2 GLN A 981 -2.325 -5.099 0.389 1.00 0.00 H new ATOM 0 HG3 GLN A 981 -2.375 -3.570 1.244 1.00 0.00 H new ATOM 0 HE21 GLN A 981 -2.966 -3.804 3.296 1.00 0.00 H new ATOM 0 HE22 GLN A 981 -4.192 -4.928 3.891 1.00 0.00 H new ATOM 1326 N VAL A 982 -4.190 -0.580 -0.669 1.00 0.00 N ATOM 1327 CA VAL A 982 -4.207 0.583 -1.551 1.00 0.00 C ATOM 1328 C VAL A 982 -4.052 0.168 -3.012 1.00 0.00 C ATOM 1329 O VAL A 982 -2.939 0.081 -3.534 1.00 0.00 O ATOM 1330 CB VAL A 982 -3.098 1.590 -1.179 1.00 0.00 C ATOM 1331 CG1 VAL A 982 -3.014 2.711 -2.203 1.00 0.00 C ATOM 1332 CG2 VAL A 982 -3.342 2.154 0.211 1.00 0.00 C ATOM 0 H VAL A 982 -3.501 -0.529 0.081 1.00 0.00 H new ATOM 0 HA VAL A 982 -5.175 1.067 -1.421 1.00 0.00 H new ATOM 0 HB VAL A 982 -2.144 1.062 -1.179 1.00 0.00 H new ATOM 0 HG11 VAL A 982 -2.225 3.407 -1.917 1.00 0.00 H new ATOM 0 HG12 VAL A 982 -2.790 2.292 -3.184 1.00 0.00 H new ATOM 0 HG13 VAL A 982 -3.966 3.239 -2.243 1.00 0.00 H new ATOM 0 HG21 VAL A 982 -2.552 2.863 0.460 1.00 0.00 H new ATOM 0 HG22 VAL A 982 -4.306 2.662 0.233 1.00 0.00 H new ATOM 0 HG23 VAL A 982 -3.343 1.342 0.938 1.00 0.00 H new ATOM 1342 N GLY A 983 -5.182 -0.092 -3.663 1.00 0.00 N ATOM 1343 CA GLY A 983 -5.168 -0.498 -5.055 1.00 0.00 C ATOM 1344 C GLY A 983 -6.456 -1.185 -5.466 1.00 0.00 C ATOM 1345 O GLY A 983 -7.027 -0.879 -6.513 1.00 0.00 O ATOM 0 H GLY A 983 -6.111 -0.028 -3.248 1.00 0.00 H new ATOM 0 HA2 GLY A 983 -5.008 0.377 -5.685 1.00 0.00 H new ATOM 0 HA3 GLY A 983 -4.328 -1.172 -5.226 1.00 0.00 H new ATOM 1349 N SER A 984 -6.912 -2.120 -4.637 1.00 0.00 N ATOM 1350 CA SER A 984 -8.139 -2.860 -4.911 1.00 0.00 C ATOM 1351 C SER A 984 -9.372 -2.031 -4.566 1.00 0.00 C ATOM 1352 O SER A 984 -9.429 -1.388 -3.517 1.00 0.00 O ATOM 1353 CB SER A 984 -8.154 -4.171 -4.122 1.00 0.00 C ATOM 1354 OG SER A 984 -7.052 -4.989 -4.472 1.00 0.00 O ATOM 0 H SER A 984 -6.448 -2.383 -3.768 1.00 0.00 H new ATOM 0 HA SER A 984 -8.165 -3.083 -5.978 1.00 0.00 H new ATOM 0 HB2 SER A 984 -8.127 -3.956 -3.054 1.00 0.00 H new ATOM 0 HB3 SER A 984 -9.084 -4.705 -4.316 1.00 0.00 H new ATOM 0 HG SER A 984 -7.318 -5.931 -4.432 1.00 0.00 H new ATOM 1360 N ARG A 985 -10.361 -2.056 -5.455 1.00 0.00 N ATOM 1361 CA ARG A 985 -11.598 -1.313 -5.246 1.00 0.00 C ATOM 1362 C ARG A 985 -12.691 -2.222 -4.692 1.00 0.00 C ATOM 1363 O ARG A 985 -12.916 -3.318 -5.203 1.00 0.00 O ATOM 1364 CB ARG A 985 -12.055 -0.673 -6.559 1.00 0.00 C ATOM 1365 CG ARG A 985 -13.325 0.152 -6.427 1.00 0.00 C ATOM 1366 CD ARG A 985 -13.652 0.881 -7.719 1.00 0.00 C ATOM 1367 NE ARG A 985 -13.862 -0.040 -8.832 1.00 0.00 N ATOM 1368 CZ ARG A 985 -14.167 0.351 -10.066 1.00 0.00 C ATOM 1369 NH1 ARG A 985 -14.298 1.642 -10.344 1.00 0.00 N ATOM 1370 NH2 ARG A 985 -14.344 -0.549 -11.023 1.00 0.00 N ATOM 0 H ARG A 985 -10.329 -2.583 -6.327 1.00 0.00 H new ATOM 0 HA ARG A 985 -11.407 -0.527 -4.516 1.00 0.00 H new ATOM 0 HB2 ARG A 985 -11.257 -0.036 -6.940 1.00 0.00 H new ATOM 0 HB3 ARG A 985 -12.217 -1.457 -7.298 1.00 0.00 H new ATOM 0 HG2 ARG A 985 -14.156 -0.499 -6.155 1.00 0.00 H new ATOM 0 HG3 ARG A 985 -13.208 0.875 -5.620 1.00 0.00 H new ATOM 0 HD2 ARG A 985 -14.547 1.486 -7.576 1.00 0.00 H new ATOM 0 HD3 ARG A 985 -12.840 1.566 -7.964 1.00 0.00 H new ATOM 0 HE ARG A 985 -13.770 -1.040 -8.653 1.00 0.00 H new ATOM 0 HH11 ARG A 985 -14.165 2.338 -9.610 1.00 0.00 H new ATOM 0 HH12 ARG A 985 -14.532 1.938 -11.292 1.00 0.00 H new ATOM 0 HH21 ARG A 985 -14.246 -1.542 -10.813 1.00 0.00 H new ATOM 0 HH22 ARG A 985 -14.578 -0.248 -11.969 1.00 0.00 H new ATOM 1384 N ILE A 986 -13.368 -1.759 -3.644 1.00 0.00 N ATOM 1385 CA ILE A 986 -14.439 -2.529 -3.016 1.00 0.00 C ATOM 1386 C ILE A 986 -15.802 -2.150 -3.586 1.00 0.00 C ATOM 1387 O ILE A 986 -16.148 -0.969 -3.663 1.00 0.00 O ATOM 1388 CB ILE A 986 -14.458 -2.316 -1.491 1.00 0.00 C ATOM 1389 CG1 ILE A 986 -14.574 -0.825 -1.162 1.00 0.00 C ATOM 1390 CG2 ILE A 986 -13.209 -2.914 -0.860 1.00 0.00 C ATOM 1391 CD1 ILE A 986 -14.647 -0.529 0.320 1.00 0.00 C ATOM 0 H ILE A 986 -13.193 -0.852 -3.211 1.00 0.00 H new ATOM 0 HA ILE A 986 -14.240 -3.579 -3.231 1.00 0.00 H new ATOM 0 HB ILE A 986 -15.328 -2.824 -1.076 1.00 0.00 H new ATOM 0 HG12 ILE A 986 -13.717 -0.302 -1.585 1.00 0.00 H new ATOM 0 HG13 ILE A 986 -15.464 -0.424 -1.647 1.00 0.00 H new ATOM 0 HG21 ILE A 986 -13.235 -2.756 0.218 1.00 0.00 H new ATOM 0 HG22 ILE A 986 -13.172 -3.983 -1.070 1.00 0.00 H new ATOM 0 HG23 ILE A 986 -12.325 -2.431 -1.276 1.00 0.00 H new ATOM 0 HD11 ILE A 986 -14.728 0.547 0.473 1.00 0.00 H new ATOM 0 HD12 ILE A 986 -15.520 -1.023 0.747 1.00 0.00 H new ATOM 0 HD13 ILE A 986 -13.746 -0.898 0.810 1.00 0.00 H new ATOM 1403 N THR A 987 -16.578 -3.156 -3.980 1.00 0.00 N ATOM 1404 CA THR A 987 -17.906 -2.919 -4.535 1.00 0.00 C ATOM 1405 C THR A 987 -18.992 -3.208 -3.515 1.00 0.00 C