USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 976 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1000 SER OG : rot 180:sc=-0.00118 USER MOD Set 1.2: A1001 SER OG : rot -159:sc= 0.116 USER MOD Set 2.1: A 999 HIS : no HD1:sc= -3.09 X(o=-4.9,f=-4.5!) USER MOD Set 2.2: A1015 THR OG1 : rot 100:sc= -1.78! USER MOD Set 3.1: A 978 THR OG1 : rot 180:sc= 0.832 USER MOD Set 3.2: A 984 SER OG : rot 107:sc= 1.12 USER MOD Set 4.1: A 975 HIS : no HD1:sc= -3.17 K(o=-3.8,f=-4.5!) USER MOD Set 4.2: A 987 THR OG1 : rot 180:sc= -0.61 USER MOD Set 5.1: A 937 TYR OH : rot 163:sc= 0.00673 USER MOD Set 5.2: A 962 SER OG : rot 29:sc= 0.55 USER MOD Single : A 901 HIS : no HD1:sc= -0.073 X(o=-0.073,f=-0.006) USER MOD Single : A 903 GLN :FLIP amide:sc= -0.65 F(o=-3.1!,f=-0.65) USER MOD Single : A 907 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 912 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 914 LYS NZ :NH3+ 140:sc= -1.02 (180deg=-3.82!) USER MOD Single : A 915 THR OG1 : rot -170:sc= 0 USER MOD Single : A 916 GLN : amide:sc= -3.47! C(o=-3.5!,f=-3.3!) USER MOD Single : A 917 THR OG1 : rot -170:sc= 2.06 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 -120:sc= -2.83! USER MOD Single : A 927 SER OG : rot 41:sc= -1.11! USER MOD Single : A 929 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 930 TYR OH : rot -179:sc= -2.92 USER MOD Single : A 936 TYR OH : rot 180:sc= 0 USER MOD Single : A 942 SER OG : rot 32:sc= 0.371 USER MOD Single : A 944 THR OG1 : rot 5:sc= 1.14 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+ 166:sc= -0.0292 (180deg=-0.228) USER MOD Single : A 961 LYS NZ :NH3+ 168:sc=-0.00647 (180deg=-0.236) USER MOD Single : A 964 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 965 THR OG1 : rot 180:sc= -0.217 USER MOD Single : A 971 ASN :FLIP amide:sc= -1.9 F(o=-2.8!,f=-1.9) USER MOD Single : A 973 MET CE :methyl -114:sc= -0.984 (180deg=-1.91) USER MOD Single : A 981 GLN : amide:sc= -5.65! C(o=-5.6!,f=-11!) USER MOD Single : A 988 TYR OH : rot 90:sc= -1.11 USER MOD Single : A 989 SER OG : rot 180:sc= 0 USER MOD Single : A 991 THR OG1 : rot 180:sc= -0.111 USER MOD Single : A 992 THR OG1 : rot 180:sc= 0 USER MOD Single : A 994 HIS : no HD1:sc= -1.5 K(o=-1.5,f=-2.6!) USER MOD Single : A1007 SER OG : rot -72:sc= 0.142 USER MOD Single : A1009 ASN : amide:sc= -1.24 K(o=-1.2,f=-3.3!) USER MOD Single : A1010 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 HIS : no HE2:sc= -5.62! C(o=-5.6!,f=-9.4!) USER MOD Single : A1014 SER OG : rot 71:sc= 1.22 USER MOD Single : A1016 LYS NZ :NH3+ -166:sc= -0.0268 (180deg=-0.304) USER MOD Single : A1021 GLN :FLIP amide:sc= 0 F(o=-2.3!,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 897 42.025 -10.421 -3.947 1.00 0.00 N ATOM 2 CA GLU A 897 41.459 -10.516 -2.576 1.00 0.00 C ATOM 3 C GLU A 897 41.422 -9.149 -1.902 1.00 0.00 C ATOM 4 O GLU A 897 40.406 -8.757 -1.327 1.00 0.00 O ATOM 5 CB GLU A 897 42.319 -11.486 -1.763 1.00 0.00 C ATOM 6 CG GLU A 897 41.848 -11.671 -0.329 1.00 0.00 C ATOM 7 CD GLU A 897 40.474 -12.309 -0.235 1.00 0.00 C ATOM 8 OE1 GLU A 897 39.900 -12.648 -1.291 1.00 0.00 O ATOM 9 OE2 GLU A 897 39.974 -12.473 0.897 1.00 0.00 O ATOM 0 HA GLU A 897 40.433 -10.881 -2.633 1.00 0.00 H new ATOM 0 HB2 GLU A 897 42.326 -12.456 -2.261 1.00 0.00 H new ATOM 0 HB3 GLU A 897 43.347 -11.125 -1.754 1.00 0.00 H new ATOM 0 HG2 GLU A 897 42.568 -12.290 0.207 1.00 0.00 H new ATOM 0 HG3 GLU A 897 41.828 -10.702 0.169 1.00 0.00 H new ATOM 18 N ALA A 898 42.537 -8.429 -1.975 1.00 0.00 N ATOM 19 CA ALA A 898 42.634 -7.105 -1.373 1.00 0.00 C ATOM 20 C ALA A 898 41.713 -6.111 -2.072 1.00 0.00 C ATOM 21 O ALA A 898 41.649 -6.069 -3.300 1.00 0.00 O ATOM 22 CB ALA A 898 44.073 -6.612 -1.415 1.00 0.00 C ATOM 0 H ALA A 898 43.386 -8.741 -2.446 1.00 0.00 H new ATOM 0 HA ALA A 898 42.316 -7.183 -0.333 1.00 0.00 H new ATOM 0 HB1 ALA A 898 44.132 -5.622 -0.962 1.00 0.00 H new ATOM 0 HB2 ALA A 898 44.710 -7.302 -0.862 1.00 0.00 H new ATOM 0 HB3 ALA A 898 44.409 -6.558 -2.451 1.00 0.00 H new ATOM 28 N GLU A 899 41.004 -5.311 -1.276 1.00 0.00 N ATOM 29 CA GLU A 899 40.083 -4.307 -1.804 1.00 0.00 C ATOM 30 C GLU A 899 38.920 -4.958 -2.551 1.00 0.00 C ATOM 31 O GLU A 899 39.095 -5.952 -3.256 1.00 0.00 O ATOM 32 CB GLU A 899 40.822 -3.337 -2.730 1.00 0.00 C ATOM 33 CG GLU A 899 39.935 -2.240 -3.297 1.00 0.00 C ATOM 34 CD GLU A 899 40.692 -1.289 -4.204 1.00 0.00 C ATOM 35 OE1 GLU A 899 41.244 -1.754 -5.223 1.00 0.00 O ATOM 36 OE2 GLU A 899 40.733 -0.080 -3.895 1.00 0.00 O ATOM 0 H GLU A 899 41.051 -5.340 -0.258 1.00 0.00 H new ATOM 0 HA GLU A 899 39.677 -3.753 -0.958 1.00 0.00 H new ATOM 0 HB2 GLU A 899 41.645 -2.879 -2.181 1.00 0.00 H new ATOM 0 HB3 GLU A 899 41.262 -3.899 -3.554 1.00 0.00 H new ATOM 0 HG2 GLU A 899 39.115 -2.693 -3.854 1.00 0.00 H new ATOM 0 HG3 GLU A 899 39.490 -1.677 -2.476 1.00 0.00 H new ATOM 43 N ALA A 900 37.731 -4.386 -2.389 1.00 0.00 N ATOM 44 CA ALA A 900 36.534 -4.902 -3.044 1.00 0.00 C ATOM 45 C ALA A 900 35.403 -3.882 -2.995 1.00 0.00 C ATOM 46 O ALA A 900 35.050 -3.380 -1.928 1.00 0.00 O ATOM 47 CB ALA A 900 36.099 -6.209 -2.396 1.00 0.00 C ATOM 0 H ALA A 900 37.571 -3.563 -1.808 1.00 0.00 H new ATOM 0 HA ALA A 900 36.773 -5.092 -4.090 1.00 0.00 H new ATOM 0 HB1 ALA A 900 35.205 -6.582 -2.895 1.00 0.00 H new ATOM 0 HB2 ALA A 900 36.899 -6.944 -2.487 1.00 0.00 H new ATOM 0 HB3 ALA A 900 35.882 -6.038 -1.342 1.00 0.00 H new ATOM 53 N HIS A 901 34.835 -3.586 -4.160 1.00 0.00 N ATOM 54 CA HIS A 901 33.739 -2.631 -4.261 1.00 0.00 C ATOM 55 C HIS A 901 32.495 -3.291 -4.835 1.00 0.00 C ATOM 56 O HIS A 901 32.523 -3.841 -5.936 1.00 0.00 O ATOM 57 CB HIS A 901 34.146 -1.444 -5.140 1.00 0.00 C ATOM 58 CG HIS A 901 35.028 -0.454 -4.447 1.00 0.00 C ATOM 59 ND1 HIS A 901 35.720 0.538 -5.112 1.00 0.00 N ATOM 60 CD2 HIS A 901 35.311 -0.290 -3.135 1.00 0.00 C ATOM 61 CE1 HIS A 901 36.392 1.265 -4.239 1.00 0.00 C ATOM 62 NE2 HIS A 901 36.161 0.784 -3.032 1.00 0.00 N ATOM 0 H HIS A 901 35.118 -3.996 -5.050 1.00 0.00 H new ATOM 0 HA HIS A 901 33.512 -2.273 -3.257 1.00 0.00 H new ATOM 0 HB2 HIS A 901 34.661 -1.819 -6.025 1.00 0.00 H new ATOM 0 HB3 HIS A 901 33.246 -0.935 -5.486 1.00 0.00 H new ATOM 0 HD2 HIS A 901 34.938 -0.892 -2.319 1.00 0.00 H new ATOM 0 HE1 HIS A 901 37.023 2.110 -4.473 1.00 0.00 H new ATOM 0 HE2 HIS A 901 36.551 1.150 -2.163 1.00 0.00 H new ATOM 71 N CYS A 902 31.399 -3.223 -4.089 1.00 0.00 N ATOM 72 CA CYS A 902 30.143 -3.806 -4.534 1.00 0.00 C ATOM 73 C CYS A 902 29.423 -2.862 -5.480 1.00 0.00 C ATOM 74 O CYS A 902 29.204 -1.692 -5.162 1.00 0.00 O ATOM 75 CB CYS A 902 29.249 -4.132 -3.341 1.00 0.00 C ATOM 76 SG CYS A 902 29.118 -2.783 -2.130 1.00 0.00 S ATOM 0 H CYS A 902 31.356 -2.771 -3.176 1.00 0.00 H new ATOM 0 HA CYS A 902 30.368 -4.731 -5.065 1.00 0.00 H new ATOM 0 HB2 CYS A 902 28.251 -4.380 -3.704 1.00 0.00 H new ATOM 0 HB3 CYS A 902 29.636 -5.020 -2.841 1.00 0.00 H new ATOM 81 N GLN A 903 29.060 -3.379 -6.643 1.00 0.00 N ATOM 82 CA GLN A 903 28.364 -2.582 -7.644 1.00 0.00 C ATOM 83 C GLN A 903 27.064 -2.020 -7.090 1.00 0.00 C ATOM 84 O GLN A 903 26.615 -2.401 -6.006 1.00 0.00 O ATOM 85 CB GLN A 903 28.070 -3.409 -8.896 1.00 0.00 C ATOM 86 CG GLN A 903 29.310 -3.988 -9.557 1.00 0.00 C ATOM 87 CD GLN A 903 30.251 -2.930 -10.111 1.00 0.00 C ATOM 88 OE1 GLN A 903 29.837 -1.667 -10.064 1.00 0.00 O flip ATOM 89 NE2 GLN A 903 31.339 -3.248 -10.590 1.00 0.00 N flip ATOM 0 H GLN A 903 29.235 -4.346 -6.918 1.00 0.00 H new ATOM 0 HA GLN A 903 29.020 -1.754 -7.912 1.00 0.00 H new ATOM 0 HB2 GLN A 903 27.397 -4.225 -8.631 1.00 0.00 H new ATOM 0 HB3 GLN A 903 27.544 -2.784 -9.617 1.00 0.00 H new ATOM 0 HG2 GLN A 903 29.848 -4.598 -8.831 1.00 0.00 H new ATOM 0 HG3 GLN A 903 29.005 -4.651 -10.366 1.00 0.00 H new ATOM 0 HE21 GLN A 903 31.621 -4.228 -10.608 1.00 0.00 H new ATOM 0 HE22 GLN A 903 31.958 -2.532 -10.969 1.00 0.00 H new ATOM 98 N ALA A 904 26.471 -1.112 -7.852 1.00 0.00 N ATOM 99 CA ALA A 904 25.219 -0.475 -7.469 1.00 0.00 C ATOM 100 C ALA A 904 24.204 -1.497 -6.959 1.00 0.00 C ATOM 101 O ALA A 904 24.032 -2.560 -7.555 1.00 0.00 O ATOM 102 CB ALA A 904 24.651 0.288 -8.655 1.00 0.00 C ATOM 0 H ALA A 904 26.842 -0.797 -8.749 1.00 0.00 H new ATOM 0 HA ALA A 904 25.423 0.219 -6.654 1.00 0.00 H new ATOM 0 HB1 ALA A 904 23.714 0.764 -8.366 1.00 0.00 H new ATOM 0 HB2 ALA A 904 25.363 1.050 -8.972 1.00 0.00 H new ATOM 0 HB3 ALA A 904 24.469 -0.403 -9.478 1.00 0.00 H new ATOM 108 N PRO A 905 23.516 -1.183 -5.847 1.00 0.00 N ATOM 109 CA PRO A 905 22.511 -2.066 -5.254 1.00 0.00 C ATOM 110 C PRO A 905 21.215 -2.074 -6.058 1.00 0.00 C ATOM 111 O PRO A 905 20.162 -1.685 -5.551 1.00 0.00 O ATOM 112 CB PRO A 905 22.267 -1.474 -3.856 1.00 0.00 C ATOM 113 CG PRO A 905 23.253 -0.359 -3.697 1.00 0.00 C ATOM 114 CD PRO A 905 23.655 0.059 -5.080 1.00 0.00 C ATOM 0 HA PRO A 905 22.850 -3.102 -5.230 1.00 0.00 H new ATOM 0 HB2 PRO A 905 21.245 -1.106 -3.762 1.00 0.00 H new ATOM 0 HB3 PRO A 905 22.406 -2.230 -3.083 1.00 0.00 H new ATOM 0 HG2 PRO A 905 22.810 0.475 -3.154 1.00 0.00 H new ATOM 0 HG3 PRO A 905 24.120 -0.688 -3.124 1.00 0.00 H new ATOM 0 HD2 PRO A 905 23.011 0.848 -5.468 1.00 0.00 H new ATOM 0 HD3 PRO A 905 24.676 0.439 -5.107 1.00 0.00 H new ATOM 122 N ASP A 906 21.303 -2.514 -7.312 1.00 0.00 N ATOM 123 CA ASP A 906 20.145 -2.563 -8.195 1.00 0.00 C ATOM 124 C ASP A 906 19.299 -1.305 -8.025 1.00 0.00 C ATOM 125 O ASP A 906 19.834 -0.214 -7.829 1.00 0.00 O ATOM 126 CB ASP A 906 19.330 -3.822 -7.893 1.00 0.00 C ATOM 127 CG ASP A 906 18.285 -4.124 -8.952 1.00 0.00 C ATOM 128 OD1 ASP A 906 18.217 -3.376 -9.952 1.00 0.00 O ATOM 129 OD2 ASP A 906 17.538 -5.110 -8.784 1.00 0.00 O ATOM 0 H ASP A 906 22.169 -2.842 -7.738 1.00 0.00 H new ATOM 0 HA ASP A 906 20.477 -2.603 -9.233 1.00 0.00 H new ATOM 0 HB2 ASP A 906 20.006 -4.673 -7.805 1.00 0.00 H new ATOM 0 HB3 ASP A 906 18.837 -3.706 -6.928 1.00 0.00 H new ATOM 134 N HIS A 907 17.988 -1.456 -8.097 1.00 0.00 N ATOM 135 CA HIS A 907 17.086 -0.322 -7.943 1.00 0.00 C ATOM 136 C HIS A 907 15.674 -0.789 -7.620 1.00 0.00 C ATOM 137 O HIS A 907 15.032 -1.459 -8.430 1.00 0.00 O ATOM 138 CB HIS A 907 17.071 0.518 -9.223 1.00 0.00 C ATOM 139 CG HIS A 907 16.367 1.831 -9.071 1.00 0.00 C ATOM 140 ND1 HIS A 907 16.770 2.801 -8.176 1.00 0.00 N ATOM 141 CD2 HIS A 907 15.285 2.336 -9.709 1.00 0.00 C ATOM 142 CE1 HIS A 907 15.966 3.845 -8.270 1.00 0.00 C ATOM 143 NE2 HIS A 907 15.057 3.588 -9.193 1.00 0.00 N ATOM 0 H HIS A 907 17.523 -2.349 -8.261 1.00 0.00 H new ATOM 0 HA HIS A 907 17.448 0.287 -7.115 1.00 0.00 H new ATOM 0 HB2 HIS A 907 18.098 0.701 -9.540 1.00 0.00 H new ATOM 0 HB3 HIS A 907 16.589 -0.053 -10.017 1.00 0.00 H new ATOM 0 HD2 HIS A 907 14.709 1.846 -10.480 1.00 0.00 H new ATOM 0 HE1 HIS A 907 16.039 4.754 -7.691 1.00 0.00 H new ATOM 0 HE2 HIS A 907 14.307 4.218 -9.477 1.00 0.00 H new ATOM 152 N PHE A 908 15.188 -0.423 -6.439 1.00 0.00 N ATOM 153 CA PHE A 908 13.845 -0.800 -6.025 1.00 0.00 C ATOM 154 C PHE A 908 12.822 0.200 -6.538 1.00 0.00 C ATOM 155 O PHE A 908 13.026 1.412 -6.465 1.00 0.00 O ATOM 156 CB PHE A 908 13.751 -0.925 -4.507 1.00 0.00 C ATOM 157 CG PHE A 908 14.531 -2.085 -3.962 1.00 0.00 C ATOM 158 CD1 PHE A 908 15.899 -1.991 -3.771 1.00 0.00 C ATOM 159 CD2 PHE A 908 13.889 -3.268 -3.635 1.00 0.00 C ATOM 160 CE1 PHE A 908 