ATOM 1406 O THR A 987 -18.997 -4.254 -2.874 1.00 0.00 O ATOM 1407 CB THR A 987 -18.166 -3.756 -5.797 1.00 0.00 C ATOM 1408 OG1 THR A 987 -17.697 -5.097 -5.610 1.00 0.00 O ATOM 1409 CG2 THR A 987 -17.489 -3.123 -6.997 1.00 0.00 C ATOM 0 H THR A 987 -16.311 -4.139 -3.925 1.00 0.00 H new ATOM 0 HA THR A 987 -17.936 -1.864 -4.807 1.00 0.00 H new ATOM 0 HB THR A 987 -19.240 -3.786 -5.980 1.00 0.00 H new ATOM 0 HG1 THR A 987 -17.870 -5.620 -6.420 1.00 0.00 H new ATOM 0 HG21 THR A 987 -17.682 -3.727 -7.884 1.00 0.00 H new ATOM 0 HG22 THR A 987 -17.883 -2.118 -7.149 1.00 0.00 H new ATOM 0 HG23 THR A 987 -16.415 -3.068 -6.822 1.00 0.00 H new ATOM 1417 N TYR A 988 -19.914 -2.269 -3.373 1.00 0.00 N ATOM 1418 CA TYR A 988 -21.010 -2.415 -2.423 1.00 0.00 C ATOM 1419 C TYR A 988 -22.255 -2.976 -3.100 1.00 0.00 C ATOM 1420 O TYR A 988 -22.531 -2.679 -4.262 1.00 0.00 O ATOM 1421 CB TYR A 988 -21.336 -1.072 -1.765 1.00 0.00 C ATOM 1422 CG TYR A 988 -20.185 -0.480 -0.982 1.00 0.00 C ATOM 1423 CD1 TYR A 988 -19.030 -0.048 -1.623 1.00 0.00 C ATOM 1424 CD2 TYR A 988 -20.259 -0.343 0.399 1.00 0.00 C ATOM 1425 CE1 TYR A 988 -17.979 0.499 -0.910 1.00 0.00 C ATOM 1426 CE2 TYR A 988 -19.213 0.204 1.117 1.00 0.00 C ATOM 1427 CZ TYR A 988 -18.077 0.623 0.460 1.00 0.00 C ATOM 1428 OH TYR A 988 -17.035 1.168 1.173 1.00 0.00 O ATOM 0 H TYR A 988 -19.927 -1.397 -3.902 1.00 0.00 H new ATOM 0 HA TYR A 988 -20.689 -3.118 -1.655 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -21.640 -0.365 -2.536 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -22.188 -1.202 -1.098 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -18.952 -0.141 -2.696 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -21.148 -0.669 0.919 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -17.087 0.827 -1.423 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -19.286 0.303 2.190 1.00 0.00 H new ATOM 0 HH TYR A 988 -16.961 2.123 0.965 1.00 0.00 H new ATOM 1438 N SER A 989 -23.007 -3.788 -2.361 1.00 0.00 N ATOM 1439 CA SER A 989 -24.226 -4.387 -2.888 1.00 0.00 C ATOM 1440 C SER A 989 -25.251 -4.591 -1.778 1.00 0.00 C ATOM 1441 O SER A 989 -24.990 -5.281 -0.793 1.00 0.00 O ATOM 1442 CB SER A 989 -23.913 -5.726 -3.559 1.00 0.00 C ATOM 1443 OG SER A 989 -23.379 -6.650 -2.627 1.00 0.00 O ATOM 0 H SER A 989 -22.793 -4.045 -1.397 1.00 0.00 H new ATOM 0 HA SER A 989 -24.646 -3.707 -3.629 1.00 0.00 H new ATOM 0 HB2 SER A 989 -24.821 -6.135 -4.002 1.00 0.00 H new ATOM 0 HB3 SER A 989 -23.203 -5.572 -4.371 1.00 0.00 H new ATOM 0 HG SER A 989 -22.409 -6.717 -2.752 1.00 0.00 H new ATOM 1449 N CYS A 990 -26.418 -3.981 -1.950 1.00 0.00 N ATOM 1450 CA CYS A 990 -27.493 -4.083 -0.973 1.00 0.00 C ATOM 1451 C CYS A 990 -28.329 -5.337 -1.199 1.00 0.00 C ATOM 1452 O CYS A 990 -28.480 -5.799 -2.331 1.00 0.00 O ATOM 1453 CB CYS A 990 -28.384 -2.843 -1.039 1.00 0.00 C ATOM 1454 SG CYS A 990 -27.518 -1.289 -0.652 1.00 0.00 S ATOM 0 H CYS A 990 -26.644 -3.407 -2.763 1.00 0.00 H new ATOM 0 HA CYS A 990 -27.042 -4.150 0.017 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -28.813 -2.769 -2.038 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -29.214 -2.967 -0.344 1.00 0.00 H new ATOM 1459 N THR A 991 -28.875 -5.879 -0.116 1.00 0.00 N ATOM 1460 CA THR A 991 -29.703 -7.075 -0.196 1.00 0.00 C ATOM 1461 C THR A 991 -30.969 -6.795 -0.998 1.00 0.00 C ATOM 1462 O THR A 991 -31.500 -5.685 -0.962 1.00 0.00 O ATOM 1463 CB THR A 991 -30.094 -7.587 1.203 1.00 0.00 C ATOM 1464 OG1 THR A 991 -30.924 -8.749 1.086 1.00 0.00 O ATOM 1465 CG2 THR A 991 -30.827 -6.510 1.989 1.00 0.00 C ATOM 0 H THR A 991 -28.759 -5.509 0.827 1.00 0.00 H new ATOM 0 HA THR A 991 -29.113 -7.843 -0.696 1.00 0.00 H new ATOM 0 HB THR A 991 -29.181 -7.846 1.739 1.00 0.00 H new ATOM 0 HG1 THR A 991 -31.167 -9.069 1.980 1.00 0.00 H new ATOM 0 HG21 THR A 991 -31.093 -6.895 2.973 1.00 0.00 H new ATOM 0 HG22 THR A 991 -30.181 -5.639 2.102 1.00 0.00 H new ATOM 0 HG23 THR A 991 -31.733 -6.223 1.455 1.00 0.00 H new ATOM 1473 N THR A 992 -31.436 -7.801 -1.730 1.00 0.00 N ATOM 1474 CA THR A 992 -32.633 -7.657 -2.553 1.00 0.00 C ATOM 1475 C THR A 992 -33.759 -6.978 -1.778 1.00 0.00 C ATOM 1476 O THR A 992 -34.143 -7.427 -0.697 1.00 0.00 O ATOM 1477 CB THR A 992 -33.129 -9.023 -3.066 1.00 0.00 C ATOM 1478 OG1 THR A 992 -32.095 -9.667 -3.819 1.00 0.00 O ATOM 1479 CG2 THR A 992 -34.367 -8.861 -3.935 1.00 0.00 C ATOM 0 H THR A 992 -31.005 -8.724 -1.771 1.00 0.00 H new ATOM 0 HA THR A 992 -32.357 -7.035 -3.404 1.00 0.00 H new ATOM 0 HB THR A 992 -33.389 -9.636 -2.203 1.00 0.00 H new ATOM 0 HG1 THR A 992 -32.417 -10.535 -4.140 1.00 0.00 H new ATOM 0 HG21 THR A 992 -34.697 -9.839 -4.284 1.00 0.00 H new ATOM 0 HG22 THR A 992 -35.162 -8.397 -3.352 1.00 0.00 H new ATOM 0 HG23 THR A 992 -34.130 -8.231 -4.792 1.00 0.00 H new ATOM 1487 