16.616 -3.059 -3.266 1.00 0.00 C ATOM 161 CE2 PHE A 908 14.601 -4.339 -3.129 1.00 0.00 C ATOM 162 CZ PHE A 908 15.966 -4.234 -2.944 1.00 0.00 C ATOM 0 H PHE A 908 15.703 0.132 -5.755 1.00 0.00 H new ATOM 0 HA PHE A 908 13.625 -1.775 -6.460 1.00 0.00 H new ATOM 0 HB2 PHE A 908 14.113 -0.004 -4.050 1.00 0.00 H new ATOM 0 HB3 PHE A 908 12.705 -1.032 -4.221 1.00 0.00 H new ATOM 0 HD1 PHE A 908 16.411 -1.073 -4.019 1.00 0.00 H new ATOM 0 HD2 PHE A 908 12.822 -3.354 -3.777 1.00 0.00 H new ATOM 0 HE1 PHE A 908 17.683 -2.975 -3.123 1.00 0.00 H new ATOM 0 HE2 PHE A 908 14.091 -5.257 -2.878 1.00 0.00 H new ATOM 0 HZ PHE A 908 16.524 -5.070 -2.548 1.00 0.00 H new ATOM 172 N LEU A 909 11.727 -0.321 -7.067 1.00 0.00 N ATOM 173 CA LEU A 909 10.666 0.510 -7.613 1.00 0.00 C ATOM 174 C LEU A 909 9.843 1.161 -6.512 1.00 0.00 C ATOM 175 O LEU A 909 9.582 2.361 -6.552 1.00 0.00 O ATOM 176 CB LEU A 909 9.758 -0.322 -8.512 1.00 0.00 C ATOM 177 CG LEU A 909 10.403 -0.829 -9.802 1.00 0.00 C ATOM 178 CD1 LEU A 909 11.597 -1.726 -9.508 1.00 0.00 C ATOM 179 CD2 LEU A 909 9.378 -1.575 -10.629 1.00 0.00 C ATOM 0 H LEU A 909 11.549 -1.323 -7.130 1.00 0.00 H new ATOM 0 HA LEU A 909 11.133 1.302 -8.199 1.00 0.00 H new ATOM 0 HB2 LEU A 909 9.398 -1.180 -7.944 1.00 0.00 H new ATOM 0 HB3 LEU A 909 8.885 0.276 -8.773 1.00 0.00 H new ATOM 0 HG LEU A 909 10.764 0.032 -10.365 1.00 0.00 H new ATOM 0 HD11 LEU A 909 12.033 -2.070 -10.446 1.00 0.00 H new ATOM 0 HD12 LEU A 909 12.343 -1.166 -8.945 1.00 0.00 H new ATOM 0 HD13 LEU A 909 11.271 -2.586 -8.923 1.00 0.00 H new ATOM 0 HD21 LEU A 909 9.843 -1.934 -11.547 1.00 0.00 H new ATOM 0 HD22 LEU A 909 8.998 -2.423 -10.059 1.00 0.00 H new ATOM 0 HD23 LEU A 909 8.554 -0.906 -10.877 1.00 0.00 H new ATOM 191 N PHE A 910 9.424 0.366 -5.534 1.00 0.00 N ATOM 192 CA PHE A 910 8.619 0.880 -4.434 1.00 0.00 C ATOM 193 C PHE A 910 9.489 1.457 -3.323 1.00 0.00 C ATOM 194 O PHE A 910 9.027 1.640 -2.197 1.00 0.00 O ATOM 195 CB PHE A 910 7.709 -0.224 -3.881 1.00 0.00 C ATOM 196 CG PHE A 910 8.420 -1.510 -3.549 1.00 0.00 C ATOM 197 CD1 PHE A 910 9.543 -1.521 -2.735 1.00 0.00 C ATOM 198 CD2 PHE A 910 7.954 -2.716 -4.050 1.00 0.00 C ATOM 199 CE1 PHE A 910 10.187 -2.705 -2.431 1.00 0.00 C ATOM 200 CE2 PHE A 910 8.594 -3.904 -3.749 1.00 0.00 C ATOM 201 CZ PHE A 910 9.712 -3.897 -2.938 1.00 0.00 C ATOM 0 H PHE A 910 9.627 -0.632 -5.481 1.00 0.00 H new ATOM 0 HA PHE A 910 8.001 1.689 -4.824 1.00 0.00 H new ATOM 0 HB2 PHE A 910 7.215 0.146 -2.983 1.00 0.00 H new ATOM 0 HB3 PHE A 910 6.928 -0.433 -4.611 1.00 0.00 H new ATOM 0 HD1 PHE A 910 9.919 -0.592 -2.333 1.00 0.00 H new ATOM 0 HD2 PHE A 910 7.080 -2.728 -4.684 1.00 0.00 H new ATOM 0 HE1 PHE A 910 11.061 -2.697 -1.797 1.00 0.00 H new ATOM 0 HE2 PHE A 910 8.220 -4.836 -4.147 1.00 0.00 H new ATOM 0 HZ PHE A 910 10.214 -4.824 -2.701 1.00 0.00 H new ATOM 211 N ALA A 911 10.747 1.746 -3.643 1.00 0.00 N ATOM 212 CA ALA A 911 11.662 2.306 -2.657 1.00 0.00 C ATOM 213 C ALA A 911 12.816 3.053 -3.316 1.00 0.00 C ATOM 214 O ALA A 911 13.578 2.479 -4.093 1.00 0.00 O ATOM 215 CB ALA A 911 12.195 1.205 -1.753 1.00 0.00 C ATOM 0 H ALA A 911 11.152 1.603 -4.568 1.00 0.00 H new ATOM 0 HA ALA A 911 11.104 3.026 -2.058 1.00 0.00 H new ATOM 0 HB1 ALA A 911 12.878 1.635 -1.020 1.00 0.00 H new ATOM 0 HB2 ALA A 911 11.364 0.724 -1.237 1.00 0.00 H new ATOM 0 HB3 ALA A 911 12.726 0.466 -2.354 1.00 0.00 H new ATOM 221 N LYS A 912 12.951 4.333 -2.982 1.00 0.00 N ATOM 222 CA LYS A 912 14.025 5.155 -3.522 1.00 0.00 C ATOM 223 C LYS A 912 15.126 5.333 -2.482 1.00 0.00 C ATOM 224 O LYS A 912 14.856 5.703 -1.339 1.00 0.00 O ATOM 225 CB LYS A 912 13.488 6.519 -3.962 1.00 0.00 C ATOM 226 CG LYS A 912 12.773 7.281 -2.858 1.00 0.00 C ATOM 227 CD LYS A 912 12.259 8.624 -3.351 1.00 0.00 C ATOM 228 CE LYS A 912 11.517 9.374 -2.256 1.00 0.00 C ATOM 229 NZ LYS A 912 11.014 10.693 -2.726 1.00 0.00 N ATOM 0 H LYS A 912 12.328 4.822 -2.339 1.00 0.00 H new ATOM 0 HA LYS A 912 14.442 4.650 -4.393 1.00 0.00 H new ATOM 0 HB2 LYS A 912 14.317 7.124 -4.331 1.00 0.00 H new ATOM 0 HB3 LYS A 912 12.801 6.377 -4.796 1.00 0.00 H new ATOM 0 HG2 LYS A 912 11.940 6.686 -2.485 1.00 0.00 H new ATOM 0 HG3 LYS A 912 13.454 7.436 -2.021 1.00 0.00 H new ATOM 0 HD2 LYS A 912 13.095 9.227 -3.704 1.00 0.00 H new ATOM 0 HD3 LYS A 912 11.595 8.470 -4.202 1.00 0.00 H new ATOM 0 HE2 LYS A 912 10.679 8.770 -1.907 1.00 0.00 H new ATOM 0 HE3 LYS A 912 12.181 9.522 -1.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 912 10.515 11.171 -1.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 912 11.815 11.280 -3.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 912 10.360 10.552 -3.522 1.00 0.00 H new ATOM 243 N LEU A 913 16.366 5.058 -2.879 1.00 0.00 N ATOM 244 CA LEU A 913 17.504 5.181 -1.973 1.00 0.00 C ATOM 245 C LEU A 913 17.472 6.526 -1.249 1.00 0.00 C ATOM 246 O LEU A 913 17.405 7.578 -1.884 1.00 0.00 O ATOM 247 CB LEU A 913 18.815 5.035 -2.748 1.00 0.00 C ATOM 248 CG LEU A 913 19.945 4.332 -1.993 1.00 0.00 C ATOM 249 CD1 LEU A 913 21.217 4.338 -2.824 1.00 0.00 C ATOM 250 CD2 LEU A 913 20.188 4.984 -0.641 1.00 0.00 C ATOM 0 H LEU A 913 16.608 4.749 -3.821 1.00 0.00 H new ATOM 0 HA LEU A 913 17.440 4.385 -1.231 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.616 4.483 -3.667 1.00 0.00 H new ATOM 0 HB3 LEU A 913 19.158 6.028 -3.040 1.00 0.00 H new ATOM 0 HG LEU A 913 19.646 3.299 -1.818 1.00 0.00 H new ATOM 0 HD11 LEU A 913 22.013 3.835 -2.275 1.00 0.00 H new ATOM 0 HD12 LEU A 913 21.039 3.817 -3.765 1.00 0.00 H new ATOM 0 HD13 LEU A 913 21.513 5.367 -3.029 1.00 0.00 H new ATOM 0 HD21 LEU A 913 20.996 4.464 -0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 913 20.463 6.029 -0.785 1.00 0.00 H new ATOM 0 HD23 LEU A 913 19.280 4.927 -0.041 1.00 0.00 H new ATOM 262 N LYS A 914 17.513 6.486 0.079 1.00 0.00 N ATOM 263 CA LYS A 914 17.482 7.708 0.879 1.00 0.00 C ATOM 264 C LYS A 914 18.889 8.180 1.237 1.00 0.00 C ATOM 265 O LYS A 914 19.132 9.377 1.387 1.00 0.00 O ATOM 266 CB LYS A 914 16.664 7.489 2.152 1.00 0.00 C ATOM 267 CG LYS A 914 16.408 8.768 2.934 1.00 0.00 C ATOM 268 CD LYS A 914 15.580 8.510 4.179 1.00 0.00 C ATOM 269 CE LYS A 914 16.350 7.686 5.196 1.00 0.00 C ATOM 270 NZ LYS A 914 17.609 8.360 5.619 1.00 0.00 N ATOM 0 H LYS A 914 17.568 5.625 0.623 1.00 0.00 H new ATOM 0 HA LYS A 914 17.010 8.485 0.277 1.00 0.00 H new ATOM 0 HB2 LYS A 914 15.708 7.037 1.887 1.00 0.00 H new ATOM 0 HB3 LYS A 914 17.186 6.779 2.793 1.00 0.00 H new ATOM 0 HG2 LYS A 914 17.360 9.218 3.217 1.00 0.00 H new ATOM 0 HG3 LYS A 914 15.893 9.487 2.297 1.00 0.00 H new ATOM 0 HD2 LYS A 914 15.286 9.460 4.626 1.00 0.00 H new ATOM 0 HD3 LYS A 914 14.662 7.989 3.906 1.00 0.00 H new ATOM 0 HE2 LYS A 914 15.722 7.508 6.069 1.00 0.00 H new ATOM 0 HE3 LYS A 914 16.586 6.711 4.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 914 17.747 8.228 6.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 914 18.413 7.947 5.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 914 17.547 9.376 5.407 1.00 0.00 H new ATOM 284 N THR A 915 19.808 7.231 1.391 1.00 0.00 N ATOM 285 CA THR A 915 21.187 7.549 1.753 1.00 0.00 C ATOM 286 C THR A 915 21.869 8.408 0.689 1.00 0.00 C ATOM 287 O THR A 915 21.745 8.155 -0.509 1.00 0.00 O ATOM 288 CB THR A 915 22.018 6.271 1.974 1.00 0.00 C ATOM 289 OG1 THR A 915 21.409 5.462 2.988 1.00 0.00 O ATOM 290 CG2 THR A 915 23.443 6.612 2.382 1.00 0.00 C ATOM 0 H THR A 915 19.623 6.235 1.271 1.00 0.00 H new ATOM 0 HA THR A 915 21.138 8.113 2.684 1.00 0.00 H new ATOM 0 HB THR A 915 22.049 5.719 1.035 1.00 0.00 H new ATOM 0 HG1 THR A 915 22.018 4.735 3.236 1.00 0.00 H new ATOM 0 HG21 THR A 915 24.009 5.692 2.532 1.00 0.00 H new ATOM 0 HG22 THR A 915 23.914 7.204 1.597 1.00 0.00 H new ATOM 0 HG23 THR A 915 23.429 7.184 3.310 1.00 0.00 H new ATOM 298 N GLN A 916 22.585 9.428 1.153 1.00 0.00 N ATOM 299 CA GLN A 916 23.297 10.351 0.274 1.00 0.00 C ATOM 300 C GLN A 916 24.606 9.746 -0.240 1.00 0.00 C ATOM 301 O GLN A 916 25.689 10.274 0.015 1.00 0.00 O ATOM 302 CB GLN A 916 23.582 11.665 1.007 1.00 0.00 C ATOM 303 CG GLN A 916 24.462 11.506 2.238 1.00 0.00 C ATOM 304 CD GLN A 916 23.781 10.751 3.364 1.00 0.00 C ATOM 305 OE1 GLN A 916 22.770 11.199 3.903 1.00 0.00 O ATOM 306 NE2 GLN A 916 24.330 9.593 3.720 1.00 0.00 N ATOM 0 H GLN A 916 22.688 9.638 2.146 1.00 0.00 H new ATOM 0 HA GLN A 916 22.658 10.547 -0.587 1.00 0.00 H new ATOM 0 HB2 GLN A 916 24.062 12.358 0.316 1.00 0.00 H new ATOM 0 HB3 GLN A 916 22.636 12.116 1.305 1.00 0.00 H new ATOM 0 HG2 GLN A 916 25.376 10.982 1.958 1.00 0.00 H new ATOM 0 HG3 GLN A 916 24.757 12.492 2.596 1.00 0.00 H new ATOM 0 HE21 GLN A 916 25.169 9.259 3.246 1.00 0.00 H new ATOM 0 HE22 GLN A 916 23.912 9.039 4.467 1.00 0.00 H new ATOM 315 N THR A 917 24.505 8.640 -0.967 1.00 0.00 N ATOM 316 CA THR A 917 25.690 7.979 -1.504 1.00 0.00 C ATOM 317 C THR A 917 26.187 8.658 -2.778 1.00 0.00 C ATOM 318 O THR A 917 27.360 9.023 -2.875 1.00 0.00 O ATOM 319 CB THR A 917 25.419 6.492 -1.795 1.00 0.00 C ATOM 320 OG1 THR A 917 26.545 5.914 -2.467 1.00 0.00 O ATOM 321 CG2 THR A 917 24.167 6.324 -2.643 1.00 0.00 C ATOM 0 H THR A 917 23.622 8.184 -1.198 1.00 0.00 H new ATOM 0 HA THR A 917 26.463 8.059 -0.739 1.00 0.00 H new ATOM 0 HB THR A 917 25.262 5.979 -0.846 1.00 0.00 H new ATOM 0 HG1 THR A 917 26.308 5.020 -2.792 1.00 0.00 H new ATOM 0 HG21 THR A 917 23.997 5.265 -2.835 1.00 0.00 H new ATOM 0 HG22 THR A 917 23.310 6.739 -2.113 1.00 0.00 H new ATOM 0 HG23 THR A 917 24.296 6.848 -3.590 1.00 0.00 H new ATOM 329 N THR A 918 25.294 8.829 -3.752 1.00 0.00 N ATOM 330 CA THR A 918 25.651 9.468 -5.016 1.00 0.00 C ATOM 331 C THR A 918 26.889 8.811 -5.630 1.00 0.00 C ATOM 332 O THR A 918 27.886 9.478 -5.914 1.00 0.00 O ATOM 333 CB THR A 918 25.908 10.977 -4.827 1.00 0.00 C ATOM 334 OG1 THR A 918 24.809 11.575 -4.129 1.00 0.00 O ATOM 335 CG2 THR A 918 26.088 11.673 -6.169 1.00 0.00 C ATOM 0 H THR A 918 24.320 8.534 -3.689 1.00 0.00 H new ATOM 0 HA THR A 918 24.807 9.339 -5.693 1.00 0.00 H new ATOM 0 HB THR A 918 26.823 11.094 -4.247 1.00 0.00 H new ATOM 0 HG1 THR A 918 24.979 12.533 -4.011 1.00 0.00 H new ATOM 0 HG21 THR A 918 26.268 12.736 -6.006 1.00 0.00 H new ATOM 0 HG22 THR A 918 26.938 11.237 -6.694 1.00 0.00 H new ATOM 0 HG23 THR A 918 25.187 11.545 -6.769 1.00 0.00 H new ATOM 343 N ALA A 919 26.824 7.496 -5.819 1.00 0.00 N ATOM 344 CA ALA A 919 27.942 6.747 -6.386 1.00 0.00 C ATOM 345 C ALA A 919 27.517 5.338 -6.787 1.00 0.00 C ATOM 346 O ALA A 919 26.553 4.795 -6.250 1.00 0.00 O ATOM 347 CB ALA A 919 29.088 6.689 -5.391 1.00 0.00 C ATOM 0 H ALA A 919 26.010 6.927 -5.588 1.00 0.00 H new ATOM 0 HA ALA A 919 28.276 7.264 -7.285 1.00 0.00 H new ATOM 0 HB1 ALA A 919 29.917 6.128 -5.823 1.00 0.00 H new ATOM 0 HB2 ALA A 919 29.418 7.701 -5.156 1.00 0.00 H new ATOM 0 HB3 ALA A 919 28.753 6.196 -4.479 1.00 0.00 H new ATOM 353 N SER A 920 28.243 4.753 -7.737 1.00 0.00 N ATOM 354 CA SER A 920 27.940 3.406 -8.211 1.00 0.00 C ATOM 355 C SER A 920 28.623 2.353 -7.341 1.00 0.00 C ATOM 356 O SER A 920 28.007 1.359 -6.958 1.00 0.00 O ATOM 357 CB SER A 920 28.377 3.245 -9.662 1.00 0.00 C ATOM 358 OG SER A 920 28.100 1.939 -10.139 1.00 0.00 O ATOM 0 H SER A 920 29.044 5.190 -8.193 1.00 0.00 H new ATOM 0 HA SER A 920 26.862 3.260 -8.145 1.00 0.00 H new ATOM 0 HB2 SER A 920 27.863 3.978 -10.283 1.00 0.00 H new ATOM 0 HB3 SER A 920 29.445 3.447 -9.748 1.00 0.00 H new ATOM 0 HG SER A 920 28.389 1.864 -11.072 1.00 0.00 H new ATOM 364 N ASP A 921 29.894 2.583 -7.027 1.00 0.00 N ATOM 365 CA ASP A 921 30.658 1.660 -6.193 1.00 0.00 C ATOM 366 C ASP A 921 30.408 1.942 -4.717 1.00 0.00 C ATOM 367 O ASP A 921 30.333 3.098 -4.302 1.00 0.00 O ATOM 368 CB ASP A 921 32.152 1.768 -6.510 1.00 0.00 C ATOM 369 CG ASP A 921 32.683 3.181 -6.354 1.00 0.00 C ATOM 370 OD1 ASP A 921 32.644 3.710 -5.223 1.00 0.00 O ATOM 371 OD2 ASP A 921 33.140 3.757 -7.363 1.00 0.00 O ATOM 0 H ASP A 921 30.418 3.401 -7.338 1.00 0.00 H new ATOM 0 HA ASP A 921 30.328 0.644 -6.411 1.00 0.00 H new ATOM 0 HB2 ASP A 921 32.708 1.101 -5.852 1.00 0.00 H new ATOM 0 HB3 ASP A 921 32.328 1.429 -7.531 1.00 0.00 H new ATOM 376 N PHE A 922 30.268 0.883 -3.926 1.00 0.00 N ATOM 377 CA PHE A 922 30.017 1.035 -2.497 1.00 0.00 C ATOM 378 C PHE A 922 31.005 0.234 -1.660 1.00 0.00 C ATOM 379 O PHE A 922 31.311 -0.916 -1.971 1.00 0.00 O ATOM 380 CB PHE A 922 28.596 0.592 -2.140 1.00 0.00 C ATOM 381 CG PHE A 922 27.518 1.493 -2.661 1.00 0.00 C ATOM 382 CD1 PHE A 922 27.275 1.602 -4.020 1.00 0.00 C ATOM 383 CD2 PHE A 922 26.747 2.235 -1.784 1.00 0.00 C ATOM 384 CE1 PHE A 922 26.279 2.433 -4.494 1.00 0.00 C ATOM 385 CE2 PHE A 922 25.751 3.068 -2.251 1.00 0.00 C ATOM 386 CZ PHE A 922 25.516 3.169 -3.608 1.00 0.00 C ATOM 0 H PHE A 922 30.324 -0.083 -4.247 1.00 0.00 H new ATOM 0 HA PHE A 922 30.141 2.094 -2.271 1.00 0.00 H new ATOM 0 HB2 PHE A 922 28.433 -0.413 -2.530 1.00 0.00 H new ATOM 0 HB3 PHE A 922 28.509 0.531 -1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 922 27.871 1.031 -4.717 1.00 0.00 H new ATOM 0 HD2 PHE A 922 26.927 2.161 -0.722 1.00 0.00 H new ATOM 0 HE1 PHE A 922 26.097 2.507 -5.556 1.00 0.00 H new ATOM 0 HE2 PHE A 922 25.155 3.641 -1.556 1.00 0.00 H new ATOM 0 HZ PHE A 922 24.738 3.822 -3.976 1.00 0.00 H new ATOM 396 N PRO A 923 31.499 0.834 -0.564 1.00 0.00 N ATOM 397 CA PRO A 923 32.434 0.168 0.342 1.00 0.00 C ATOM 398 C PRO A 923 31.728 -0.910 1.157 1.00 0.00 C ATOM 399 O PRO A 923 30.655 -0.669 1.712 1.00 0.00 O ATOM 400 CB PRO A 923 32.917 1.300 1.248 1.00 0.00 C ATOM 401 CG PRO A 923 31.797 2.283 1.251 1.00 0.00 C ATOM 402 CD PRO A 923 31.162 2.199 -0.112 1.00 0.00 C ATOM 0 HA PRO A 923 33.246 -0.337 -0.182 1.00 0.00 H new ATOM 0 HB2 PRO A 923 33.130 0.939 2.254 1.00 0.00 H new ATOM 0 HB3 PRO A 923 33.836 1.747 0.868 1.00 0.00 H new ATOM 0 HG2 PRO A 923 31.074 2.048 2.032 1.00 0.00 H new ATOM 0 HG3 PRO A 923 32.163 3.290 1.449 1.00 0.00 H new ATOM 0 HD2 PRO A 923 30.084 2.351 -0.063 1.00 0.00 H new ATOM 0 HD3 PRO A 923 31.560 2.956 -0.788 1.00 0.00 H new ATOM 410 N ILE A 924 32.316 -2.098 1.216 1.00 0.00 N ATOM 411 CA ILE A 924 31.715 -3.200 1.954 1.00 0.00 C ATOM 412 C ILE A 924 31.479 -2.826 3.417 1.00 0.00 C ATOM 413 O ILE A 924 32.212 -2.021 3.990 1.00 0.00 O ATOM 414 CB ILE A 924 32.570 -4.475 1.882 1.00 0.00 C ATOM 415 CG1 ILE A 924 32.900 -4.813 0.426 1.00 0.00 C ATOM 416 CG2 ILE A 924 31.824 -5.625 2.539 1.00 0.00 C ATOM 417 CD1 ILE A 924 33.768 -6.042 0.266 1.00 0.00 C ATOM 0 H ILE A 924 33.203 -2.322 0.765 1.00 0.00 H new ATOM 0 HA ILE A 924 30.755 -3.402 1.479 1.00 0.00 H new ATOM 0 HB ILE A 924 33.507 -4.309 2.414 1.00 0.00 H new ATOM 0 HG12 ILE A 924 31.970 -4.963 -0.122 1.00 0.00 H new ATOM 0 HG13 ILE A 924 33.405 -3.961 -0.030 1.00 0.00 H new ATOM 0 HG21 ILE A 924 32.431 -6.529 2.488 1.00 0.00 H new ATOM 0 HG22 ILE A 924 31.625 -5.381 3.582 1.00 0.00 H new ATOM 0 HG23 ILE A 924 30.881 -5.791 2.019 1.00 0.00 H new ATOM 0 HD11 ILE A 924 33.959 -6.217 -0.793 1.00 0.00 H new ATOM 0 HD12 ILE A 924 34.714 -5.889 0.785 1.00 0.00 H new ATOM 0 HD13 ILE A 924 33.257 -6.906 0.691 1.00 0.00 H new ATOM 429 N GLY A 925 30.435 -3.406 4.005 1.00 0.00 N ATOM 430 CA GLY A 925 30.096 -3.117 5.384 1.00 0.00 C ATOM 431 C GLY A 925 29.107 -1.975 5.489 1.00 0.00 C ATOM 432 O GLY A 925 28.247 -1.960 6.370 1.00 0.00 O ATOM 0 H GLY A 925 29.816 -4.074 3.546 1.00 0.00 H new ATOM 0 HA2 GLY A 925 29.674 -4.008 5.850 1.00 0.00 H new ATOM 0 HA3 GLY A 925 31.001 -2.867 5.937 1.00 0.00 H new ATOM 436 N THR A 926 29.237 -1.019 4.578 1.00 0.00 N ATOM 437 CA THR A 926 28.364 0.146 4.540 1.00 0.00 C ATOM 438 C THR A 926 26.890 -0.238 4.417 1.00 0.00 C ATOM 439 O THR A 926 26.506 -1.011 3.538 1.00 0.00 O ATOM 440 CB THR A 926 28.741 1.069 3.366 1.00 0.00 C ATOM 441 OG1 THR A 926 29.975 1.740 3.647 1.00 0.00 O ATOM 442 CG2 THR A 926 27.649 2.090 3.090 1.00 0.00 C ATOM 0 H THR A 926 29.948 -1.030 3.847 1.00 0.00 H new ATOM 0 HA THR A 926 28.503 0.670 5.486 1.00 0.00 H new ATOM 0 HB THR A 926 28.857 0.450 2.477 1.00 0.00 H new ATOM 0 HG1 THR A 926 29.829 2.709 3.644 1.00 0.00 H new ATOM 0 HG21 THR A 926 27.947 2.725 2.256 1.00 0.00 H new ATOM 0 HG22 THR A 926 26.723 1.573 2.839 1.00 0.00 H new ATOM 0 HG23 THR A 926 27.493 2.705 3.977 1.00 0.00 H new ATOM 450 N SER A 927 26.068 0.338 5.291 1.00 0.00 N ATOM 451 CA SER A 927 24.629 0.099 5.279 1.00 0.00 C ATOM 452 C SER A 927 23.955 1.091 4.337 1.00 0.00 C ATOM 453 O SER A 927 24.467 2.192 4.128 1.00 0.00 O ATOM 454 CB SER A 927 24.051 0.233 6.689 1.00 0.00 C ATOM 455 OG SER A 927 22.654 0.004 6.693 1.00 0.00 O ATOM 0 H SER A 927 26.378 0.978 6.022 1.00 0.00 H new ATOM 0 HA SER A 927 24.442 -0.916 4.928 1.00 0.00 H new ATOM 0 HB2 SER A 927 24.541 -0.478 7.355 1.00 0.00 H new ATOM 0 HB3 SER A 927 24.260 1.230 7.077 1.00 0.00 H new ATOM 0 HG SER A 927 22.444 -0.747 6.099 1.00 0.00 H new ATOM 461 N LEU A 928 22.822 0.709 3.754 1.00 0.00 N ATOM 462 CA LEU A 928 22.129 1.602 2.826 1.00 0.00 C ATOM 463 C LEU A 928 20.612 1.528 3.004 1.00 0.00 C ATOM 464 O LEU A 928 19.968 0.589 2.541 1.00 0.00 O ATOM 465 CB LEU A 928 22.507 1.235 1.389 1.00 0.00 C ATOM 466 CG LEU A 928 22.483 2.390 0.390 1.00 0.00 C ATOM 467 CD1 LEU A 928 23.530 3.431 0.760 1.00 0.00 C ATOM 468 CD2 LEU A 928 22.724 1.874 -1.019 1.00 0.00 C ATOM 0 H LEU A 928 22.370 -0.193 3.902 1.00 0.00 H new ATOM 0 HA LEU A 928 22.438 2.625 3.040 1.00 0.00 H new ATOM 0 HB2 LEU A 928 23.507 0.802 1.394 1.00 0.00 H new ATOM 0 HB3 LEU A 928 21.826 0.460 1.039 1.00 0.00 H new ATOM 0 HG LEU A 928 21.500 2.860 0.424 1.00 0.00 H new ATOM 0 HD11 LEU A 928 23.501 4.248 0.039 1.00 0.00 H new ATOM 0 HD12 LEU A 928 23.321 3.819 1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 928 24.519 2.972 0.749 1.00 0.00 H new ATOM 0 HD21 LEU A 928 22.704 2.708 -1.720 1.00 0.00 H new ATOM 0 HD22 LEU A 928 23.696 1.384 -1.066 1.00 0.00 H new ATOM 0 HD23 LEU A 928 21.944 1.159 -1.283 1.00 0.00 H new ATOM 480 N LYS A 929 20.045 2.526 3.677 1.00 0.00 N ATOM 481 CA LYS A 929 18.602 2.564 3.918 1.00 0.00 C ATOM 482 C LYS A 929 17.843 3.190 2.749 1.00 0.00 C ATOM 483 O LYS A 929 18.210 4.254 2.246 1.00 0.00 O ATOM 484 CB LYS A 929 18.303 3.329 5.209 1.00 0.00 C ATOM 485 CG LYS A 929 18.795 4.767 5.196 1.00 0.00 C ATOM 486 CD LYS A 929 18.574 5.447 6.539 1.00 0.00 C ATOM 487 CE LYS A 929 19.364 4.769 7.648 1.00 0.00 C ATOM 488 NZ LYS A 929 19.159 5.438 8.963 1.00 0.00 N ATOM 0 H LYS A 929 20.559 3.317 4.065 1.00 0.00 H new ATOM 0 HA LYS A 929 18.260 1.534 4.018 1.00 0.00 H new ATOM 0 HB2 LYS A 929 17.227 3.324 5.383 1.00 0.00 H new ATOM 0 HB3 LYS A 929 18.763 2.805 6.046 1.00 0.00 H new ATOM 0 HG2 LYS A 929 19.856 4.787 4.948 1.00 0.00 H new ATOM 0 HG3 LYS A 929 18.275 5.323 4.416 1.00 0.00 H new ATOM 0 HD2 LYS A 929 18.869 6.494 6.470 1.00 0.00 H new ATOM 0 HD3 LYS A 929 17.512 5.430 6.785 1.00 0.00 H new ATOM 0 HE2 LYS A 929 19.063 3.724 7.721 1.00 0.00 H new ATOM 0 HE3 LYS A 929 20.425 4.779 7.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 19.714 4.947 9.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 19.469 6.429 8.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 18.151 5.406 9.215 1.00 0.00 H new ATOM 502 N TYR A 930 16.770 2.520 2.332 1.00 0.00 N ATOM 503 CA TYR A 930 15.937 3.002 1.232 1.00 0.00 C ATOM 504 C TYR A 930 14.563 3.433 1.741 1.00 0.00 C ATOM 505 O TYR A 930 13.930 2.720 2.519 1.00 0.00 O ATOM 506 CB TYR A 930 15.765 1.915 0.166 1.00 0.00 C ATOM 507 CG TYR A 930 17.023 1.592 -0.613 1.00 0.00 C ATOM 508 CD1 TYR A 930 18.223 1.329 0.033 1.00 0.00 C ATOM 509 CD2 TYR A 930 17.001 1.541 -2.003 1.00 0.00 C ATOM 510 CE1 TYR A 930 19.367 1.027 -0.682 1.00 0.00 C ATOM 511 CE2 TYR A 930 18.139 1.238 -2.723 1.00 0.00 C ATOM 512 CZ TYR A 930 19.319 0.983 -2.058 1.00 0.00 C ATOM 513 OH TYR A 930 20.454 0.681 -2.773 1.00 0.00 O ATOM 0 H TYR A 930 16.457 1.640 2.741 1.00 0.00 H new ATOM 0 HA TYR A 930 16.439 3.862 0.789 1.00 0.00 H new ATOM 0 HB2 TYR A 930 15.408 1.005 0.648 1.00 0.00 H new ATOM 0 HB3 TYR A 930 14.991 2.230 -0.534 1.00 0.00 H new ATOM 0 HD1 TYR A 930 18.264 1.361 1.112 1.00 0.00 H new ATOM 0 HD2 TYR A 930 16.078 1.742 -2.527 1.00 0.00 H new ATOM 0 HE1 TYR A 930 20.294 0.827 -0.164 1.00 0.00 H new ATOM 0 HE2 TYR A 930 18.105 1.201 -3.802 1.00 0.00 H new ATOM 0 HH TYR A 930 20.253 0.706 -3.732 1.00 0.00 H new ATOM 523 N GLU A 931 14.102 4.599 1.295 1.00 0.00 N ATOM 524 CA GLU A 931 12.797 5.110 1.706 1.00 0.00 C ATOM 525 C GLU A 931 11.722 4.753 0.680 1.00 0.00 C ATOM 526 O GLU A 931 11.865 5.035 -0.508 1.00 0.00 O ATOM 527 CB GLU A 931 12.857 6.627 1.908 1.00 0.00 C ATOM 528 CG GLU A 931 13.301 7.395 0.674 1.00 0.00 C ATOM 529 CD GLU A 931 13.395 8.889 0.917 1.00 0.00 C ATOM 530 OE1 GLU A 931 13.115 9.325 2.053 1.00 0.00 O ATOM 531 OE2 GLU A 931 13.748 9.624 -0.029 1.00 0.00 O ATOM 0 H GLU A 931 14.610 5.206 0.652 1.00 0.00 H new ATOM 0 HA GLU A 931 12.532 4.640 2.653 1.00 0.00 H new ATOM 0 HB2 GLU A 931 11.872 6.983 2.211 1.00 0.00 H new ATOM 0 HB3 GLU A 931 13.541 6.848 2.727 1.00 0.00 H new ATOM 0 HG2 GLU A 931 14.272 7.022 0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 931 12.599 7.207 -0.138 1.00 0.00 H new ATOM 538 N CYS A 932 10.648 4.125 1.152 1.00 0.00 N ATOM 539 CA CYS A 932 9.544 3.717 0.286 1.00 0.00 C ATOM 540 C CYS A 932 8.937 4.902 -0.462 1.00 0.00 C ATOM 541 O CYS A 932 8.903 6.022 0.048 1.00 0.00 O ATOM 542 CB CYS A 932 8.454 3.020 1.103 1.00 0.00 C ATOM 543 SG CYS A 932 8.997 1.495 1.937 1.00 0.00 S ATOM 0 H CYS A 932 10.518 3.886 2.135 1.00 0.00 H new ATOM 0 HA CYS A 932 9.953 3.024 -0.449 1.00 0.00 H new ATOM 0 HB2 CYS A 932 8.079 3.716 1.853 1.00 0.00 H new ATOM 0 HB3 CYS A 932 7.619 2.781 0.444 1.00 0.00 H new ATOM 548 N ARG A 933 8.438 4.636 -1.668 1.00 0.00 N ATOM 549 CA ARG A 933 7.806 5.666 -2.488 1.00 0.00 C ATOM 550 C ARG A 933 6.336 5.814 -2.107 1.00 0.00 C ATOM 551 O ARG A 933 5.766 4.926 -1.474 1.00 0.00 O ATOM 552 CB ARG A 933 7.924 5.324 -3.977 1.00 0.00 C ATOM 553 CG ARG A 933 9.341 5.401 -4.522 1.00 0.00 C ATOM 554 CD ARG A 933 9.369 5.175 -6.027 1.00 0.00 C ATOM 555 NE ARG A 933 10.713 5.321 -6.583 1.00 0.00 N ATOM 556 CZ ARG A 933 11.393 6.465 -6.582 1.00 0.00 C ATOM 557 NH1 ARG A 933 10.854 7.563 -6.069 1.00 0.00 N ATOM 558 NH2 ARG A 933 12.613 6.512 -7.100 1.00 0.00 N ATOM 0 H ARG A 933 8.460 3.712 -2.099 1.00 0.00 H new ATOM 0 HA ARG A 933 8.321 6.609 -2.306 1.00 0.00 H new ATOM 0 HB2 ARG A 933 7.538 4.318 -4.139 1.00 0.00 H new ATOM 0 HB3 ARG A 933 7.290 6.004 -4.546 1.00 0.00 H new ATOM 0 HG2 ARG A 933 9.769 6.376 -4.291 1.00 0.00 H new ATOM 0 HG3 ARG A 933 9.964 4.655 -4.029 1.00 0.00 H new ATOM 0 HD2 ARG A 933 8.992 4.177 -6.250 