N GLY A 993 -34.281 -5.892 -2.341 1.00 0.00 N ATOM 1488 CA GLY A 993 -35.355 -5.161 -1.695 1.00 0.00 C ATOM 1489 C GLY A 993 -35.051 -3.680 -1.563 1.00 0.00 C ATOM 1490 O GLY A 993 -35.894 -2.836 -1.868 1.00 0.00 O ATOM 0 H GLY A 993 -33.978 -5.505 -3.235 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -36.274 -5.291 -2.267 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -35.533 -5.582 -0.705 1.00 0.00 H new ATOM 1494 N HIS A 994 -33.844 -3.366 -1.101 1.00 0.00 N ATOM 1495 CA HIS A 994 -33.423 -1.984 -0.921 1.00 0.00 C ATOM 1496 C HIS A 994 -32.544 -1.527 -2.082 1.00 0.00 C ATOM 1497 O HIS A 994 -31.699 -2.278 -2.567 1.00 0.00 O ATOM 1498 CB HIS A 994 -32.655 -1.841 0.396 1.00 0.00 C ATOM 1499 CG HIS A 994 -33.391 -2.376 1.586 1.00 0.00 C ATOM 1500 ND1 HIS A 994 -33.848 -3.674 1.667 1.00 0.00 N ATOM 1501 CD2 HIS A 994 -33.739 -1.784 2.754 1.00 0.00 C ATOM 1502 CE1 HIS A 994 -34.447 -3.858 2.829 1.00 0.00 C ATOM 1503 NE2 HIS A 994 -34.393 -2.727 3.508 1.00 0.00 N ATOM 0 H HIS A 994 -33.138 -4.056 -0.844 1.00 0.00 H new ATOM 0 HA HIS A 994 -34.313 -1.356 -0.894 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -31.700 -2.360 0.307 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -32.431 -0.787 0.563 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -33.539 -0.762 3.039 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -34.903 -4.777 3.167 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -34.775 -2.578 4.442 1.00 0.00 H new ATOM 1512 N ARG A 995 -32.745 -0.287 -2.515 1.00 0.00 N ATOM 1513 CA ARG A 995 -31.968 0.281 -3.609 1.00 0.00 C ATOM 1514 C ARG A 995 -30.751 1.021 -3.067 1.00 0.00 C ATOM 1515 O ARG A 995 -30.815 1.635 -2.003 1.00 0.00 O ATOM 1516 CB ARG A 995 -32.832 1.236 -4.436 1.00 0.00 C ATOM 1517 CG ARG A 995 -33.421 2.379 -3.625 1.00 0.00 C ATOM 1518 CD ARG A 995 -34.253 3.310 -4.492 1.00 0.00 C ATOM 1519 NE ARG A 995 -33.462 3.929 -5.552 1.00 0.00 N ATOM 1520 CZ ARG A 995 -33.956 4.797 -6.430 1.00 0.00 C ATOM 1521 NH1 ARG A 995 -35.233 5.147 -6.374 1.00 0.00 N ATOM 1522 NH2 ARG A 995 -33.172 5.314 -7.365 1.00 0.00 N ATOM 0 H ARG A 995 -33.442 0.346 -2.123 1.00 0.00 H new ATOM 0 HA ARG A 995 -31.629 -0.533 -4.250 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -32.230 1.648 -5.246 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -33.643 0.672 -4.897 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -34.041 1.976 -2.824 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -32.617 2.943 -3.153 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -35.077 2.751 -4.935 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -34.694 4.088 -3.868 1.00 0.00 H new ATOM 0 HE ARG A 995 -32.475 3.682 -5.623 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -35.839 4.750 -5.656 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -35.609 5.813 -7.049 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -32.189 5.046 -7.412 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -33.552 5.980 -8.038 1.00 0.00 H new ATOM 1536 N LEU A 996 -29.643 0.948 -3.795 1.00 0.00 N ATOM 1537 CA LEU A 996 -28.408 1.606 -3.380 1.00 0.00 C ATOM 1538 C LEU A 996 -28.509 3.124 -3.556 1.00 0.00 C ATOM 1539 O LEU A 996 -28.975 3.609 -4.587 1.00 0.00 O ATOM 1540 CB LEU A 996 -27.225 1.048 -4.179 1.00 0.00 C ATOM 1541 CG LEU A 996 -25.838 1.400 -3.643 1.00 0.00 C ATOM 1542 CD1 LEU A 996 -24.786 0.474 -4.231 1.00 0.00 C ATOM 1543 CD2 LEU A 996 -25.512 2.844 -3.950 1.00 0.00 C ATOM 0 H LEU A 996 -29.574 0.440 -4.676 1.00 0.00 H new ATOM 0 HA LEU A 996 -28.247 1.403 -2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -27.315 -0.038 -4.216 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -27.300 1.409 -5.205 1.00 0.00 H new ATOM 0 HG LEU A 996 -25.838 1.267 -2.561 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -23.805 0.741 -3.837 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -25.017 -0.557 -3.962 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -24.780 0.573 -5.316 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -24.521 3.083 -3.563 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -25.528 2.999 -5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -26.252 3.492 -3.479 1.00 0.00 H new ATOM 1555 N ILE A 997 -28.055 3.863 -2.546 1.00 0.00 N ATOM 1556 CA ILE A 997 -28.076 5.325 -2.582 1.00 0.00 C ATOM 1557 C ILE A 997 -26.658 5.891 -2.577 1.00 0.00 C ATOM 1558 O ILE A 997 -25.788 5.400 -1.859 1.00 0.00 O ATOM 1559 CB ILE A 997 -28.861 5.918 -1.387 1.00 0.00 C ATOM 1560 CG1 ILE A 997 -30.363 5.743 -1.579 1.00 0.00 C ATOM 1561 CG2 ILE A 997 -28.537 7.385 -1.188 1.00 0.00 C ATOM 1562 CD1 ILE A 997 -30.834 4.339 -1.328 1.00 0.00 C ATOM 0 H ILE A 997 -27.666 3.472 -1.688 1.00 0.00 H new ATOM 0 HA ILE A 997 -28.580 5.609 -3.506 1.00 0.00 H new ATOM 0 HB ILE A 997 -28.554 