1.00 0.00 H new ATOM 0 HD3 ARG A 933 8.698 5.884 -6.512 1.00 0.00 H new ATOM 0 HE ARG A 933 11.155 4.499 -6.995 1.00 0.00 H new ATOM 0 HH11 ARG A 933 9.914 7.533 -5.673 1.00 0.00 H new ATOM 0 HH12 ARG A 933 11.379 8.437 -6.070 1.00 0.00 H new ATOM 0 HH21 ARG A 933 13.030 5.671 -7.499 1.00 0.00 H new ATOM 0 HH22 ARG A 933 13.134 7.389 -7.099 1.00 0.00 H new ATOM 572 N PRO A 934 5.699 6.942 -2.481 1.00 0.00 N ATOM 573 CA PRO A 934 4.293 7.185 -2.164 1.00 0.00 C ATOM 574 C PRO A 934 3.421 5.968 -2.447 1.00 0.00 C ATOM 575 O PRO A 934 3.619 5.271 -3.442 1.00 0.00 O ATOM 576 CB PRO A 934 3.914 8.340 -3.079 1.00 0.00 C ATOM 577 CG PRO A 934 5.189 9.076 -3.324 1.00 0.00 C ATOM 578 CD PRO A 934 6.298 8.059 -3.236 1.00 0.00 C ATOM 0 HA PRO A 934 4.145 7.402 -1.106 1.00 0.00 H new ATOM 0 HB2 PRO A 934 3.482 7.978 -4.012 1.00 0.00 H new ATOM 0 HB3 PRO A 934 3.170 8.985 -2.612 1.00 0.00 H new ATOM 0 HG2 PRO A 934 5.178 9.554 -4.304 1.00 0.00 H new ATOM 0 HG3 PRO A 934 5.328 9.866 -2.586 1.00 0.00 H new ATOM 0 HD2 PRO A 934 6.627 7.741 -4.225 1.00 0.00 H new ATOM 0 HD3 PRO A 934 7.171 8.464 -2.724 1.00 0.00 H new ATOM 586 N GLU A 935 2.471 5.723 -1.547 1.00 0.00 N ATOM 587 CA GLU A 935 1.549 4.590 -1.647 1.00 0.00 C ATOM 588 C GLU A 935 2.196 3.319 -1.106 1.00 0.00 C ATOM 589 O GLU A 935 1.799 2.208 -1.458 1.00 0.00 O ATOM 590 CB GLU A 935 1.086 4.372 -3.093 1.00 0.00 C ATOM 591 CG GLU A 935 0.361 5.569 -3.690 1.00 0.00 C ATOM 592 CD GLU A 935 -0.067 5.336 -5.126 1.00 0.00 C ATOM 593 OE1 GLU A 935 0.214 4.243 -5.662 1.00 0.00 O ATOM 594 OE2 GLU A 935 -0.683 6.248 -5.716 1.00 0.00 O ATOM 0 H GLU A 935 2.317 6.306 -0.724 1.00 0.00 H new ATOM 0 HA GLU A 935 0.673 4.825 -1.042 1.00 0.00 H new ATOM 0 HB2 GLU A 935 1.953 4.138 -3.711 1.00 0.00 H new ATOM 0 HB3 GLU A 935 0.426 3.505 -3.127 1.00 0.00 H new ATOM 0 HG2 GLU A 935 -0.517 5.795 -3.085 1.00 0.00 H new ATOM 0 HG3 GLU A 935 1.012 6.442 -3.646 1.00 0.00 H new ATOM 601 N TYR A 936 3.190 3.497 -0.238 1.00 0.00 N ATOM 602 CA TYR A 936 3.899 2.378 0.376 1.00 0.00 C ATOM 603 C TYR A 936 4.334 2.733 1.795 1.00 0.00 C ATOM 604 O TYR A 936 4.675 3.881 2.077 1.00 0.00 O ATOM 605 CB TYR A 936 5.123 1.978 -0.453 1.00 0.00 C ATOM 606 CG TYR A 936 4.787 1.504 -1.847 1.00 0.00 C ATOM 607 CD1 TYR A 936 4.569 2.409 -2.876 1.00 0.00 C ATOM 608 CD2 TYR A 936 4.672 0.150 -2.129 1.00 0.00 C ATOM 609 CE1 TYR A 936 4.248 1.978 -4.147 1.00 0.00 C ATOM 610 CE2 TYR A 936 4.353 -0.289 -3.398 1.00 0.00 C ATOM 611 CZ TYR A 936 4.142 0.629 -4.405 1.00 0.00 C ATOM 612 OH TYR A 936 3.822 0.195 -5.671 1.00 0.00 O ATOM 0 H TYR A 936 3.524 4.414 0.057 1.00 0.00 H new ATOM 0 HA TYR A 936 3.213 1.532 0.413 1.00 0.00 H new ATOM 0 HB2 TYR A 936 5.798 2.831 -0.522 1.00 0.00 H new ATOM 0 HB3 TYR A 936 5.661 1.187 0.070 1.00 0.00 H new ATOM 0 HD1 TYR A 936 4.652 3.468 -2.679 1.00 0.00 H new ATOM 0 HD2 TYR A 936 4.835 -0.572 -1.343 1.00 0.00 H new ATOM 0 HE1 TYR A 936 4.081 2.696 -4.937 1.00 0.00 H new ATOM 0 HE2 TYR A 936 4.269 -1.346 -3.601 1.00 0.00 H new ATOM 0 HH TYR A 936 3.789 -0.784 -5.682 1.00 0.00 H new ATOM 622 N TYR A 937 4.322 1.744 2.686 1.00 0.00 N ATOM 623 CA TYR A 937 4.720 1.969 4.072 1.00 0.00 C ATOM 624 C TYR A 937 5.457 0.755 4.632 1.00 0.00 C ATOM 625 O TYR A 937 5.095 -0.389 4.352 1.00 0.00 O ATOM 626 CB TYR A 937 3.498 2.301 4.943 1.00 0.00 C ATOM 627 CG TYR A 937 2.539 1.146 5.160 1.00 0.00 C ATOM 628 CD1 TYR A 937 2.833 0.125 6.058 1.00 0.00 C ATOM 629 CD2 TYR A 937 1.337 1.079 4.467 1.00 0.00 C ATOM 630 CE1 TYR A 937 1.959 -0.927 6.257 1.00 0.00 C ATOM 631 CE2 TYR A 937 0.457 0.031 4.663 1.00 0.00 C ATOM 632 CZ TYR A 937 0.773 -0.969 5.557 1.00 0.00 C ATOM 633 OH TYR A 937 -0.101 -2.014 5.753 1.00 0.00 O ATOM 0 H TYR A 937 4.043 0.786 2.474 1.00 0.00 H new ATOM 0 HA TYR A 937 5.400 2.821 4.091 1.00 0.00 H new ATOM 0 HB2 TYR A 937 3.846 2.653 5.914 1.00 0.00 H new ATOM 0 HB3 TYR A 937 2.954 3.125 4.482 1.00 0.00 H new ATOM 0 HD1 TYR A 937 3.761 0.155 6.610 1.00 0.00 H new ATOM 0 HD2 TYR A 937 1.086 1.859 3.763 1.00 0.00 H new ATOM 0 HE1 TYR A 937 2.204 -1.712 6.957 1.00 0.00 H new ATOM 0 HE2 TYR A 937 -0.475 -0.004 4.118 1.00 0.00 H new ATOM 0 HH TYR A 937 -0.985 -1.770 5.409 1.00 0.00 H new ATOM 643 N GLY A 938 6.493 1.012 5.422 1.00 0.00 N ATOM 644 CA GLY A 938 7.261 -0.067 6.011 1.00 0.00 C ATOM 645 C GLY A 938 8.606 0.392 6.533 1.00 0.00 C ATOM 646 O GLY A 938 9.524 -0.411 6.692 1.00 0.00 O ATOM 0 H GLY A 938 6.814 1.949 5.665 1.00 0.00 H new ATOM 0 HA2 GLY A 938 6.691 -0.510 6.827 1.00 0.00 H new ATOM 0 HA3 GLY A 938 7.412 -0.849 5.267 1.00 0.00 H new ATOM 650 N ARG A 939 8.719 1.687 6.803 1.00 0.00 N ATOM 651 CA ARG A 939 9.961 2.259 7.314 1.00 0.00 C ATOM 652 C ARG A 939 11.096 2.100 6.307 1.00 0.00 C ATOM 653 O ARG A 939 11.005 1.302 5.374 1.00 0.00 O ATOM 654 CB ARG A 939 10.361 1.587 8.625 1.00 0.00 C ATOM 655 CG ARG A 939 9.359 1.780 9.743 1.00 0.00 C ATOM 656 CD ARG A 939 9.847 1.124 11.020 1.00 0.00 C ATOM 657 NE ARG A 939 11.033 1.787 11.557 1.00 0.00 N ATOM 658 CZ ARG A 939 11.647 1.411 12.675 1.00 0.00 C ATOM 659 NH1 ARG A 939 11.190 0.378 13.370 1.00 0.00 N ATOM 660 NH2 ARG A 939 12.718 2.067 13.098 1.00 0.00 N ATOM 0 H ARG A 939 7.965 2.362 6.677 1.00 0.00 H new ATOM 0 HA ARG A 939 9.785 3.321 7.486 1.00 0.00 H new ATOM 0 HB2 ARG A 939 10.494 0.519 8.449 1.00 0.00 H new ATOM 0 HB3 ARG A 939 11.327 1.980 8.944 1.00 0.00 H new ATOM 0 HG2 ARG A 939 9.198 2.844 9.914 1.00 0.00 H new ATOM 0 HG3 ARG A 939 8.398 1.355 9.454 1.00 0.00 H new ATOM 0 HD2 ARG A 939 9.052 1.144 11.765 1.00 0.00 H new ATOM 0 HD3 ARG A 939 10.074 0.076 10.825 1.00 0.00 H new ATOM 0 HE ARG A 939 11.412 2.584 11.045 1.00 0.00 H new ATOM 0 HH11 ARG A 939 10.366 -0.130 13.047 1.00 0.00 H new ATOM 0 HH12 ARG A 939 11.662 0.091 14.227 1.00 0.00 H new ATOM 0 HH21 ARG A 939 13.073 2.862 12.566 1.00 0.00 H new ATOM 0 HH22 ARG A 939 13.188 1.777 13.956 1.00 0.00 H new ATOM 674 N PRO A 940 12.198 2.845 6.497 1.00 0.00 N ATOM 675 CA PRO A 940 13.355 2.758 5.614 1.00 0.00 C ATOM 676 C PRO A 940 14.176 1.515 5.925 1.00 0.00 C ATOM 677 O PRO A 940 14.721 1.382 7.022 1.00 0.00 O ATOM 678 CB PRO A 940 14.139 4.027 5.932 1.00 0.00 C ATOM 679 CG PRO A 940 13.791 4.352 7.345 1.00 0.00 C ATOM 680 CD PRO A 940 12.411 3.799 7.600 1.00 0.00 C ATOM 0 HA PRO A 940 13.086 2.681 4.561 1.00 0.00 H new ATOM 0 HB2 PRO A 940 15.211 3.868 5.816 1.00 0.00 H new ATOM 0 HB3 PRO A 940 13.863 4.840 5.261 1.00 0.00 H new ATOM 0 HG2 PRO A 940 14.515 3.912 8.031 1.00 0.00 H new ATOM 0 HG3 PRO A 940 13.811 5.429 7.509 1.00 0.00 H new ATOM 0 HD2 PRO A 940 12.352 3.306 8.570 1.00 0.00 H new ATOM 0 HD3 PRO A 940 11.658 4.587 7.596 1.00 0.00 H new ATOM 688 N PHE A 941 14.245 0.592 4.971 1.00 0.00 N ATOM 689 CA PHE A 941 14.983 -0.645 5.180 1.00 0.00 C ATOM 690 C PHE A 941 16.443 -0.518 4.763 1.00 0.00 C ATOM 691 O PHE A 941 16.771 -0.457 3.578 1.00 0.00 O ATOM 692 CB PHE A 941 14.302 -1.804 4.444 1.00 0.00 C ATOM 693 CG PHE A 941 14.082 -1.566 2.976 1.00 0.00 C ATOM 694 CD1 PHE A 941 12.919 -0.960 2.528 1.00 0.00 C ATOM 695 CD2 PHE A 941 15.031 -1.954 2.046 1.00 0.00 C ATOM 696 CE1 PHE A 941 12.709 -0.747 1.179 1.00 0.00 C ATOM 697 CE2 PHE A 941 14.827 -1.744 0.696 1.00 0.00 C ATOM 698 CZ PHE A 941 13.664 -1.139 0.263 1.00 0.00 C ATOM 0 H PHE A 941 13.803 0.677 4.055 1.00 0.00 H new ATOM 0 HA PHE A 941 14.975 -0.856 6.249 1.00 0.00 H new ATOM 0 HB2 PHE A 941 14.908 -2.702 4.567 1.00 0.00 H new ATOM 0 HB3 PHE A 941 13.339 -2.002 4.916 1.00 0.00 H new ATOM 0 HD1 PHE A 941 12.169 -0.651 3.241 1.00 0.00 H new ATOM 0 HD2 PHE A 941 15.943 -2.427 2.380 1.00 0.00 H new ATOM 0 HE1 PHE A 941 11.798 -0.274 0.842 1.00 0.00 H new ATOM 0 HE2 PHE A 941 15.575 -2.052 -0.019 1.00 0.00 H new ATOM 0 HZ PHE A 941 13.502 -0.973 -0.792 1.00 0.00 H new ATOM 708 N SER A 942 17.316 -0.485 5.759 1.00 0.00 N ATOM 709 CA SER A 942 18.749 -0.387 5.524 1.00 0.00 C ATOM 710 C SER A 942 19.321 -1.732 5.093 1.00 0.00 C ATOM 711 O SER A 942 19.166 -2.730 5.798 1.00 0.00 O ATOM 712 CB SER A 942 19.460 0.102 6.787 1.00 0.00 C ATOM 713 OG SER A 942 19.250 -0.788 7.869 1.00 0.00 O ATOM 0 H SER A 942 17.055 -0.525 6.744 1.00 0.00 H new ATOM 0 HA SER A 942 18.914 0.332 4.721 1.00 0.00 H new ATOM 0 HB2 SER A 942 20.528 0.197 6.593 1.00 0.00 H new ATOM 0 HB3 SER A 942 19.095 1.094 7.052 1.00 0.00 H new ATOM 0 HG SER A 942 19.171 -1.704 7.529 1.00 0.00 H new ATOM 719 N ILE A 943 20.009 -1.758 3.957 1.00 0.00 N ATOM 720 CA ILE A 943 20.623 -2.989 3.483 1.00 0.00 C ATOM 721 C ILE A 943 22.074 -3.042 3.933 1.00 0.00 C ATOM 722 O ILE A 943 22.460 -2.327 4.860 1.00 0.00 O ATOM 723 CB ILE A 943 20.542 -3.137 1.948 1.00 0.00 C ATOM 724 CG1 ILE A 943 21.008 -1.858 1.248 1.00 0.00 C ATOM 725 CG2 ILE A 943 19.127 -3.497 1.528 1.00 0.00 C ATOM 726 CD1 ILE A 943 20.908 -1.923 -0.262 1.00 0.00 C ATOM 0 H ILE A 943 20.154 -0.948 3.354 1.00 0.00 H new ATOM 0 HA ILE A 943 20.065 -3.820 3.915 1.00 0.00 H new ATOM 0 HB ILE A 943 21.209 -3.944 1.646 1.00 0.00 H new ATOM 0 HG12 ILE A 943 20.412 -1.019 1.608 1.00 0.00 H new ATOM 0 HG13 ILE A 943 22.042 -1.657 1.527 1.00 0.00 H new ATOM 0 HG21 ILE A 943 19.084 -3.598 0.444 1.00 0.00 H new ATOM 0 HG22 ILE A 943 18.838 -4.440 1.992 1.00 0.00 H new ATOM 0 HG23 ILE A 943 18.442 -2.711 1.846 1.00 0.00 H new ATOM 0 HD11 ILE A 943 21.255 -0.983 -0.690 1.00 0.00 H new ATOM 0 HD12 ILE A 943 21.526 -2.741 -0.633 1.00 0.00 H new ATOM 0 HD13 ILE A 943 19.871 -2.093 -0.551 1.00 0.00 H new ATOM 738 N THR A 944 22.878 -3.880 3.294 1.00 0.00 N ATOM 739 CA THR A 944 24.274 -3.999 3.677 1.00 0.00 C ATOM 740 C THR A 944 25.123 -4.629 2.586 1.00 0.00 C ATOM 741 O THR A 944 24.894 -5.768 2.177 1.00 0.00 O ATOM 742 CB THR A 944 24.413 -4.843 4.962 1.00 0.00 C ATOM 743 OG1 THR A 944 24.028 -4.068 6.104 1.00 0.00 O ATOM 744 CG2 THR A 944 25.835 -5.358 5.140 1.00 0.00 C ATOM 0 H THR A 944 22.592 -4.479 2.519 1.00 0.00 H new ATOM 0 HA THR A 944 24.634 -2.985 3.849 1.00 0.00 H new ATOM 0 HB THR A 944 23.752 -5.705 4.868 1.00 0.00 H new ATOM 0 HG1 THR A 944 23.689 -3.197 5.809 1.00 0.00 H new ATOM 0 HG21 THR A 944 25.897 -5.948 6.054 1.00 0.00 H new ATOM 0 HG22 THR A 944 26.106 -5.981 4.287 1.00 0.00 H new ATOM 0 HG23 THR A 944 26.522 -4.514 5.206 1.00 0.00 H new ATOM 752 N CYS A 945 26.134 -3.887 2.149 1.00 0.00 N ATOM 753 CA CYS A 945 27.056 -4.376 1.140 1.00 0.00 C ATOM 754 C CYS A 945 27.946 -5.436 1.761 1.00 0.00 C ATOM 755 O CYS A 945 28.865 -5.125 2.514 1.00 0.00 O ATOM 756 CB CYS A 945 27.890 -3.224 0.593 1.00 0.00 C ATOM 757 SG CYS A 945 29.357 -3.729 -0.353 1.00 0.00 S ATOM 0 H CYS A 945 26.333 -2.943 2.481 1.00 0.00 H new ATOM 0 HA CYS A 945 26.501 -4.814 0.311 1.00 0.00 H new ATOM 0 HB2 CYS A 945 27.258 -2.607 -0.045 1.00 0.00 H new ATOM 0 HB3 CYS A 945 28.210 -2.598 1.426 1.00 0.00 H new ATOM 762 N LEU A 946 27.642 -6.690 1.480 1.00 0.00 N ATOM 763 CA LEU A 946 28.394 -7.794 2.054 1.00 0.00 C ATOM 764 C LEU A 946 29.699 -8.065 1.314 1.00 0.00 C ATOM 765 O LEU A 946 29.901 -7.626 0.182 1.00 0.00 O ATOM 766 CB LEU A 946 27.515 -9.037 2.126 1.00 0.00 C ATOM 767 CG LEU A 946 26.240 -8.840 2.950 1.00 0.00 C ATOM 768 CD1 LEU A 946 25.273 -9.990 2.748 1.00 0.00 C ATOM 769 CD2 LEU A 946 26.579 -8.677 4.423 1.00 0.00 C ATOM 0 H LEU A 946 26.882 -6.970 0.860 1.00 0.00 H new ATOM 0 HA LEU A 946 28.683 -7.510 3.066 1.00 0.00 