5.371 -0.496 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -30.890 6.421 -0.907 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -30.628 6.032 -2.596 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -29.104 7.771 -0.341 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -27.471 7.499 -0.993 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -28.802 7.941 -2.087 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -31.912 4.284 -1.482 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -30.334 3.659 -2.017 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -30.599 4.054 -0.302 1.00 0.00 H new ATOM 1574 N GLY A 998 -26.437 6.934 -3.372 1.00 0.00 N ATOM 1575 CA GLY A 998 -25.126 7.554 -3.431 1.00 0.00 C ATOM 1576 C GLY A 998 -24.227 6.954 -4.495 1.00 0.00 C ATOM 1577 O GLY A 998 -24.591 6.899 -5.669 1.00 0.00 O ATOM 0 H GLY A 998 -27.141 7.360 -3.975 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -25.244 8.620 -3.624 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -24.642 7.458 -2.459 1.00 0.00 H new ATOM 1581 N HIS A 999 -23.039 6.522 -4.080 1.00 0.00 N ATOM 1582 CA HIS A 999 -22.064 5.941 -4.999 1.00 0.00 C ATOM 1583 C HIS A 999 -22.416 4.493 -5.340 1.00 0.00 C ATOM 1584 O HIS A 999 -23.568 4.186 -5.643 1.00 0.00 O ATOM 1585 CB HIS A 999 -20.668 6.022 -4.382 1.00 0.00 C ATOM 1586 CG HIS A 999 -20.282 7.406 -3.963 1.00 0.00 C ATOM 1587 ND1 HIS A 999 -20.154 8.454 -4.852 1.00 0.00 N ATOM 1588 CD2 HIS A 999 -20.006 7.917 -2.740 1.00 0.00 C ATOM 1589 CE1 HIS A 999 -19.815 9.548 -4.192 1.00 0.00 C ATOM 1590 NE2 HIS A 999 -19.720 9.249 -2.910 1.00 0.00 N ATOM 0 H HIS A 999 -22.727 6.564 -3.110 1.00 0.00 H new ATOM 0 HA HIS A 999 -22.082 6.511 -5.928 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -20.623 5.362 -3.515 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -19.939 5.652 -5.102 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -20.010 7.377 -1.805 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -19.645 10.521 -4.628 1.00 0.00 H new ATOM 0 HE2 HIS A 999 -19.474 9.902 -2.166 1.00 0.00 H new ATOM 1599 N SER A1000 -21.417 3.608 -5.299 1.00 0.00 N ATOM 1600 CA SER A1000 -21.626 2.196 -5.614 1.00 0.00 C ATOM 1601 C SER A1000 -20.333 1.403 -5.439 1.00 0.00 C ATOM 1602 O SER A1000 -20.361 0.204 -5.159 1.00 0.00 O ATOM 1603 CB SER A1000 -22.138 2.039 -7.047 1.00 0.00 C ATOM 1604 OG SER A1000 -21.217 2.572 -7.982 1.00 0.00 O ATOM 0 H SER A1000 -20.457 3.846 -5.051 1.00 0.00 H new ATOM 0 HA SER A1000 -22.372 1.804 -4.923 1.00 0.00 H new ATOM 0 HB2 SER A1000 -22.308 0.984 -7.261 1.00 0.00 H new ATOM 0 HB3 SER A1000 -23.098 2.544 -7.150 1.00 0.00 H new ATOM 0 HG SER A1000 -21.569 2.457 -8.890 1.00 0.00 H new ATOM 1610 N SER A1001 -19.205 2.081 -5.617 1.00 0.00 N ATOM 1611 CA SER A1001 -17.895 1.450 -5.493 1.00 0.00 C ATOM 1612 C SER A1001 -16.850 2.471 -5.052 1.00 0.00 C ATOM 1613 O SER A1001 -16.989 3.665 -5.312 1.00 0.00 O ATOM 1614 CB SER A1001 -17.481 0.826 -6.827 1.00 0.00 C ATOM 1615 OG SER A1001 -18.424 -0.143 -7.251 1.00 0.00 O ATOM 0 H SER A1001 -19.171 3.074 -5.849 1.00 0.00 H new ATOM 0 HA SER A1001 -17.960 0.666 -4.738 1.00 0.00 H new ATOM 0 HB2 SER A1001 -17.390 1.605 -7.584 1.00 0.00 H new ATOM 0 HB3 SER A1001 -16.499 0.363 -6.726 1.00 0.00 H new ATOM 0 HG SER A1001 -18.256 -0.374 -8.188 1.00 0.00 H new ATOM 1621 N ALA A1002 -15.805 1.994 -4.382 1.00 0.00 N ATOM 1622 CA ALA A1002 -14.741 2.869 -3.906 1.00 0.00 C ATOM 1623 C ALA A1002 -13.418 2.118 -3.823 1.00 0.00 C ATOM 1624 O ALA A1002 -13.341 1.037 -3.241 1.00 0.00 O ATOM 1625 CB ALA A1002 -15.102 3.454 -2.549 1.00 0.00 C ATOM 0 H ALA A1002 -15.673 1.008 -4.157 1.00 0.00 H new ATOM 0 HA ALA A1002 -14.627 3.685 -4.620 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -14.297 4.105 -2.208 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -16.023 4.030 -2.635 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -15.245 2.646 -1.831 1.00 0.00 H new ATOM 1631 N GLU A1003 -12.384 2.697 -4.421 1.00 0.00 N ATOM 1632 CA GLU A1003 -11.061 2.082 -4.435 1.00 0.00 C ATOM 1633 C GLU A1003 -10.178 2.615 -3.316 1.00 0.00 C ATOM 1634 O GLU A1003 -10.140 3.819 -3.058 1.00 0.00 O ATOM 1635 CB GLU A1003 -10.381 2.332 -5.781 1.00 0.00 C ATOM 1636 CG GLU A1003 -10.352 3.798 -6.179 1.00 0.00 C ATOM 1637 CD GLU A1003 -9.708 4.025 -7.534 1.00 0.00 C ATOM 1638 OE1 GLU A1003 -9.279 3.034 -8.162 1.00 0.00 O ATOM 1639 OE2 GLU A1003 -9.634 5.195 -7.966 1.00 0.00 O ATOM 0 H GLU A1003 -12.436 3.594 -4.904 1.00 0.00 H new ATOM 0 HA GLU A1003 -11.196 1.012 -4.280 1.00 0.00 H new ATOM 0 HB2 GLU A1003 -9.359 1.954 -5.739 1.00 0.00 H new ATOM 0 HB3 GLU A1003 -10.900 1.764 -6.553 1.00 0.00 H new ATOM 0 HG2 GLU A1003 -11.371 4.186 -6.196 1.00 0.00 H new ATOM 0 HG3 GLU A1003 -9.808 4.365 -5.423 1.00 0.00 H new ATOM 1646 N CYS A1004 -9.446 1.711 -2.673 1.00 0.00 N ATOM 1647 CA CYS A1004 -8.536 2.094 -1.603 1.00 0.00 C ATOM 1648 C CYS A1004 -7.345 2.831 -2.198 1.00 0.00 C ATOM 1649 O CYS A1004 -6.394 2.210 -2.672 1.00 0.00 O ATOM 1650 CB CYS A1004 -8.055 0.857 -0.839 1.00 0.00 C ATOM 1651 SG CYS A1004 -6.829 1.208 0.464 1.00 0.00 S ATOM 0 H CYS A1004 -9.466 0.711 -2.874 1.00 0.00 H new ATOM 0 HA CYS A1004 -9.061 2.747 -0.905 1.00 0.00 H new ATOM 0 HB2 CYS A1004 -8.917 0.366 -0.387 1.00 0.00 H new ATOM 0 HB3 CYS A1004 -7.622 0.152 -1.549 1.00 0.00 H new ATOM 1656 N ILE A1005 -7.410 4.155 -2.196 1.00 0.00 N ATOM 1657 CA ILE A1005 -6.339 4.958 -2.763 1.00 0.00 C ATOM 1658 C ILE A1005 -5.460 5.577 -1.682 1.00 0.00 C ATOM 1659 O ILE A1005 -5.391 5.075 -0.557 1.00 0.00 O ATOM 1660 CB ILE A1005 -6.903 6.068 -3.669 1.00 0.00 C ATOM 1661 CG1 ILE A1005 -7.841 6.979 -2.873 1.00 0.00 C ATOM 1662 CG2 ILE A1005 -7.627 5.455 -4.862 1.00 0.00 C ATOM 1663 CD1 ILE A1005 -8.412 8.122 -3.684 1.00 0.00 C ATOM 0 H ILE A1005 -8.187 4.692 -1.811 1.00 0.00 H new ATOM 0 HA ILE A1005 -5.723 4.286 -3.360 1.00 0.00 H new ATOM 0 HB ILE A1005 -6.076 6.673 -4.042 1.00 0.00 H new ATOM 0 HG12 ILE A1005 -8.662 6.382 -2.475 1.00 0.00 H new ATOM 0 HG13 ILE A1005 -7.300 7.386 -2.019 1.00 0.00 H new ATOM 0 HG21 ILE A1005 -8.022 6.249 -5.496 1.00 0.00 H new ATOM 0 HG22 ILE A1005 -6.930 4.845 -5.437 1.00 0.00 H new ATOM 0 HG23 ILE A1005 -8.448 4.832 -4.508 1.00 0.00 H new ATOM 0 HD11 ILE A1005 -9.067 8.724 -3.054 1.00 0.00 H new ATOM 0 HD12 ILE A1005 -7.599 8.743 -4.060 1.00 0.00 H new ATOM 0 HD13 ILE A1005 -8.982 7.723 -4.523 1.00 0.00 H new ATOM 1675 N LEU A1006 -4.781 6.665 -2.034 1.00 0.00 N ATOM 1676 CA LEU A1006 -3.888 7.343 -1.102 1.00 0.00 C ATOM 1677 C LEU A1006 -3.740 8.822 -1.446 1.00 0.00 C ATOM 1678 O LEU A1006 -3.601 9.189 -2.613 1.00 0.00 O ATOM 1679 CB LEU A1006 -2.513 6.671 -1.127 1.00 0.00 C ATOM 1680 CG LEU A1006 -1.456 7.318 -0.233 1.00 0.00 C ATOM 1681 CD1 LEU A1006 -1.821 7.147 1.231 1.00 0.00 C ATOM 1682 CD2 LEU A1006 -0.085 6.722 -0.510 1.00 0.00 C ATOM 0 H LEU A1006 -4.833 7.095 -2.957 1.00 0.00 H new ATOM 0 HA LEU A1006 -4.321 7.269 -0.105 1.00 0.00 H new ATOM 0 HB2 LEU A1006 -2.630 5.629 -0.828 1.00 0.00 H new ATOM 0 HB3 LEU A1006 -2.146 6.669 -2.153 1.00 0.00 H new ATOM 0 HG LEU A1006 -1.421 8.384 -0.459 1.00 0.00 H new ATOM 0 HD11 LEU A1006 -1.057 7.614 1.853 1.00 0.00 H new ATOM 0 HD12 LEU A1006 -2.784 7.619 1.423 1.00 0.00 H new ATOM 0 HD13 LEU A1006 -1.884 6.085 1.469 1.00 0.00 H new ATOM 0 HD21 LEU A1006 0.655 7.195 0.136 1.00 0.00 H new ATOM 0 HD22 LEU A1006 -0.107 5.650 -0.312 1.00 0.00 H new ATOM 0 HD23 LEU A1006 0.182 6.893 -1.553 1.00 0.00 H new ATOM 1694 N SER A1007 -3.761 9.663 -0.418 1.00 0.00 N ATOM 1695 CA SER A1007 -3.622 11.104 -0.597 1.00 0.00 C ATOM 1696 C SER A1007 -2.155 11.518 -0.535 1.00 0.00 C ATOM 1697 O SER A1007 -1.707 12.376 -1.296 1.00 0.00 O ATOM 1698 CB SER A1007 -4.418 11.853 0.472 1.00 0.00 C ATOM 1699 OG SER A1007 -4.281 13.256 0.322 1.00 0.00 O ATOM 0 H SER A1007 -3.873 9.370 0.553 1.00 0.00 H new ATOM 0 HA SER A1007 -4.016 11.362 -1.580 1.00 0.00 H new ATOM 0 HB2 SER A1007 -5.471 11.578 0.405 1.00 0.00 H new ATOM 0 HB3 SER A1007 -4.073 11.555 1.462 1.00 0.00 H new ATOM 0 HG SER A1007 -4.801 13.712 1.017 1.00 0.00 H new ATOM 1705 N GLY A1008 -1.412 10.905 0.384 1.00 0.00 N ATOM 1706 CA GLY A1008 -0.004 11.223 0.539 1.00 0.00 C ATOM 1707 C GLY A1008 0.711 10.253 1.461 1.00 0.00 C ATOM 1708 O GLY A1008 1.886 9.947 1.259 1.00 0.00 O ATOM 0 H GLY A1008 -1.762 10.193 1.025 1.00 0.00 H new ATOM 0 HA2 GLY A1008 0.478 11.212 -0.439 1.00 0.00 H new ATOM 0 HA3 GLY A1008 0.096 12.235 0.933 1.00 0.00 H new ATOM 1712 N ASN A1009 -0.001 9.771 2.476 1.00 0.00 N ATOM 1713 CA ASN A1009 0.570 8.831 3.435 1.00 0.00 C ATOM 1714 C ASN A1009 -0.513 7.950 4.045 1.00 0.00 C ATOM 1715 O ASN A1009 -0.314 6.750 4.237 1.00 0.00 O ATOM 1716 CB ASN A1009 1.310 9.582 4.542 1.00 0.00 C ATOM 1717 CG ASN A1009 0.426 10.587 5.253 1.00 0.00 C ATOM 1718 OD1 ASN A1009 -0.098 11.516 4.636 1.00 0.00 O ATOM 1719 ND2 ASN A1009 0.255 10.408 6.557 1.00 0.00 N ATOM 0 H ASN A1009 -0.975 10.016 2.655 1.00 0.00 H new ATOM 0 HA ASN A1009 1.276 8.195 2.901 1.00 0.00 H new ATOM 0 HB2 ASN A1009 1.696 8.866 5.267 1.00 0.00 H new ATOM 0 HB3 ASN A1009 2.170 10.098 4.115 1.00 0.00 H new ATOM 0 HD21 ASN A1009 -0.329 11.054 7.088 1.00 0.00 H new ATOM 0 HD22 ASN A1009 0.708 9.625 7.028 1.00 0.00 H new ATOM 1726 N THR A1010 -1.661 8.549 4.342 1.00 0.00 N ATOM 1727 CA THR A1010 -2.773 7.810 4.923 1.00 0.00 C ATOM 1728 C THR A1010 -3.689 7.272 3.830 1.00 0.00 C ATOM 1729 O THR A1010 -4.098 8.008 2.931 1.00 0.00 O ATOM 1730 CB THR A1010 -3.595 8.692 5.883 1.00 0.00 C ATOM 1731 OG1 THR A1010 -2.746 9.222 6.907 1.00 0.00 O ATOM 1732 CG2 THR A1010 -4.721 7.893 6.518 