H new ATOM 0 HB2 LEU A 946 27.241 -9.337 1.115 1.00 0.00 H new ATOM 0 HB3 LEU A 946 28.092 -9.856 2.556 1.00 0.00 H new ATOM 0 HG LEU A 946 25.752 -7.929 2.603 1.00 0.00 H new ATOM 0 HD11 LEU A 946 24.377 -9.822 3.346 1.00 0.00 H new ATOM 0 HD12 LEU A 946 24.999 -10.055 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 946 25.746 -10.922 3.058 1.00 0.00 H new ATOM 0 HD21 LEU A 946 25.661 -8.538 4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 946 27.096 -9.568 4.778 1.00 0.00 H new ATOM 0 HD23 LEU A 946 27.223 -7.808 4.554 1.00 0.00 H new ATOM 781 N ASP A 947 30.584 -8.773 2.003 1.00 0.00 N ATOM 782 CA ASP A 947 31.911 -9.121 1.500 1.00 0.00 C ATOM 783 C ASP A 947 31.898 -9.564 0.040 1.00 0.00 C ATOM 784 O ASP A 947 32.822 -9.255 -0.714 1.00 0.00 O ATOM 785 CB ASP A 947 32.495 -10.233 2.365 1.00 0.00 C ATOM 786 CG ASP A 947 33.948 -10.527 2.041 1.00 0.00 C ATOM 787 OD1 ASP A 947 34.233 -10.927 0.893 1.00 0.00 O ATOM 788 OD2 ASP A 947 34.801 -10.357 2.937 1.00 0.00 O ATOM 0 H ASP A 947 30.400 -9.128 2.941 1.00 0.00 H new ATOM 0 HA ASP A 947 32.525 -8.222 1.552 1.00 0.00 H new ATOM 0 HB2 ASP A 947 32.411 -9.953 3.415 1.00 0.00 H new ATOM 0 HB3 ASP A 947 31.906 -11.140 2.229 1.00 0.00 H new ATOM 793 N ASN A 948 30.874 -10.309 -0.356 1.00 0.00 N ATOM 794 CA ASN A 948 30.788 -10.806 -1.726 1.00 0.00 C ATOM 795 C ASN A 948 30.204 -9.760 -2.669 1.00 0.00 C ATOM 796 O ASN A 948 29.472 -10.096 -3.599 1.00 0.00 O ATOM 797 CB ASN A 948 29.940 -12.079 -1.772 1.00 0.00 C ATOM 798 CG ASN A 948 30.525 -13.194 -0.927 1.00 0.00 C ATOM 799 OD1 ASN A 948 31.653 -13.634 -1.151 1.00 0.00 O ATOM 800 ND2 ASN A 948 29.757 -13.660 0.051 1.00 0.00 N ATOM 0 H ASN A 948 30.096 -10.582 0.245 1.00 0.00 H new ATOM 0 HA ASN A 948 31.801 -11.030 -2.060 1.00 0.00 H new ATOM 0 HB2 ASN A 948 28.932 -11.854 -1.424 1.00 0.00 H new ATOM 0 HB3 ASN A 948 29.853 -12.417 -2.805 1.00 0.00 H new ATOM 0 HD21 ASN A 948 30.096 -14.412 0.652 1.00 0.00 H new ATOM 0 HD22 ASN A 948 28.828 -13.266 0.202 1.00 0.00 H new ATOM 807 N LEU A 949 30.547 -8.494 -2.434 1.00 0.00 N ATOM 808 CA LEU A 949 30.065 -7.402 -3.277 1.00 0.00 C ATOM 809 C LEU A 949 28.579 -7.550 -3.562 1.00 0.00 C ATOM 810 O LEU A 949 28.131 -7.417 -4.702 1.00 0.00 O ATOM 811 CB LEU A 949 30.860 -7.352 -4.582 1.00 0.00 C ATOM 812 CG LEU A 949 32.209 -6.637 -4.486 1.00 0.00 C ATOM 813 CD1 LEU A 949 33.031 -7.192 -3.337 1.00 0.00 C ATOM 814 CD2 LEU A 949 32.977 -6.759 -5.791 1.00 0.00 C ATOM 0 H LEU A 949 31.155 -8.200 -1.669 1.00 0.00 H new ATOM 0 HA LEU A 949 30.212 -6.464 -2.741 1.00 0.00 H new ATOM 0 HB2 LEU A 949 31.029 -8.372 -4.927 1.00 0.00 H new ATOM 0 HB3 LEU A 949 30.255 -6.855 -5.341 1.00 0.00 H new ATOM 0 HG LEU A 949 32.018 -5.581 -4.295 1.00 0.00 H new ATOM 0 HD11 LEU A 949 33.986 -6.669 -3.287 1.00 0.00 H new ATOM 0 HD12 LEU A 949 32.490 -7.050 -2.401 1.00 0.00 H new ATOM 0 HD13 LEU A 949 33.207 -8.256 -3.496 1.00 0.00 H new ATOM 0 HD21 LEU A 949 33.933 -6.243 -5.700 1.00 0.00 H new ATOM 0 HD22 LEU A 949 33.152 -7.812 -6.013 1.00 0.00 H new ATOM 0 HD23 LEU A 949 32.398 -6.310 -6.598 1.00 0.00 H new ATOM 826 N VAL A 950 27.823 -7.832 -2.512 1.00 0.00 N ATOM 827 CA VAL A 950 26.387 -8.011 -2.625 1.00 0.00 C ATOM 828 C VAL A 950 25.643 -7.064 -1.703 1.00 0.00 C ATOM 829 O VAL A 950 26.203 -6.084 -1.210 1.00 0.00 O ATOM 830 CB VAL A 950 25.985 -9.442 -2.250 1.00 0.00 C ATOM 831 CG1 VAL A 950 26.540 -10.441 -3.239 1.00 0.00 C ATOM 832 CG2 VAL A 950 26.467 -9.752 -0.848 1.00 0.00 C ATOM 0 H VAL A 950 28.186 -7.942 -1.565 1.00 0.00 H new ATOM 0 HA VAL A 950 26.123 -7.804 -3.662 1.00 0.00 H new ATOM 0 HB VAL A 950 24.898 -9.520 -2.281 1.00 0.00 H new ATOM 0 HG11 VAL A 950 26.239 -11.447 -2.948 1.00 0.00 H new ATOM 0 HG12 VAL A 950 26.154 -10.221 -4.234 1.00 0.00 H new ATOM 0 HG13 VAL A 950 27.628 -10.377 -3.249 1.00 0.00 H new ATOM 0 HG21 VAL A 950 26.181 -10.770 -0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 950 27.552 -9.658 -0.807 1.00 0.00 H new ATOM 0 HG23 VAL A 950 26.015 -9.052 -0.145 1.00 0.00 H new ATOM 842 N TRP A 951 24.382 -7.388 -1.455 1.00 0.00 N ATOM 843 CA TRP A 951 23.539 -6.594 -0.579 1.00 0.00 C ATOM 844 C TRP A 951 22.464 -7.466 0.051 1.00 0.00 C ATOM 845 O TRP A 951 21.680 -8.108 -0.649 1.00 0.00 O ATOM 846 CB TRP A 951 22.880 -5.445 -1.352 1.00 0.00 C ATOM 847 CG TRP A 951 23.858 -4.448 -1.895 1.00 0.00 C ATOM 848 CD1 TRP A 951 24.497 -4.487 -3.103 1.00 0.00 C ATOM 849 CD2 TRP A 951 24.325 -3.270 -1.233 1.00 0.00 C ATOM 850 NE1 TRP A 951 25.326 -3.399 -3.233 1.00 0.00 N ATOM 851 CE2 TRP A 951 25.238 -2.637 -2.096 1.00 0.00 C ATOM 852 CE3 TRP A 951 24.054 -2.689 0.006 1.00 0.00 C ATOM 853 CZ2 TRP A 951 25.881 -1.451 -1.756 1.00 0.00 C ATOM 854 CZ3 TRP A 951 24.690 -1.513 0.344 1.00 0.00 C ATOM 855 CH2 TRP A 951 25.595 -0.902 -0.534 1.00 0.00 C ATOM 0 H TRP A 951 23.918 -8.204 -1.854 1.00 0.00 H new ATOM 0 HA TRP A 951 24.168 -6.174 0.206 1.00 0.00 H new ATOM 0 HB2 TRP A 951 22.300 -5.859 -2.177 1.00 0.00 H new ATOM 0 HB3 TRP A 951 22.178 -4.932 -0.695 1.00 0.00 H new ATOM 0 HD1 TRP A 951 24.369 -5.260 -3.846 1.00 0.00 H new ATOM 0 HE1 TRP A 951 25.911 -3.192 -4.042 1.00 0.00 H new ATOM 0 HE3 TRP A 951 23.358 -3.153 0.689 1.00 0.00 H new ATOM 0 HZ2 TRP A 951 26.580 -0.980 -2.431 1.00 0.00 H new ATOM 0 HZ3 TRP A 951 24.487 -1.056 1.301 1.00 0.00 H new ATOM 0 HH2 TRP A 951 26.076 0.020 -0.242 1.00 0.00 H new ATOM 866 N SER A 952 22.439 -7.481 1.380 1.00 0.00 N ATOM 867 CA SER A 952 21.464 -8.269 2.127 1.00 0.00 C ATOM 868 C SER A 952 20.078 -8.132 1.507 1.00 0.00 C ATOM 869 O SER A 952 19.736 -7.083 0.959 1.00 0.00 O ATOM 870 CB SER A 952 21.434 -7.829 3.593 1.00 0.00 C ATOM 871 OG SER A 952 20.497 -8.590 4.334 1.00 0.00 O ATOM 0 H SER A 952 23.087 -6.953 1.965 1.00 0.00 H new ATOM 0 HA SER A 952 21.762 -9.317 2.082 1.00 0.00 H new ATOM 0 HB2 SER A 952 22.426 -7.942 4.030 1.00 0.00 H new ATOM 0 HB3 SER A 952 21.177 -6.771 3.653 1.00 0.00 H new ATOM 0 HG SER A 952 20.498 -8.291 5.267 1.00 0.00 H new ATOM 877 N SER A 953 19.295 -9.199 1.576 1.00 0.00 N ATOM 878 CA SER A 953 17.959 -9.198 0.994 1.00 0.00 C ATOM 879 C SER A 953 16.954 -8.488 1.896 1.00 0.00 C ATOM 880 O SER A 953 16.697 -8.921 3.020 1.00 0.00 O ATOM 881 CB SER A 953 17.498 -10.630 0.748 1.00 0.00 C ATOM 882 OG SER A 953 16.216 -10.659 0.145 1.00 0.00 O ATOM 0 H SER A 953 19.560 -10.074 2.028 1.00 0.00 H new ATOM 0 HA SER A 953 18.010 -8.657 0.049 1.00 0.00 H new ATOM 0 HB2 SER A 953 18.216 -11.141 0.107 1.00 0.00 H new ATOM 0 HB3 SER A 953 17.471 -11.174 1.692 1.00 0.00 H new ATOM 0 HG SER A 953 15.945 -11.589 -0.003 1.00 0.00 H new ATOM 888 N PRO A 954 16.365 -7.387 1.400 1.00 0.00 N ATOM 889 CA PRO A 954 15.372 -6.600 2.134 1.00 0.00 C ATOM 890 C PRO A 954 14.005 -7.276 2.139 1.00 0.00 C ATOM 891 O PRO A 954 13.029 -6.727 1.627 1.00 0.00 O ATOM 892 CB PRO A 954 15.310 -5.274 1.358 1.00 0.00 C ATOM 893 CG PRO A 954 16.401 -5.350 0.339 1.00 0.00 C ATOM 894 CD PRO A 954 16.614 -6.809 0.077 1.00 0.00 C ATOM 0 HA PRO A 954 15.642 -6.476 3.183 1.00 0.00 H new ATOM 0 HB2 PRO A 954 14.338 -5.144 0.882 1.00 0.00 H new ATOM 0 HB3 PRO A 954 15.455 -4.423 2.024 1.00 0.00 H new ATOM 0 HG2 PRO A 954 16.120 -4.826 -0.574 1.00 0.00 H new ATOM 0 HG3 PRO A 954 17.314 -4.882 0.708 1.00 0.00 H new ATOM 0 HD2 PRO A 954 15.925 -7.195 -0.675 1.00 0.00 H new ATOM 0 HD3 PRO A 954 17.623 -7.018 -0.278 1.00 0.00 H new ATOM 902 N LYS A 955 13.945 -8.474 2.706 1.00 0.00 N ATOM 903 CA LYS A 955 12.698 -9.229 2.761 1.00 0.00 C ATOM 904 C LYS A 955 11.777 -8.685 3.847 1.00 0.00 C ATOM 905 O LYS A 955 12.201 -8.472 4.983 1.00 0.00 O ATOM 906 CB LYS A 955 12.988 -10.707 3.025 1.00 0.00 C ATOM 907 CG LYS A 955 11.740 -11.574 3.029 1.00 0.00 C ATOM 908 CD LYS A 955 12.044 -13.005 3.443 1.00 0.00 C ATOM 909 CE LYS A 955 12.593 -13.076 4.859 1.00 0.00 C ATOM 910 NZ LYS A 955 12.882 -14.476 5.274 1.00 0.00 N ATOM 0 H LYS A 955 14.743 -8.944 3.134 1.00 0.00 H new ATOM 0 HA LYS A 955 12.198 -9.124 1.798 1.00 0.00 H new ATOM 0 HB2 LYS A 955 13.676 -11.076 2.264 1.00 0.00 H new ATOM 0 HB3 LYS A 955 13.493 -10.805 3.986 1.00 0.00 H new ATOM 0 HG2 LYS A 955 11.004 -11.148 3.711 1.00 0.00 H new ATOM 0 HG3 LYS A 955 11.293 -11.571 2.035 1.00 0.00 H new ATOM 0 HD2 LYS A 955 11.136 -13.604 3.374 1.00 0.00 H new ATOM 0 HD3 LYS A 955 12.766 -13.439 2.751 1.00 0.00 H new ATOM 0 HE2 LYS A 955 13.505 -12.483 4.925 1.00 0.00 H new ATOM 0 HE3 LYS A 955 11.875 -12.634 5.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 13.254 -14.480 6.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 12.007 -15.037 5.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 13.587 -14.890 4.631 1.00 0.00 H new ATOM 924 N ASP A 956 10.513 -8.467 3.487 1.00 0.00 N ATOM 925 CA ASP A 956 9.529 -7.949 4.431 1.00 0.00 C ATOM 926 C ASP A 956 10.018 -6.644 5.052 1.00 0.00 C ATOM 927 O ASP A 956 10.558 -6.637 6.158 1.00 0.00 O ATOM 928 CB ASP A 956 9.245 -8.983 5.524 1.00 0.00 C ATOM 929 CG ASP A 956 8.734 -10.298 4.965 1.00 0.00 C ATOM 930 OD1 ASP A 956 8.590 -10.403 3.729 1.00 0.00 O ATOM 931 OD2 ASP A 956 8.475 -11.221 5.766 1.00 0.00 O ATOM 0 H ASP A 956 10.149 -8.641 2.550 1.00 0.00 H new ATOM 0 HA ASP A 956 8.604 -7.749 3.890 1.00 0.00 H new ATOM 0 HB2 ASP A 956 10.157 -9.164 6.093 1.00 0.00 H new ATOM 0 HB3 ASP A 956 8.510 -8.578 6.220 1.00 0.00 H new ATOM 936 N VAL A 957 9.837 -5.543 4.325 1.00 0.00 N ATOM 937 CA VAL A 957 10.278 -4.234 4.799 1.00 0.00 C ATOM 938 C VAL A 957 9.413 -3.111 4.246 1.00 0.00 C ATOM 939 O VAL A 957 9.374 -2.018 4.804 1.00 0.00 O ATOM 940 CB VAL A 957 11.738 -3.954 4.402 1.00 0.00 C ATOM 941 CG1 VAL A 957 12.694 -4.813 5.208 1.00 0.00 C ATOM 942 CG2 VAL A 957 11.932 -4.172 2.911 1.00 0.00 C ATOM 0 H VAL A 957 9.389 -5.532 3.409 1.00 0.00 H new ATOM 0 HA VAL A 957 10.188 -4.261 5.885 1.00 0.00 H new ATOM 0 HB VAL A 957 11.961 -2.911 4.627 1.00 0.00 H new ATOM 0 HG11 VAL A 957 13.719 -4.596 4.908 1.00 0.00 H new ATOM 0 HG12 VAL A 957 12.572 -4.595 6.269 1.00 0.00 H new ATOM 0 HG13 VAL A 957 12.478 -5.866 5.027 1.00 0.00 H new ATOM 0 HG21 VAL A 957 12.970 -3.970 2.646 1.00 0.00 H new ATOM 0 HG22 VAL A 957 11.687 -5.204 2.659 1.00 0.00 H new ATOM 0 HG23 VAL A 957 11.278 -3.499 2.357 1.00 0.00 H new ATOM 952 N CYS A 958 8.733 -3.377 3.143 1.00 0.00 N ATOM 953 CA CYS A 958 7.884 -2.369 2.525 1.00 0.00 C ATOM 954 C CYS A 958 6.730 -3.017 1.773 1.00 0.00 C ATOM 955 O CYS A 958 6.919 -3.975 1.023 1.00 0.00 O ATOM 956 CB CYS A 958 8.708 -1.497 1.576 1.00 0.00 C ATOM 957 SG CYS A 958 7.874 0.041 1.069 1.00 0.00 S ATOM 0 H CYS A 958 8.751 -4.275 2.659 1.00 0.00 H new ATOM 0 HA CYS A 958 7.468 -1.742 3.314 1.00 0.00 H new ATOM 0 HB2 CYS A 958 9.652 -1.244 2.059 1.00 0.00 H new ATOM 0 HB3 CYS A 958 8.951 -2.077 0.686 1.00 0.00 H new ATOM 962 N LYS A 959 5.532 -2.487 1.991 1.00 0.00 N ATOM 963 CA LYS A 959 4.329 -3.005 1.353 1.00 0.00 C ATOM 964 C LYS A 959 3.383 -1.858 1.002 1.00 0.00 C ATOM 965 O LYS A 959 3.336 -0.850 1.705 1.00 0.00 O ATOM 966 CB LYS A 959 3.635 -4.001 2.286 1.00 0.00 C ATOM 967 CG LYS A 959 4.525 -5.161 2.715 1.00 0.00 C ATOM 968 CD LYS A 959 4.861 -6.074 1.547 1.00 0.00 C ATOM 969 CE LYS A 959 5.753 -7.226 1.980 1.00 0.00 C ATOM 970 NZ LYS A 959 5.107 -8.067 3.024 1.00 0.00 N ATOM 0 H LYS A 959 5.368 -1.693 2.610 1.00 0.00 H new ATOM 0 HA LYS A 959 4.607 -3.518 0.432 1.00 0.00 H new ATOM 0 HB2 LYS A 959 3.289 -3.473 3.174 1.00 0.00 H new ATOM 0 HB3 LYS A 959 2.751 -4.398 1.787 1.00 0.00 H new ATOM 0 HG2 LYS A 959 5.446 -4.772 3.149 1.00 0.00 H new ATOM 0 HG3 LYS A 959 4.024 -5.736 3.494 1.00 0.00 H new ATOM 0 HD2 LYS A 959 3.941 -6.467 1.115 1.00 0.00 H new ATOM 0 HD3 LYS A 959 5.360 -5.500 0.766 1.00 0.00 H new ATOM 0 HE2 LYS A 959 5.994 -7.843 1.115 1.00 0.00 H new ATOM 0 HE3 LYS A 959 6.694 -6.832 2.