1.00 0.00 C ATOM 0 H THR A1010 -1.845 9.541 4.190 1.00 0.00 H new ATOM 0 HA THR A1010 -2.349 6.979 5.487 1.00 0.00 H new ATOM 0 HB THR A1010 -4.029 9.511 5.309 1.00 0.00 H new ATOM 0 HG1 THR A1010 -3.275 9.783 7.512 1.00 0.00 H new ATOM 0 HG21 THR A1010 -5.288 8.535 7.192 1.00 0.00 H new ATOM 0 HG22 THR A1010 -5.381 7.512 5.739 1.00 0.00 H new ATOM 0 HG23 THR A1010 -4.303 7.058 7.080 1.00 0.00 H new ATOM 1740 N ALA A1011 -4.003 5.984 3.908 1.00 0.00 N ATOM 1741 CA ALA A1011 -4.862 5.345 2.919 1.00 0.00 C ATOM 1742 C ALA A1011 -6.328 5.660 3.181 1.00 0.00 C ATOM 1743 O ALA A1011 -6.765 5.708 4.331 1.00 0.00 O ATOM 1744 CB ALA A1011 -4.637 3.840 2.920 1.00 0.00 C ATOM 0 H ALA A1011 -3.675 5.362 4.647 1.00 0.00 H new ATOM 0 HA ALA A1011 -4.602 5.741 1.938 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -5.285 3.375 2.177 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -3.596 3.628 2.678 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -4.869 3.438 3.906 1.00 0.00 H new ATOM 1750 N HIS A1012 -7.083 5.879 2.108 1.00 0.00 N ATOM 1751 CA HIS A1012 -8.502 6.196 2.237 1.00 0.00 C ATOM 1752 C HIS A1012 -9.265 5.856 0.960 1.00 0.00 C ATOM 1753 O HIS A1012 -8.735 5.974 -0.145 1.00 0.00 O ATOM 1754 CB HIS A1012 -8.691 7.677 2.580 1.00 0.00 C ATOM 1755 CG HIS A1012 -8.178 8.612 1.528 1.00 0.00 C ATOM 1756 ND1 HIS A1012 -8.673 8.642 0.242 1.00 0.00 N ATOM 1757 CD2 HIS A1012 -7.212 9.558 1.579 1.00 0.00 C ATOM 1758 CE1 HIS A1012 -8.034 9.565 -0.452 1.00 0.00 C ATOM 1759 NE2 HIS A1012 -7.143 10.137 0.335 1.00 0.00 N ATOM 0 H HIS A1012 -6.740 5.843 1.148 1.00 0.00 H new ATOM 0 HA HIS A1012 -8.905 5.588 3.047 1.00 0.00 H new ATOM 0 HB2 HIS A1012 -9.752 7.871 2.739 1.00 0.00 H new ATOM 0 HB3 HIS A1012 -8.183 7.890 3.521 1.00 0.00 H new ATOM 0 HD1 HIS A1012 -9.417 8.044 -0.117 1.00 0.00 H new ATOM 0 HD2 HIS A1012 -6.608 9.811 2.438 1.00 0.00 H new ATOM 0 HE1 HIS A1012 -8.211 9.810 -1.489 1.00 0.00 H new ATOM 1768 N TRP A1013 -10.513 5.427 1.126 1.00 0.00 N ATOM 1769 CA TRP A1013 -11.356 5.065 -0.003 1.00 0.00 C ATOM 1770 C TRP A1013 -11.713 6.295 -0.824 1.00 0.00 C ATOM 1771 O TRP A1013 -11.946 7.375 -0.280 1.00 0.00 O ATOM 1772 CB TRP A1013 -12.628 4.369 0.481 1.00 0.00 C ATOM 1773 CG TRP A1013 -12.358 3.206 1.384 1.00 0.00 C ATOM 1774 CD1 TRP A1013 -12.421 3.196 2.747 1.00 0.00 C ATOM 1775 CD2 TRP A1013 -11.956 1.890 0.989 1.00 0.00 C ATOM 1776 NE1 TRP A1013 -12.100 1.948 3.225 1.00 0.00 N ATOM 1777 CE2 TRP A1013 -11.807 1.130 2.164 1.00 0.00 C ATOM 1778 CE3 TRP A1013 -11.713 1.280 -0.244 1.00 0.00 C ATOM 1779 CZ2 TRP A1013 -11.427 -0.209 2.141 1.00 0.00 C ATOM 1780 CZ3 TRP A1013 -11.333 -0.049 -0.265 1.00 0.00 C ATOM 1781 CH2 TRP A1013 -11.194 -0.781 0.921 1.00 0.00 C ATOM 0 H TRP A1013 -10.962 5.322 2.036 1.00 0.00 H new ATOM 0 HA TRP A1013 -10.798 4.375 -0.636 1.00 0.00 H new ATOM 0 HB2 TRP A1013 -13.252 5.092 1.007 1.00 0.00 H new ATOM 0 HB3 TRP A1013 -13.197 4.025 -0.383 1.00 0.00 H new ATOM 0 HD1 TRP A1013 -12.685 4.045 3.361 1.00 0.00 H new ATOM 0 HE1 TRP A1013 -12.083 1.675 4.208 1.00 0.00 H new ATOM 0 HE3 TRP A1013 -11.820 1.836 -1.164 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 -11.320 -0.776 3.054 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 -11.140 -0.531 -1.212 1.00 0.00 H new ATOM 0 HH2 TRP A1013 -10.897 -1.818 0.871 1.00 0.00 H new ATOM 1792 N SER A1014 -11.747 6.122 -2.137 1.00 0.00 N ATOM 1793 CA SER A1014 -12.066 7.211 -3.049 1.00 0.00 C ATOM 1794 C SER A1014 -13.435 7.813 -2.740 1.00 0.00 C ATOM 1795 O SER A1014 -13.653 9.007 -2.942 1.00 0.00 O ATOM 1796 CB SER A1014 -12.026 6.711 -4.490 1.00 0.00 C ATOM 1797 OG SER A1014 -13.009 5.716 -4.716 1.00 0.00 O ATOM 0 H SER A1014 -11.556 5.232 -2.597 1.00 0.00 H new ATOM 0 HA SER A1014 -11.319 7.993 -2.916 1.00 0.00 H new ATOM 0 HB2 SER A1014 -12.187 7.546 -5.172 1.00 0.00 H new ATOM 0 HB3 SER A1014 -11.038 6.306 -4.710 1.00 0.00 H new ATOM 0 HG SER A1014 -13.071 5.530 -5.676 1.00 0.00 H new ATOM 1803 N THR A1015 -14.359 6.982 -2.262 1.00 0.00 N ATOM 1804 CA THR A1015 -15.705 7.447 -1.941 1.00 0.00 C ATOM 1805 C THR A1015 -16.261 6.762 -0.695 1.00 0.00 C ATOM 1806 O THR A1015 -16.087 5.558 -0.503 1.00 0.00 O ATOM 1807 CB THR A1015 -16.677 7.207 -3.111 1.00 0.00 C ATOM 1808 OG1 THR A1015 -16.745 5.810 -3.416 1.00 0.00 O ATOM 1809 CG2 THR A1015 -16.243 7.980 -4.346 1.00 0.00 C ATOM 0 H THR A1015 -14.201 5.989 -2.089 1.00 0.00 H new ATOM 0 HA THR A1015 -15.620 8.517 -1.751 1.00 0.00 H new ATOM 0 HB THR A1015 -17.663 7.560 -2.810 1.00 0.00 H new ATOM 0 HG1 THR A1015 -16.860 5.691 -4.382 1.00 0.00 H new ATOM 0 HG21 THR A1015 -16.946 7.793 -5.158 1.00 0.00 H new ATOM 0 HG22 THR A1015 -16.224 9.046 -4.120 1.00 0.00 H new ATOM 0 HG23 THR A1015 -15.247 7.656 -4.647 1.00 0.00 H new ATOM 1817 N LYS A1016 -16.935 7.544 0.143 1.00 0.00 N