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 5.630 -8.961 3.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 5.115 -7.560 3.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 4.125 -8.269 2.748 1.00 0.00 H new ATOM 984 N ARG A 960 2.649 -2.007 -0.098 1.00 0.00 N ATOM 985 CA ARG A 960 1.726 -0.967 -0.547 1.00 0.00 C ATOM 986 C ARG A 960 0.762 -0.554 0.560 1.00 0.00 C ATOM 987 O ARG A 960 0.310 -1.383 1.351 1.00 0.00 O ATOM 988 CB ARG A 960 0.920 -1.432 -1.759 1.00 0.00 C ATOM 989 CG ARG A 960 0.165 -0.301 -2.440 1.00 0.00 C ATOM 990 CD ARG A 960 -0.833 -0.827 -3.455 1.00 0.00 C ATOM 991 NE ARG A 960 -1.462 0.246 -4.223 1.00 0.00 N ATOM 992 CZ ARG A 960 -0.797 1.069 -5.031 1.00 0.00 C ATOM 993 NH1 ARG A 960 0.514 0.945 -5.181 1.00 0.00 N ATOM 994 NH2 ARG A 960 -1.449 2.016 -5.692 1.00 0.00 N ATOM 0 H ARG A 960 2.675 -2.835 -0.693 1.00 0.00 H new ATOM 0 HA ARG A 960 2.335 -0.107 -0.824 1.00 0.00 H new ATOM 0 HB2 ARG A 960 1.593 -1.897 -2.479 1.00 0.00 H new ATOM 0 HB3 ARG A 960 0.211 -2.198 -1.445 1.00 0.00 H new ATOM 0 HG2 ARG A 960 -0.357 0.292 -1.689 1.00 0.00 H new ATOM 0 HG3 ARG A 960 0.873 0.363 -2.936 1.00 0.00 H new ATOM 0 HD2 ARG A 960 -0.328 -1.511 -4.137 1.00 0.00 H new ATOM 0 HD3 ARG A 960 -1.603 -1.402 -2.940 1.00 0.00 H new ATOM 0 HE ARG A 960 -2.470 0.372 -4.135 1.00 0.00 H new ATOM 0 HH11 ARG A 960 1.018 0.216 -4.676 1.00 0.00 H new ATOM 0 HH12 ARG A 960 1.018 1.578 -5.801 1.00 0.00 H new ATOM 0 HH21 ARG A 960 -2.458 2.113 -5.581 1.00 0.00 H new ATOM 0 HH22 ARG A 960 -0.941 2.647 -6.311 1.00 0.00 H new ATOM 1008 N LYS A 961 0.445 0.736 0.595 1.00 0.00 N ATOM 1009 CA LYS A 961 -0.473 1.284 1.584 1.00 0.00 C ATOM 1010 C LYS A 961 -1.820 0.577 1.549 1.00 0.00 C ATOM 1011 O LYS A 961 -2.243 0.067 0.508 1.00 0.00 O ATOM 1012 CB LYS A 961 -0.676 2.778 1.350 1.00 0.00 C ATOM 1013 CG LYS A 961 0.551 3.619 1.665 1.00 0.00 C ATOM 1014 CD LYS A 961 0.256 5.105 1.540 1.00 0.00 C ATOM 1015 CE LYS A 961 -0.815 5.549 2.525 1.00 0.00 C ATOM 1016 NZ LYS A 961 -0.422 5.278 3.936 1.00 0.00 N ATOM 0 H LYS A 961 0.815 1.427 -0.058 1.00 0.00 H new ATOM 0 HA LYS A 961 -0.028 1.125 2.566 1.00 0.00 H new ATOM 0 HB2 LYS A 961 -0.958 2.939 0.309 1.00 0.00 H new ATOM 0 HB3 LYS A 961 -1.509 3.123 1.963 1.00 0.00 H new ATOM 0 HG2 LYS A 961 0.894 3.399 2.676 1.00 0.00 H new ATOM 0 HG3 LYS A 961 1.361 3.350 0.988 1.00 0.00 H new ATOM 0 HD2 LYS A 961 1.169 5.674 1.714 1.00 0.00 H new ATOM 0 HD3 LYS A 961 -0.069 5.328 0.524 1.00 0.00 H new ATOM 0 HE2 LYS A 961 -1.003 6.615 2.400 1.00 0.00 H new ATOM 0 HE3 LYS A 961 -1.749 5.032 2.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 -1.074 5.771 4.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 -0.464 4.255 4.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 0.547 5.618 4.098 1.00 0.00 H new ATOM 1030 N SER A 962 -2.496 0.564 2.693 1.00 0.00 N ATOM 1031 CA SER A 962 -3.801 -0.069 2.797 1.00 0.00 C ATOM 1032 C SER A 962 -4.722 0.748 3.694 1.00 0.00 C ATOM 1033 O SER A 962 -4.426 0.982 4.865 1.00 0.00 O ATOM 1034 CB SER A 962 -3.665 -1.486 3.355 1.00 0.00 C ATOM 1035 OG SER A 962 -3.214 -1.467 4.698 1.00 0.00 O ATOM 0 H SER A 962 -2.160 0.985 3.559 1.00 0.00 H new ATOM 0 HA SER A 962 -4.233 -0.120 1.798 1.00 0.00 H new ATOM 0 HB2 SER A 962 -4.627 -1.996 3.299 1.00 0.00 H new ATOM 0 HB3 SER A 962 -2.966 -2.055 2.742 1.00 0.00 H new ATOM 0 HG SER A 962 -3.511 -0.640 5.131 1.00 0.00 H new ATOM 1041 N CYS A 963 -5.842 1.173 3.127 1.00 0.00 N ATOM 1042 CA CYS A 963 -6.825 1.962 3.852 1.00 0.00 C ATOM 1043 C CYS A 963 -7.723 1.060 4.692 1.00 0.00 C ATOM 1044 O CYS A 963 -7.910 -0.113 4.373 1.00 0.00 O ATOM 1045 CB CYS A 963 -7.660 2.779 2.867 1.00 0.00 C ATOM 1046 SG CYS A 963 -8.235 1.822 1.430 1.00 0.00 S ATOM 0 H CYS A 963 -6.093 0.982 2.157 1.00 0.00 H new ATOM 0 HA CYS A 963 -6.303 2.643 4.525 1.00 0.00 H new ATOM 0 HB2 CYS A 963 -8.524 3.189 3.389 1.00 0.00 H new ATOM 0 HB3 CYS A 963 -7.069 3.625 2.517 1.00 0.00 H new ATOM 1051 N LYS A 964 -8.270 1.611 5.770 1.00 0.00 N ATOM 1052 CA LYS A 964 -9.140 0.844 6.654 1.00 0.00 C ATOM 1053 C LYS A 964 -10.417 0.438 5.931 1.00 0.00 C ATOM 1054 O LYS A 964 -11.059 1.257 5.273 1.00 0.00 O ATOM 1055 CB LYS A 964 -9.485 1.663 7.901 1.00 0.00 C ATOM 1056 CG LYS A 964 -10.405 0.937 8.869 1.00 0.00 C ATOM 1057 CD LYS A 964 -10.761 1.809 10.061 1.00 0.00 C ATOM 1058 CE LYS A 964 -11.696 1.090 11.019 1.00 0.00 C ATOM 1059 NZ LYS A 964 -12.069 1.945 12.180 1.00 0.00 N ATOM 0 H LYS A 964 -8.127 2.581 6.052 1.00 0.00 H new ATOM 0 HA LYS A 964 -8.609 -0.058 6.957 1.00 0.00 H new ATOM 0 HB2 LYS A 964 -8.563 1.928 8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 964 -9.958 2.596 7.594 1.00 0.00 H new ATOM 0 HG2 LYS A 964 -11.316 0.638 8.351 1.00 0.00 H new ATOM 0 HG3 LYS A 964 -9.921 0.024 9.217 1.00 0.00 H new ATOM 0 HD2 LYS A 964 -9.851 2.097 10.587 1.00 0.00 H new ATOM 0 HD3 LYS A 964 -11.232 2.728 9.713 1.00 0.00 H new ATOM 0 HE2 LYS A 964 -12.598 0.787 10.487 1.00 0.00 H new ATOM 0 HE3 LYS A 964 -11.217 0.179 11.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 -12.707 1.417 12.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 -11.211 2.213 12.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 -12.549 2.802 11.840 1.00 0.00 H new ATOM 1073 N THR A 965 -10.776 -0.837 6.054 1.00 0.00 N ATOM 1074 CA THR A 965 -11.973 -1.362 5.411 1.00 0.00 C ATOM 1075 C THR A 965 -13.209 -0.576 5.836 1.00 0.00 C ATOM 1076 O THR A 965 -13.400 -0.300 7.022 1.00 0.00 O ATOM 1077 CB THR A 965 -12.181 -2.852 5.748 1.00 0.00 C ATOM 1078 OG1 THR A 965 -10.998 -3.596 5.435 1.00 0.00 O ATOM 1079 CG2 THR A 965 -13.359 -3.427 4.975 1.00 0.00 C ATOM 0 H THR A 965 -10.253 -1.526 6.595 1.00 0.00 H new ATOM 0 HA THR A 965 -11.831 -1.258 4.335 1.00 0.00 H new ATOM 0 HB THR A 965 -12.392 -2.930 6.815 1.00 0.00 H new ATOM 0 HG1 THR A 965 -11.138 -4.541 5.654 1.00 0.00 H new ATOM 0 HG21 THR A 965 -13.484 -4.479 5.231 1.00 0.00 H new ATOM 0 HG22 THR A 965 -14.266 -2.881 5.234 1.00 0.00 H new ATOM 0 HG23 THR A 965 -13.172 -3.334 3.905 1.00 0.00 H new ATOM 1087 N PRO A 966 -14.073 -0.204 4.873 1.00 0.00 N ATOM 1088 CA PRO A 966 -15.296 0.551 5.154 1.00 0.00 C ATOM 1089 C PRO A 966 -16.143 -0.115 6.233 1.00 0.00 C ATOM 1090 O PRO A 966 -16.101 -1.334 6.397 1.00 0.00 O ATOM 1091 CB PRO A 966 -16.045 0.561 3.812 1.00 0.00 C ATOM 1092 CG PRO A 966 -15.348 -0.445 2.956 1.00 0.00 C ATOM 1093 CD PRO A 966 -13.930 -0.490 3.440 1.00 0.00 C ATOM 0 HA PRO A 966 -15.077 1.550 5.531 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -17.095 0.301 3.947 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -16.018 1.550 3.355 1.00 0.00 H new ATOM 0 HG2 PRO A 966 -15.820 -1.424 3.041 1.00 0.00 H new ATOM 0 HG3 PRO A 966 -15.392 -0.160 1.905 1.00 0.00 H new ATOM 0 HD2 PRO A 966 -13.472 -1.463 3.264 1.00 0.00 H new ATOM 0 HD3 PRO A 966 -13.307 0.250 2.939 1.00 0.00 H new ATOM 1101 N PRO A 967 -16.914 0.682 6.997 1.00 0.00 N ATOM 1102 CA PRO A 967 -17.768 0.164 8.072 1.00 0.00 C ATOM 1103 C PRO A 967 -19.001 -0.567 7.548 1.00 0.00 C ATOM 1104 O PRO A 967 -20.105 -0.354 8.044 1.00 0.00 O ATOM 1105 CB PRO A 967 -18.173 1.425 8.835 1.00 0.00 C ATOM 1106 CG PRO A 967 -18.127 2.511 7.816 1.00 0.00 C ATOM 1107 CD PRO A 967 -17.009 2.150 6.876 1.00 0.00 C ATOM 0 HA PRO A 967 -17.249 -0.575 8.682 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -19.170 1.326 9.264 1.00 0.00 H new ATOM 0 HB3 PRO A 967 -17.490 1.626 9.660 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -19.075 2.587 7.284 1.00 0.00 H new ATOM 0 HG3 PRO A 967 -17.946 3.478 8.285 1.00 0.00 H new ATOM 0 HD2 PRO A 967 -17.231 2.454 5.853 1.00 0.00 H new ATOM 0 HD3 PRO A 967 -16.075 2.637 7.158 1.00 0.00 H new ATOM 1115 N ASP A 968 -18.782 -1.429 6.550 1.00 0.00 N ATOM 1116 CA ASP A 968 -19.838 -2.233 5.915 1.00 0.00 C ATOM 1117 C ASP A 968 -21.245 -1.696 6.181 1.00 0.00 C ATOM 1118 O ASP A 968 -21.756 -1.795 7.298 1.00 0.00 O ATOM 1119 CB ASP A 968 -19.745 -3.683 6.395 1.00 0.00 C ATOM 1120 CG ASP A 968 -18.415 -4.324 6.048 1.00 0.00 C ATOM 1121 OD1 ASP A 968 -17.372 -3.813 6.508 1.00 0.00 O ATOM 1122 OD2 ASP A 968 -18.416 -5.337 5.318 1.00 0.00 O ATOM 0 H ASP A 968 -17.856 -1.592 6.154 1.00 0.00 H new ATOM 0 HA ASP A 968 -19.672 -2.174 4.839 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -19.890 -3.715 7.475 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -20.552 -4.263 5.948 1.00 0.00 H new ATOM 1127 N PRO A 969 -21.903 -1.140 5.146 1.00 0.00 N ATOM 1128 CA PRO A 969 -23.262 -0.605 5.272 1.00 0.00 C ATOM 1129 C PRO A 969 -24.189 -1.558 6.012 1.00 0.00 C ATOM 1130 O PRO A 969 -24.098 -2.776 5.857 1.00 0.00 O ATOM 1131 CB PRO A 969 -23.710 -0.440 3.821 1.00 0.00 C ATOM 1132 CG PRO A 969 -22.447 -0.200 3.068 1.00 0.00 C ATOM 1133 CD PRO A 969 -21.384 -1.004 3.769 1.00 0.00 C ATOM 0 HA PRO A 969 -23.288 0.320 5.848 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -24.224 -1.331 3.460 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -24.403 0.395 3.711 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -22.548 -0.511 2.028 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -22.193 0.860 3.061 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -21.240 -1.976 3.297 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -20.420 -0.495 3.752 1.00 0.00 H new ATOM 1141 N VAL A 970 -25.074 -0.992 6.825 1.00 0.00 N ATOM 1142 CA VAL A 970 -26.015 -1.771 7.601 1.00 0.00 C ATOM 1143 C VAL A 970 -26.727 -2.812 6.742 1.00 0.00 C ATOM 1144 O VAL A 970 -27.226 -2.499 5.662 1.00 0.00 O ATOM 1145 CB VAL A 970 -27.049 -0.851 8.259 1.00 0.00 C ATOM 1146 CG1 VAL A 970 -27.705 0.020 7.210 1.00 0.00 C ATOM 1147 CG2 VAL A 970 -28.075 -1.660 9.017 1.00 0.00 C ATOM 0 H VAL A 970 -25.154 0.016 6.960 1.00 0.00 H new ATOM 0 HA VAL A 970 -25.450 -2.296 8.371 1.00 0.00 H new ATOM 0 HB VAL A 970 -26.543 -0.204 8.976 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -28.439 0.671 7.685 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -26.947 0.627 6.715 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -28.203 -0.610 6.473 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -28.800 -0.989 9.477 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -28.588 -2.333 8.330 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -27.578 -2.243 9.792 1.00 0.00 H new ATOM 1157 N ASN A 971 -26.763 -4.049 7.240 1.00 0.00 N ATOM 1158 CA ASN A 971 -27.406 -5.163 6.541 1.00 0.00 C ATOM 1159 C ASN A 971 -26.556 -5.661 5.373 1.00 0.00 C ATOM 1160 O ASN A 971 -26.331 -6.863 5.229 1.00 0.00 O ATOM 1161 CB ASN A 971 -28.798 -4.765 6.043 1.00 0.00 C ATOM 1162 CG ASN A 971 -29.712 -4.323 7.167 1.00 0.00 C ATOM 1163 OD1 ASN A 971 -30.201 -3.091 7.083 1.00 0.00 O flip ATOM 1164 ND2 ASN A 971 -29.980 -5.081 8.100 1.00 0.00 N flip ATOM 0 H ASN A 971 -26.349 -4.306 8.136 1.00 0.00 H new ATOM 0 HA ASN A 971 -27.507 -5.977 7.258 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -28.703 -3.957 5.317 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -29.249 -5.610 5.523 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -29.582 -6.020 8.125 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -30.600 -4.770 8.848 1.00 0.00 H new ATOM 1171 N GLY A 972 -26.090 -4.736 4.537 1.00 0.00 N ATOM 1172 CA GLY A 972 -25.280 -5.113 3.393 1.00 0.00 C ATOM 1173 C GLY A 972 -23.858 -5.488 3.768 1.00 0.00 C ATOM 1174 O GLY A 972 -23.601 -5.940 4.885 1.00 0.00 O ATOM 0 H GLY A 972 -26.259 -3.735 4.632 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -25.749 -5.955 2.885 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -25.256 -4.286 2.684 1.00 0.00 H new ATOM 1178 N MET A 973 -22.935 -5.296 2.826 1.00 0.00 N ATOM 1179 CA MET A 973 -21.525 -5.611 3.040 1.00 0.00 C ATOM 1180 C MET A 973 -20.719 -5.339 1.769 1.00 0.00 C ATOM 1181 O MET A 973 -21.204 -5.567 0.659 1.00 0.00 O ATOM 1182 CB MET A 973 -21.351 -7.078 3.458 1.00 0.00 C ATOM 1183 CG MET A 973 -21.656 -8.080 2.352 1.00 0.00 C ATOM 1184 SD MET A 973 -23.388 -8.076 1.845 1.00 0.00 S ATOM 1185 CE MET A 973 -24.185 -8.712 3.318 1.00 0.00 C ATOM 0 H MET A 973 -23.142 -4.921 1.900 1.00 0.00 H new ATOM 0 HA MET A 973 -21.155 -4.972 3.842 1.00 0.00 H new ATOM 0 HB2 MET A 973 -20.326 -7.229 3.798 1.00 0.00 H new ATOM 0 HB3 MET A 973 -22.002 -7.282 4.308 1.00 0.00 H new ATOM 0 HG2 MET A 973 -21.031 -7.858 1.487 1.00 0.00 H new ATOM 0 HG3 MET A 973 -21.386 -9.080 2.692 1.00 0.00 H new ATOM 0 HE1 MET A 973 -24.625 -9.686 3.102 1.00 0.00 H new ATOM 0 HE2 MET A 973 -23.448 -8.815 4.115 1.00 0.00 H new ATOM 0 HE3 MET A 973 -24.967 -8.022 3.635 1.00 0.00 H new ATOM 1195 N VAL A 974 -19.489 -4.851 1.931 1.00 0.00 N ATOM 1196 CA VAL A 974 -18.639 -4.560 0.781 1.00 0.00 C ATOM 1197 C VAL A 974 -17.738 -5.739 0.451 1.00 0.00 C ATOM 1198 O VAL A 974 -17.035 -6.267 1.314 1.00 0.00 O ATOM 1199 CB VAL A 974 -17.757 -3.307 1.000 1.00 0.00 C ATOM 1200 CG1 VAL A 974 -16.708 -3.551 2.078 1.00 0.00 C ATOM 1201 CG2 VAL A 974 -17.084 -2.905 -0.304 1.00 0.00 C ATOM 0 H VAL A 974 -19.065 -4.651 2.837 1.00 0.00 H new ATOM 0 HA VAL A 974 -19.316 -4.367 -0.051 1.00 0.00 H new ATOM 0 HB VAL A 974 -18.403 -2.495 1.335 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -16.105 -2.653 2.208 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -17.202 -3.796 3.018 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -16.066 -4.379 1.780 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -16.466 -2.022 -0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -16.458 -3.724 -0.658 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -17.845 -2.680 -1.052 1.00 0.00 H new ATOM 1211 N HIS A 975 -17.754 -6.136 -0.811 1.00 0.00 N ATOM 1212 CA HIS A 975 -16.928 -7.236 -1.273 1.00 0.00 C ATOM 1213 C HIS A 975 -15.740 -6.707 -2.062 1.00 0.00 C ATOM 1214 O HIS A 975 -15.902 -6.062 -3.101 1.00 0.00 O ATOM 1215 CB HIS A 975 -17.750 -8.201 -2.127 1.00 0.00 C ATOM 1216 CG HIS A 975 -18.718 -7.518 -3.038 1.00 0.00 C ATOM 1217 ND1 HIS A 975 -19.829 -6.837 -2.587 1.00 0.00 N ATOM 1218 CD2 HIS A 975 -18.734 -7.406 -4.383 1.00 0.00 C ATOM 1219 CE1 HIS A 975 -20.486 -6.341 -3.618 1.00 0.00 C ATOM 1220 NE2 HIS A 975 -19.843 -6.671 -4.720 1.00 0.00 N ATOM 0 H HIS A 975 -18.333 -5.710 -1.535 1.00 0.00 H new ATOM 0 HA HIS A 975 -16.555 -7.779 -0.405 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -17.073 -8.813 -2.723 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -18.297 -8.878 -1.471 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -18.008 -7.819 -5.068 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -21.397 -5.762 -3.567 1.00 0.00 H new ATOM 0 HE2 HIS A 975 -20.124 -6.421 -5.668 1.00 0.00 H new ATOM 1229 N VAL A 976 -14.545 -6.981 -1.557 1.00 0.00 N ATOM 1230 CA VAL A 976 -13.325 -6.541 -2.198 1.00 0.00 C ATOM 1231 C VAL A 976 -13.077 -7.316 -3.486 1.00 0.00 C ATOM 1232 O VAL A 976 -13.342 -8.515 -3.560 1.00 0.00 O ATOM 1233 CB VAL A 976 -12.131 -6.710 -1.254 1.00 0.00 C ATOM 1234 CG1 VAL A 976 -12.277 -5.803 -0.040 1.00 0.00 C ATOM 1235 CG2 VAL A 976 -12.009 -8.158 -0.835 1.00 0.00 C ATOM 0 H VAL A 976 -14.400 -7.511 -0.698 1.00 0.00 H new ATOM 0 HA VAL A 976 -13.438 -5.485 -2.443 1.00 0.00 H new ATOM 0 HB VAL A 976 -11.220 -6.422 -1.779 1.00 0.00 H new ATOM 0 HG11 VAL A 976 -11.419 -5.937 0.619 1.00 0.00 H new ATOM 0 HG12 VAL A 976 -12.326 -4.764 -0.366 1.00 0.00 H new ATOM 0 HG13 VAL A 976 -13.191 -6.058 0.497 1.00 0.00 H new ATOM 0 HG21 VAL A 976 -11.158 -8.272 -0.164 1.00 0.00 H new ATOM 0 HG22 VAL A 976 -12.920 -8.466 -0.322 1.00 0.00 H new ATOM 0 HG23 VAL A 976 -11.861 -8.781 -1.717 1.00 0.00 H new ATOM 1245 N ILE A 977 -12.572 -6.625 -4.500 1.00 0.00 N ATOM 1246 CA ILE A 977 -12.295 -7.256 -5.783 1.00 0.00 C ATOM 1247 C ILE A 977 -11.042 -8.116 -5.689 1.00 0.00 C ATOM 1248 O ILE A 977 -10.961 -9.190 -6.287 1.00 0.00 O ATOM 1249 CB ILE A 977 -12.110 -6.210 -6.899 1.00 0.00 C ATOM 1250 CG1 ILE A 977 -13.230 -5.163 -6.847 1.00 0.00 C ATOM 1251 CG2 ILE A 977 -12.077 -6.891 -8.258 1.00 0.00 C ATOM 1252 CD1 ILE A 977 -14.625 -5.740 -6.957 1.00 0.00 C ATOM 0 H ILE A 977 -12.347 -5.631 -4.459 1.00 0.00 H new ATOM 0 HA ILE A 977 -13.153 -7.880 -6.032 1.00 0.00 H new ATOM 0 HB ILE A 977 -11.159 -5.700 -6.743 1.00 0.00 H new ATOM 0 HG12 ILE A 977 -13.151 -4.609 -5.912 1.00 0.00 H new ATOM 0 HG13 ILE A 977 -13.080 -4.447 -7.655 1.00 0.00 H new ATOM 0 HG21 ILE A 977 -11.946 -6.141 -9.038 1.00 0.00 H new ATOM 0 HG22 ILE A 977 -11.248 -7.597 -8.291 1.00 0.00 H new ATOM 0 HG23 ILE A 977 -13.014 -7.424 -8.421 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -15.357 -4.934 -6.912 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -14.726 -6.269 -7.905 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -14.798 -6.434 -6.134 1.00 0.00 H new ATOM 1264 N THR A 978 -10.071 -7.637 -4.920 1.00 0.00 N ATOM 1265 CA THR A 978 -8.817 -8.351 -4.717 1.00 0.00 C ATOM 1266 C THR A 978 -8.315 -8.138 -3.294 1.00 0.00 C ATOM 1267 O THR A 978 -7.948 -9.086 -2.601 1.00 0.00 O ATOM 1268 CB THR A 978 -7.732 -7.890 -5.708 1.00 0.00 C ATOM 1269 OG1 THR A 978 -7.506 -6.482 -5.571 1.00 0.00 O ATOM 1270 CG2 THR A 978 -8.132 -8.208 -7.141 1.00 0.00 C ATOM 0 H THR A 978 -10.130 -6.748 -4.423 1.00 0.00 H new ATOM 0 HA THR A 978 -9.014 -9.409 -4.889 1.00 0.00 H new ATOM 0 HB THR A 978 -6.813 -8.429 -5.478 1.00 0.00 H new ATOM 0 HG1 THR A 978 -6.814 -6.199 -6.204 1.00 0.00 H new ATOM 0 HG21 THR A 978 -7.349 -7.872 -7.820 1.00 0.00 H new ATOM 0 HG22 THR A 978 -8.270 -9.284 -7.250 1.00 0.00 H new ATOM 0 HG23 THR A 978 -9.064 -7.696 -7.381 1.00 0.00 H new ATOM 1278 N ASP A 979 -8.316 -6.880 -2.866 1.00 0.00 N ATOM 1279 CA ASP A 979 -7.878 -6.518 -1.524 1.00 0.00 C ATOM 1280 C ASP A 979 -8.438 -5.142 -1.156 1.00 0.00 C ATOM 1281 O ASP A 979 -9.595 -4.843 -1.452 1.00 0.00 O ATOM 1282 CB ASP A 979 -6.347 -6.525 -1.448 1.00 0.00 C ATOM 1283 CG ASP A 979 -5.828 -6.459 -0.024 1.00 0.00 C ATOM 1284 OD1 ASP A 979 -6.657 -6.425 0.911 1.00 0.00 O ATOM 1285 OD2 ASP A 979 -4.592 -6.444 0.157 1.00 0.00 O ATOM 0 H ASP A 979 -8.618 -6.089 -3.435 1.00 0.00 H new ATOM 0 HA ASP A 979 -8.254 -7.250 -0.809 1.00 0.00 H new ATOM 0 HB2 ASP A 979 -5.968 -7.428 -1.926 1.00 0.00 H new ATOM 0 HB3 ASP A 979 -5.956 -5.678 -2.012 1.00 0.00 H new ATOM 1290 N ILE A 980 -7.616 -4.301 -0.532 1.00 0.00 N ATOM 1291 CA ILE A 980 -8.042 -2.957 -0.155 1.00 0.00 C ATOM 1292 C ILE A 980 -6.865 -1.991 -0.134 1.00 0.00 C ATOM 1293 O ILE A 980 -6.806 -1.080 0.693 1.00 0.00 O ATOM 1294 CB ILE A 980 -8.747 -2.931 1.216 1.00 0.00 C ATOM 1295 CG1 ILE A 980 -7.958 -3.739 2.247 1.00 0.00 C ATOM 1296 CG2 ILE A 980 -10.171 -3.451 1.093 1.00 0.00 C ATOM 1297 CD1 ILE A 980 -8.617 -3.781 3.609 1.00 0.00 C ATOM 0 H ILE A 980 -6.654 -4.526 -0.278 1.00 0.00 H new ATOM 0 HA ILE A 980 -8.757 -2.640 -0.914 1.00 0.00 H new ATOM 0 HB ILE A 980 -8.790 -1.898 1.561 1.00 0.00 H new ATOM 0 HG12 ILE A 980 -7.833 -4.758 1.881 1.00 0.00 H new ATOM 0 HG13 ILE A 980 -6.960 -3.311 2.347 1.00 0.00 H new ATOM 0 HG21 ILE A 980 -10.653 -3.425 2.070 1.00 0.00 H new ATOM 0 HG22 ILE A 980 -10.728 -2.824 0.397 1.00 0.00 H new ATOM 0 HG23 ILE A 980 -10.153 -4.476 0.724 1.00 0.00 H new ATOM 0 HD11 ILE A 980 -8.005 -4.370 4.292 1.00 0.00 H new ATOM 0 HD12 ILE A 980 -8.718 -2.767 3.996 1.00 0.00 H new ATOM 0 HD13 ILE A 980 -9.604 -4.236 3.522 1.00 0.00 H new ATOM 1309 N GLN A 981 -5.942 -2.185 -1.067 1.00 0.00 N ATOM 1310 CA GLN A 981 -4.775 -1.322 -1.185 1.00 0.00 C ATOM 1311 C GLN A 981 -5.174 -0.005 -1.835 1.00 0.00 C ATOM 1312 O GLN A 981 -6.267 0.102 -2.389 1.00 0.00 O ATOM 1313 CB GLN A 981 -3.688 -2.002 -2.021 1.00 0.00 C ATOM 1314 CG GLN A 981 -3.158 -3.295 -1.420 1.00 0.00 C ATOM 1315 CD GLN A 981 -2.425 -3.077 -0.112 1.00 0.00 C ATOM 1316 OE1 GLN A 981 -3.008 -2.622 0.866 1.00 0.00 O ATOM 1317 NE2 GLN A 981 -1.138 -3.400 -0.094 1.00 0.00 N ATOM 0 H GLN A 981 -5.980 -2.936 -1.756 1.00 0.00 H new ATOM 0 HA GLN A 981 -4.380 -1.130 -0.187 1.00 0.00 H new ATOM 0 HB2 GLN A 981 -4.087 -2.212 -3.013 1.00 0.00 H new ATOM 0 HB3 GLN A 981 -2.858 -1.308 -2.151 1.00 0.00 H new ATOM 0 HG2 GLN A 981 -3.989 -3.981 -1.256 1.00 0.00 H new ATOM 0 HG3 GLN A 981 -2.486 -3.773 -2.133 1.00 0.00 H new ATOM 0 HE21 GLN A 981 -0.695 -3.776 -0.932 1.00 0.00 H new ATOM 0 HE22 GLN A 981 -0.592 -3.273 0.758 1.00 0.00 H new ATOM 1326 N VAL A 982 -4.292 0.991 -1.768 1.00 0.00 N ATOM 1327 CA VAL A 982 -4.555 2.296 -2.364 1.00 0.00 C ATOM 1328 C VAL A 982 -4.681 2.226 -3.892 1.00 0.00 C ATOM 1329 O VAL A 982 -4.374 3.191 -4.591 1.00 0.00 O ATOM 1330 CB VAL A 982 -3.447 3.291 -2.003 1.00 0.00 C ATOM 1331 CG1 VAL A 982 -3.515 3.653 -0.529 1.00 0.00 C ATOM 1332 CG2 VAL A 982 -2.091 2.713 -2.363 1.00 0.00 C ATOM 0 H VAL A 982 -3.386 0.917 -1.305 1.00 0.00 H new ATOM 0 HA VAL A 982 -5.508 2.634 -1.956 1.00 0.00 H new ATOM 0 HB VAL A 982 -3.592 4.206 -2.577 1.00 0.00 H new ATOM 0 HG11 VAL A 982 -2.721 4.360 -0.291 1.00 0.00 H new ATOM 0 HG12 VAL A 982 -4.482 4.106 -0.310 1.00 0.00 H new ATOM 0 HG13 VAL A 982 -3.391 2.753 0.073 1.00 0.00 H new ATOM 0 HG21 VAL A 982 -1.310 3.428 -2.103 1.00 0.00 H new ATOM 0 HG22 VAL A 982 -1.933 1.786 -1.812 1.00 0.00 H new ATOM 0 HG23 VAL A 982 -2.055 2.510 -3.433 1.00 0.00 H new ATOM 1342 N GLY A 983 -5.140 1.088 -4.398 1.00 0.00 N ATOM 1343 CA GLY A 983 -5.310 0.909 -5.826 1.00 0.00 C ATOM 1344 C GLY A 983 -6.422 -0.075 -6.135 1.00 0.00 C ATOM 1345 O GLY A 983 -7.029 -0.024 -7.204 1.00 0.00 O ATOM 0 H GLY A 983 -5.400 0.277 -3.836 1.00 0.00 H new ATOM 0 HA2 GLY A 983 -5.534 1.870 -6.290 1.00 0.00 H new ATOM 0 HA3 GLY A 983 -4.377 0.554 -6.263 1.00 0.00 H new ATOM 1349 N SER A 984 -6.686 -0.972 -5.188 1.00 0.00 N ATOM 1350 CA SER A 984 -7.731 -1.978 -5.347 1.00 0.00 C ATOM 1351 C SER A 984 -9.119 -1.370 -5.154 1.00 0.00 C ATOM 1352 O SER A 984 -9.342 -0.576 -4.240 1.00 0.00 O ATOM 1353 CB SER A 984 -7.520 -3.123 -4.355 1.00 0.00 C ATOM 1354 OG SER A 984 -8.531 -4.106 -4.488 1.00 0.00 O ATOM 0 H SER A 984 -6.188 -1.022 -4.299 1.00 0.00 H new ATOM 0 HA SER A 984 -7.668 -2.368 -6.363 1.00 0.00 H new ATOM 0 HB2 SER A 984 -6.543 -3.577 -4.521 1.00 0.00 H new ATOM 0 HB3 SER A 984 -7.521 -2.732 -3.338 1.00 0.00 H new ATOM 0 HG SER A 984 -8.156 -4.905 -4.913 1.00 0.00 H new