ATOM 1818 CA LYS A1016 -17.530 7.033 1.373 1.00 0.00 C ATOM 1819 C LYS A1016 -18.638 6.026 1.052 1.00 0.00 C ATOM 1820 O LYS A1016 -19.423 6.234 0.127 1.00 0.00 O ATOM 1821 CB LYS A1016 -18.074 8.202 2.206 1.00 0.00 C ATOM 1822 CG LYS A1016 -18.516 7.827 3.616 1.00 0.00 C ATOM 1823 CD LYS A1016 -19.885 7.167 3.632 1.00 0.00 C ATOM 1824 CE LYS A1016 -20.971 8.124 3.167 1.00 0.00 C ATOM 1825 NZ LYS A1016 -21.078 9.316 4.053 1.00 0.00 N ATOM 0 H LYS A1016 -17.083 8.542 -0.010 1.00 0.00 H new ATOM 0 HA LYS A1016 -16.767 6.516 1.954 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -17.305 8.971 2.273 1.00 0.00 H new ATOM 0 HB3 LYS A1016 -18.921 8.643 1.679 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -17.783 7.151 4.057 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -18.539 8.722 4.238 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -19.874 6.288 2.988 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -20.111 6.821 4.640 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -20.758 8.447 2.148 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -21.928 7.603 3.143 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -21.974 9.809 3.865 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -21.052 9.013 5.047 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -20.283 9.960 3.866 1.00 0.00 H new ATOM 1839 N PRO A1017 -18.705 4.911 1.808 1.00 0.00 N ATOM 1840 CA PRO A1017 -19.711 3.860 1.596 1.00 0.00 C ATOM 1841 C PRO A1017 -21.121 4.411 1.374 1.00 0.00 C ATOM 1842 O PRO A1017 -21.569 5.305 2.090 1.00 0.00 O ATOM 1843 CB PRO A1017 -19.650 3.065 2.898 1.00 0.00 C ATOM 1844 CG PRO A1017 -18.238 3.204 3.352 1.00 0.00 C ATOM 1845 CD PRO A1017 -17.794 4.578 2.923 1.00 0.00 C ATOM 0 HA PRO A1017 -19.503 3.276 0.699 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -20.346 3.460 3.638 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -19.915 2.020 2.738 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -18.164 3.090 4.434 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -17.608 2.434 2.907 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -17.878 5.298 3.737 1.00 0.00 H new ATOM 0 HD3 PRO A1017 -16.752 4.580 2.603 1.00 0.00 H new ATOM 1853 N PRO A1018 -21.841 3.879 0.367 1.00 0.00 N ATOM 1854 CA PRO A1018 -23.207 4.318 0.044 1.00 0.00 C ATOM 1855 C PRO A1018 -24.213 3.980 1.141 1.00 0.00 C ATOM 1856 O PRO A1018 -23.856 3.853 2.312 1.00 0.00 O ATOM 1857 CB PRO A1018 -23.536 3.545 -1.237 1.00 0.00 C ATOM 1858 CG PRO A1018 -22.644 2.353 -1.205 1.00 0.00 C ATOM 1859 CD PRO A1018 -21.379 2.808 -0.536 1.00 0.00 C ATOM 0 HA PRO A1018 -23.265 5.401 -0.064 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -24.586 3.252 -1.263 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -23.352 4.152 -2.123 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -23.105 1.534 -0.654 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -22.444 1.987 -2.212 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -20.900 1.997 0.013 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -20.651 3.177 -1.259 1.00 0.00 H new ATOM 1867 N ILE A1019 -25.477 3.843 0.747 1.00 0.00 N ATOM 1868 CA ILE A1019 -26.548 3.526 1.689 1.00 0.00 C ATOM 1869 C ILE A1019 -27.554 2.553 1.095 1.00 0.00 C ATOM 1870 O ILE A1019 -27.887 2.632 -0.086 1.00 0.00 O ATOM 1871 CB ILE A1019 -27.345 4.776 2.102 1.00 0.00 C ATOM 1872 CG1 ILE A1019 -26.436 5.878 2.631 1.00 0.00 C ATOM 1873 CG2 ILE A1019 -28.390 4.408 3.147 1.00 0.00 C ATOM 1874 CD1 ILE A1019 -27.201 7.141 2.954 1.00 0.00 C ATOM 0 H ILE A1019 -25.785 3.947 -0.220 1.00 0.00 H new ATOM 0 HA ILE A1019 -26.046 3.088 2.552 1.00 0.00 H new ATOM 0 HB ILE A1019 -27.843 5.160 1.212 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -25.924 5.526 3.527 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -25.667 6.100 1.891 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -28.949 5.299 3.433 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -29.075 3.668 2.732 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -27.896 3.993 4.025 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -26.512 7.898 3.328 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -27.692 7.510 2.053 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -27.952 6.927 3.714 1.00 0.00 H new ATOM 1886 N CYS A1020 -28.082 1.677 1.936 1.00 0.00 N ATOM 1887 CA CYS A1020 -29.104 0.740 1.509 1.00 0.00 C ATOM 1888 C CYS A1020 -30.453 1.219 2.027 1.00 0.00 C ATOM 1889 O CYS A1020 -30.616 1.444 3.226 1.00 0.00 O ATOM 1890 CB CYS A1020 -28.800 -0.668 2.019 1.00 0.00 C ATOM 1891 SG CYS A1020 -27.258 -1.375 1.360 1.00 0.00 S ATOM 0 H CYS A1020 -27.818 1.597 2.918 1.00 0.00 H new ATOM 0 HA CYS A1020 -29.123 0.696 0.420 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -28.741 -0.645 3.107 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -29.630 -1.325 1.758 1.00 0.00 H new ATOM 1896 N GLN A1021 -31.410 1.405 1.126 1.00 0.00 N ATOM 1897 CA GLN A1021 -32.726 1.896 1.517 1.00 0.00 C ATOM 1898 C GLN A1021 -33.820 1.223 0.695 1.00 0.00 C ATOM 1899 O GLN A1021 -33.764 1.211 -0.533 1.00 0.00 O ATOM 1900 CB GLN A1021 -32.782 3.414 1.310 1.00 0.00 C ATOM 1901 CG GLN A1021 -33.565 4.161 2.377 1.00 0.00 C ATOM 1902 CD GLN A1021 -32.849 4.214 3.715 1.00 0.00 C ATOM 1903 OE1 GLN A1021 -33.418 4.646 4.717 1.00 0.00 O ATOM 1904 NE2 GLN A1021 -31.588 3.794 3.736 1.00 0.00 N ATOM 0 H GLN A1021 -31.302 1.225 0.128 1.00 0.00 H new ATOM 0 HA GLN A1021 -32.892 1.659 2.568 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -31.764 3.803 1.283 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -33.228 3.620 0.337 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -33.756 5.178 2.034 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -34.535 3.682 2.510 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -31.153 3.443 2.883 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -31.055 3.823 4.605 1.00 0.00 H new ATOM 1913 N ARG A1022 -34.809 0.659 1.382 1.00 0.00 N ATOM 1914 CA ARG A1022 -35.915 -0.030 0.721 1.00 0.00 C ATOM 1915 C ARG A1022 -36.513 0.825 -0.381 1.00 0.00 C ATOM 1916 O ARG A1022 -36.709 2.031 -0.224 1.00 0.00 O ATOM 1917 CB ARG A1022 -36.999 -0.419 1.732 1.00 0.00 C ATOM 1918 CG ARG A1022 -37.858 0.746 2.209 1.00 0.00 C ATOM 1919 CD ARG A1022 -37.027 1.828 2.880 1.00 0.00 C ATOM 1920 NE ARG A1022 -37.857 2.918 3.385 1.00 0.00 N ATOM 1921 CZ ARG A1022 -37.373 3.974 4.032 1.00 0.00 C ATOM 1922 NH1 ARG A1022 -36.071 4.080 4.256 1.00 0.00 N ATOM 1923 NH2 ARG A1022 -38.193 4.927 4.456 1.00 0.00 N ATOM 0 H ARG A1022 -34.868 0.665 2.400 1.00 0.00 H new ATOM 0 HA ARG A1022 -35.514 -0.939 0.272 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -37.646 -1.172 1.282 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -36.524 -0.883 2.596 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -38.393 1.173 1.361 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -38.610 0.380 2.908 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -36.460 1.392 3.703 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -36.303 2.223 2.168 1.00 0.00 H new ATOM 0 HE ARG A1022 -38.864 2.866 3.233 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -35.437 3.350 3.932 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -35.703 4.892 4.753 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -39.196 4.850 4.286 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -37.821 5.737 4.952 1.00 0.00 H new ATOM 1937 N ILE A1023 -36.787 0.182 -1.503 1.00 0.00 N ATOM 1938 CA ILE A1023 -37.351 0.855 -2.654 1.00 0.00 C ATOM 1939 C ILE A1023 -38.839 1.140 -2.453 1.00 0.00 C ATOM 1940 O ILE A1023 -39.595 0.259 -2.044 1.00 0.00 O ATOM 1941 CB ILE A1023 -37.163 0.010 -3.923 1.00 0.00 C ATOM 1942 CG1 ILE A1023 -35.738 -0.545 -3.987 1.00 0.00 C ATOM 1943 CG2 ILE A1023 -37.457 0.855 -5.143 1.00 0.00 C ATOM 1944 CD1 ILE A1023 -35.482 -1.431 -5.188 1.00 0.00 C ATOM 0 H ILE A1023 -36.625 -0.816 -1.639 1.00 0.00 H new ATOM 0 HA ILE A1023 -36.823 1.802 -2.769 1.00 0.00 H new ATOM 0 HB ILE A1023 -37.856 -0.831 -3.898 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -35.034 0.287 -4.004 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -35.538 -1.113 -3.079 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -37.323 0.254 -6.043 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -38.485 1.215 -5.097 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -36.775 1.705 -5.170 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -34.452 -1.786 -5.165 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -36.161 -2.284 -5.162 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -35.649 -0.862 -6.102 1.00 0.00 H new ATOM 1956 N PRO A1024 -39.281 2.378 -2.740 1.00 0.00 N ATOM 1957 CA PRO A1024 -40.687 2.773 -2.590 1.00 0.00 C ATOM 1958 C PRO A1024 -41.627 1.898 -3.414 1.00 0.00 C ATOM 1959 O PRO A1024 -42.725 1.576 -2.914 1.00 0.00 O ATOM 1960 CB PRO A1024 -40.707 4.216 -3.108 1.00 0.00 C ATOM 1961 CG PRO A1024 -39.309 4.690 -2.935 1.00 0.00 C ATOM 1962 CD PRO A1024 -38.455 3.495 -3.233 1.00 0.00 C ATOM 1963 OXT PRO A1024 -41.257 1.543 -4.553 1.00 0.00 O ATOM 0 HA PRO A1024 -41.032 2.669 -1.561 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -41.015 4.259 -4.153 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -41.408 4.831 -2.544 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -39.085 5.514 -3.612 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -39.138 5.055 -1.922 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -38.244 3.403 -4.298 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -37.494 3.546 -2.721 1.00 0.00 H new