ATOM 1360 N ARG A 985 -10.046 -1.752 -6.028 1.00 0.00 N ATOM 1361 CA ARG A 985 -11.418 -1.258 -5.974 1.00 0.00 C ATOM 1362 C ARG A 985 -12.286 -2.156 -5.092 1.00 0.00 C ATOM 1363 O ARG A 985 -11.956 -3.319 -4.865 1.00 0.00 O ATOM 1364 CB ARG A 985 -12.003 -1.192 -7.386 1.00 0.00 C ATOM 1365 CG ARG A 985 -13.344 -0.484 -7.468 1.00 0.00 C ATOM 1366 CD ARG A 985 -13.897 -0.519 -8.883 1.00 0.00 C ATOM 1367 NE ARG A 985 -15.071 0.334 -9.041 1.00 0.00 N ATOM 1368 CZ ARG A 985 -15.706 0.504 -10.197 1.00 0.00 C ATOM 1369 NH1 ARG A 985 -15.293 -0.132 -11.285 1.00 0.00 N ATOM 1370 NH2 ARG A 985 -16.757 1.310 -10.267 1.00 0.00 N ATOM 0 H ARG A 985 -9.869 -2.408 -6.789 1.00 0.00 H new ATOM 0 HA ARG A 985 -11.407 -0.258 -5.540 1.00 0.00 H new ATOM 0 HB2 ARG A 985 -11.294 -0.682 -8.038 1.00 0.00 H new ATOM 0 HB3 ARG A 985 -12.115 -2.206 -7.769 1.00 0.00 H new ATOM 0 HG2 ARG A 985 -14.051 -0.958 -6.787 1.00 0.00 H new ATOM 0 HG3 ARG A 985 -13.233 0.551 -7.143 1.00 0.00 H new ATOM 0 HD2 ARG A 985 -13.123 -0.201 -9.581 1.00 0.00 H new ATOM 0 HD3 ARG A 985 -14.158 -1.545 -9.143 1.00 0.00 H new ATOM 0 HE ARG A 985 -15.423 0.826 -8.220 1.00 0.00 H new ATOM 0 HH11 ARG A 985 -14.486 -0.754 -11.237 1.00 0.00 H new ATOM 0 HH12 ARG A 985 -15.782 0.001 -12.170 1.00 0.00 H new ATOM 0 HH21 ARG A 985 -17.080 1.801 -9.433 1.00 0.00 H new ATOM 0 HH22 ARG A 985 -17.243 1.439 -11.155 1.00 0.00 H new ATOM 1384 N ILE A 986 -13.400 -1.612 -4.605 1.00 0.00 N ATOM 1385 CA ILE A 986 -14.316 -2.374 -3.759 1.00 0.00 C ATOM 1386 C ILE A 986 -15.768 -2.107 -4.145 1.00 0.00 C ATOM 1387 O ILE A 986 -16.195 -0.957 -4.243 1.00 0.00 O ATOM 1388 CB ILE A 986 -14.135 -2.034 -2.267 1.00 0.00 C ATOM 1389 CG1 ILE A 986 -14.425 -0.553 -2.016 1.00 0.00 C ATOM 1390 CG2 ILE A 986 -12.729 -2.395 -1.810 1.00 0.00 C ATOM 1391 CD1 ILE A 986 -14.492 -0.183 -0.552 1.00 0.00 C ATOM 0 H ILE A 986 -13.689 -0.650 -4.781 1.00 0.00 H new ATOM 0 HA ILE A 986 -14.078 -3.426 -3.915 1.00 0.00 H new ATOM 0 HB ILE A 986 -14.846 -2.622 -1.686 1.00 0.00 H new ATOM 0 HG12 ILE A 986 -13.651 0.046 -2.497 1.00 0.00 H new ATOM 0 HG13 ILE A 986 -15.371 -0.292 -2.491 1.00 0.00 H new ATOM 0 HG21 ILE A 986 -12.615 -2.149 -0.754 1.00 0.00 H new ATOM 0 HG22 ILE A 986 -12.562 -3.462 -1.954 1.00 0.00 H new ATOM 0 HG23 ILE A 986 -12.001 -1.832 -2.394 1.00 0.00 H new ATOM 0 HD11 ILE A 986 -14.701 0.882 -0.455 1.00 0.00 H new ATOM 0 HD12 ILE A 986 -15.285 -0.754 -0.068 1.00 0.00 H new ATOM 0 HD13 ILE A 986 -13.539 -0.411 -0.075 1.00 0.00 H new ATOM 1403 N THR A 987 -16.527 -3.177 -4.355 1.00 0.00 N ATOM 1404 CA THR A 987 -17.932 -3.051 -4.716 1.00 0.00 C ATOM 1405 C THR A 987 -18.832 -3.393 -3.536 1.00 0.00 C ATOM 1406 O THR A 987 -18.556 -4.325 -2.783 1.00 0.00 O ATOM 1407 CB THR A 987 -18.299 -3.935 -5.919 1.00 0.00 C ATOM 1408 OG1 THR A 987 -17.618 -5.191 -5.838 1.00 0.00 O ATOM 1409 CG2 THR A 987 -17.951 -3.237 -7.221 1.00 0.00 C ATOM 0 H THR A 987 -16.193 -4.138 -4.281 1.00 0.00 H new ATOM 0 HA THR A 987 -18.091 -2.010 -4.998 1.00 0.00 H new ATOM 0 HB THR A 987 -19.374 -4.114 -5.898 1.00 0.00 H new ATOM 0 HG1 THR A 987 -17.861 -5.745 -6.609 1.00 0.00 H new ATOM 0 HG21 THR A 987 -18.218 -3.879 -8.061 1.00 0.00 H new ATOM 0 HG22 THR A 987 -18.503 -2.300 -7.290 1.00 0.00 H new ATOM 0 HG23 THR A 987 -16.881 -3.030 -7.248 1.00 0.00 H new ATOM 1417 N TYR A 988 -19.898 -2.621 -3.375 1.00 0.00 N ATOM 1418 CA TYR A 988 -20.836 -2.832 -2.275 1.00 0.00 C ATOM 1419 C TYR A 988 -22.121 -3.501 -2.751 1.00 0.00 C ATOM 1420 O TYR A 988 -22.579 -3.266 -3.869 1.00 0.00 O ATOM 1421 CB TYR A 988 -21.180 -1.505 -1.595 1.00 0.00 C ATOM 1422 CG TYR A 988 -19.994 -0.788 -0.990 1.00 0.00 C ATOM 1423 CD1 TYR A 988 -18.981 -0.273 -1.790 1.00 0.00 C ATOM 1424 CD2 TYR A 988 -19.898 -0.608 0.384 1.00 0.00 C ATOM 1425 CE1 TYR A 988 -17.905 0.396 -1.236 1.00 0.00 C ATOM 1426 CE2 TYR A 988 -18.828 0.060 0.944 1.00 0.00 C ATOM 1427 CZ TYR A 988 -17.834 0.559 0.131 1.00 0.00 C ATOM 1428 OH TYR A 988 -16.769 1.229 0.686 1.00 0.00 O ATOM 0 H TYR A 988 -20.137 -1.843 -3.990 1.00 0.00 H new ATOM 0 HA TYR A 988 -20.346 -3.492 -1.560 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -21.653 -0.848 -2.325 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -21.915 -1.692 -0.812 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -19.035 -0.397 -2.861 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -20.675 -0.998 1.026 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -17.125 0.789 -1.871 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -18.770 0.191 2.014 1.00 0.00 H new ATOM 0 HH TYR A 988 -16.979 2.184 0.746 1.00 0.00 H new ATOM 1438 N SER A 989 -22.706 -4.323 -1.884 1.00 0.00 N ATOM 1439 CA SER A 989 -23.952 -5.013 -2.201 1.00 0.00 C ATOM 1440 C SER A 989 -24.725 -5.331 -0.926 1.00 0.00 C ATOM 1441 O SER A 989 -24.203 -5.975 -0.018 1.00 0.00 O ATOM 1442 CB SER A 989 -23.677 -6.302 -2.975 1.00 0.00 C ATOM 1443 OG SER A 989 -24.883 -6.978 -3.288 1.00 0.00 O ATOM 0 H SER A 989 -22.336 -4.527 -0.956 1.00 0.00 H new ATOM 0 HA SER A 989 -24.553 -4.352 -2.825 1.00 0.00 H new ATOM 0 HB2 SER A 989 -23.138 -6.070 -3.894 1.00 0.00 H new ATOM 0 HB3 SER A 989 -23.034 -6.954 -2.384 1.00 0.00 H new ATOM 0 HG SER A 989 -24.679 -7.798 -3.784 1.00 0.00 H new ATOM 1449 N CYS A 990 -25.969 -4.871 -0.867 1.00 0.00 N ATOM 1450 CA CYS A 990 -26.816 -5.103 0.297 1.00 0.00 C ATOM 1451 C CYS A 990 -27.280 -6.558 0.360 1.00 0.00 C ATOM 1452 O CYS A 990 -26.462 -7.474 0.451 1.00 0.00 O ATOM 1453 CB CYS A 990 -28.013 -4.151 0.279 1.00 0.00 C ATOM 1454 SG CYS A 990 -27.563 -2.398 0.477 1.00 0.00 S ATOM 0 H CYS A 990 -26.414 -4.335 -1.612 1.00 0.00 H new ATOM 0 HA CYS A 990 -26.227 -4.904 1.193 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -28.549 -4.274 -0.662 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -28.701 -4.432 1.077 1.00 0.00 H new ATOM 1459 N THR A 991 -28.592 -6.764 0.320 1.00 0.00 N ATOM 1460 CA THR A 991 -29.163 -8.102 0.383 1.00 0.00 C ATOM 1461 C THR A 991 -30.651 -8.066 0.061 1.00 0.00 C ATOM 1462 O THR A 991 -31.287 -7.019 0.167 1.00 0.00 O ATOM 1463 CB THR A 991 -28.962 -8.738 1.770 1.00 0.00 C ATOM 1464 OG1 THR A 991 -29.548 -10.044 1.802 1.00 0.00 O ATOM 1465 CG2 THR A 991 -29.581 -7.872 2.859 1.00 0.00 C ATOM 0 H THR A 991 -29.282 -6.017 0.244 1.00 0.00 H new ATOM 0 HA THR A 991 -28.642 -8.709 -0.358 1.00 0.00 H new ATOM 0 HB THR A 991 -27.891 -8.817 1.955 1.00 0.00 H new ATOM 0 HG1 THR A 991 -29.414 -10.441 2.688 1.00 0.00 H new ATOM 0 HG21 THR A 991 -29.426 -8.342 3.830 1.00 0.00 H new ATOM 0 HG22 THR A 991 -29.111 -6.889 2.853 1.00 0.00 H new ATOM 0 HG23 THR A 991 -30.650 -7.764 2.675 1.00 0.00 H new ATOM 1473 N THR A 992 -31.193 -9.212 -0.339 1.00 0.00 N ATOM 1474 CA THR A 992 -32.608 -9.316 -0.687 1.00 0.00 C ATOM 1475 C THR A 992 -33.497 -8.780 0.433 1.00 0.00 C ATOM 1476 O THR A 992 -33.976 -9.538 1.278 1.00 0.00 O ATOM 1477 CB THR A 992 -33.004 -10.774 -0.993 1.00 0.00 C ATOM 1478 OG1 THR A 992 -32.172 -11.299 -2.034 1.00 0.00 O ATOM 1479 CG2 THR A 992 -34.463 -10.865 -1.413 1.00 0.00 C ATOM 0 H THR A 992 -30.673 -10.085 -0.431 1.00 0.00 H new ATOM 0 HA THR A 992 -32.758 -8.711 -1.581 1.00 0.00 H new ATOM 0 HB THR A 992 -32.867 -11.361 -0.085 1.00 0.00 H new ATOM 0 HG1 THR A 992 -32.428 -12.226 -2.222 1.00 0.00 H new ATOM 0 HG21 THR A 992 -34.717 -11.904 -1.623 1.00 0.00 H new ATOM 0 HG22 THR A 992 -35.097 -10.492 -0.609 1.00 0.00 H new ATOM 0 HG23 THR A 992 -34.622 -10.264 -2.309 1.00 0.00 H new ATOM 1487 N GLY A 993 -33.711 -7.467 0.434 1.00 0.00 N ATOM 1488 CA GLY A 993 -34.536 -6.847 1.452 1.00 0.00 C ATOM 1489 C GLY A 993 -34.431 -5.333 1.441 1.00 0.00 C ATOM 1490 O GLY A 993 -35.435 -4.634 1.580 1.00 0.00 O ATOM 0 H GLY A 993 -33.326 -6.821 -0.255 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -35.576 -7.137 1.299 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -34.241 -7.222 2.432 1.00 0.00 H new ATOM 1494 N HIS A 994 -33.211 -4.828 1.281 1.00 0.00 N ATOM 1495 CA HIS A 994 -32.973 -3.391 1.259 1.00 0.00 C ATOM 1496 C HIS A 994 -32.215 -2.988 -0.003 1.00 0.00 C ATOM 1497 O HIS A 994 -31.327 -3.707 -0.463 1.00 0.00 O ATOM 1498 CB HIS A 994 -32.174 -2.972 2.497 1.00 0.00 C ATOM 1499 CG HIS A 994 -32.786 -3.419 3.789 1.00 0.00 C ATOM 1500 ND1 HIS A 994 -33.006 -4.746 4.097 1.00 0.00 N ATOM 1501 CD2 HIS A 994 -33.219 -2.710 4.858 1.00 0.00 C ATOM 1502 CE1 HIS A 994 -33.548 -4.832 5.299 1.00 0.00 C ATOM 1503 NE2 HIS A 994 -33.687 -3.612 5.781 1.00 0.00 N ATOM 0 H HIS A 994 -32.371 -5.395 1.165 1.00 0.00 H new ATOM 0 HA HIS A 994 -33.938 -2.884 1.263 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -31.166 -3.380 2.423 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -32.079 -1.886 2.507 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -33.200 -1.635 4.965 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -33.829 -5.746 5.801 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -34.079 -3.377 6.693 1.00 0.00 H new ATOM 1512 N ARG A 995 -32.571 -1.835 -0.554 1.00 0.00 N ATOM 1513 CA ARG A 995 -31.930 -1.326 -1.760 1.00 0.00 C ATOM 1514 C ARG A 995 -30.758 -0.421 -1.403 1.00 0.00 C ATOM 1515 O ARG A 995 -30.800 0.293 -0.406 1.00 0.00 O ATOM 1516 CB ARG A 995 -32.937 -0.548 -2.610 1.00 0.00 C ATOM 1517 CG ARG A 995 -33.534 0.652 -1.893 1.00 0.00 C ATOM 1518 CD ARG A 995 -34.494 1.418 -2.790 1.00 0.00 C ATOM 1519 NE ARG A 995 -35.045 2.595 -2.122 1.00 0.00 N ATOM 1520 CZ ARG A 995 -35.901 3.435 -2.695 1.00 0.00 C ATOM 1521 NH1 ARG A 995 -36.307 3.227 -3.940 1.00 0.00 N ATOM 1522 NH2 ARG A 995 -36.354 4.484 -2.022 1.00 0.00 N ATOM 0 H ARG A 995 -33.304 -1.231 -0.183 1.00 0.00 H new ATOM 0 HA ARG A 995 -31.559 -2.177 -2.332 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -32.446 -0.209 -3.522 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -33.742 -1.219 -2.911 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -34.059 0.318 -0.998 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -32.734 1.315 -1.564 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -33.975 1.726 -3.698 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -35.308 0.760 -3.096 1.00 0.00 H new ATOM 0 HE ARG A 995 -34.756 2.783 -1.162 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -35.962 2.421 -4.461 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -36.964 3.873 -4.377 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -36.046 4.647 -1.064 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -37.011 5.128 -2.463 1.00 0.00 H new ATOM 1536 N LEU A 996 -29.712 -0.459 -2.220 1.00 0.00 N ATOM 1537 CA LEU A 996 -28.532 0.366 -1.988 1.00 0.00 C ATOM 1538 C LEU A 996 -28.830 1.831 -2.306 1.00 0.00 C ATOM 1539 O LEU A 996 -29.433 2.141 -3.334 1.00 0.00 O ATOM 1540 CB LEU A 996 -27.359 -0.140 -2.834 1.00 0.00 C ATOM 1541 CG LEU A 996 -26.018 0.549 -2.586 1.00 0.00 C ATOM 1542 CD1 LEU A 996 -24.866 -0.356 -2.994 1.00 0.00 C ATOM 1543 CD2 LEU A 996 -25.959 1.861 -3.336 1.00 0.00 C ATOM 0 H LEU A 996 -29.657 -1.052 -3.048 1.00 0.00 H new ATOM 0 HA LEU A 996 -28.259 0.294 -0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -27.237 -1.208 -2.652 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -27.617 -0.024 -3.887 1.00 0.00 H new ATOM 0 HG LEU A 996 -25.925 0.755 -1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -23.920 0.153 -2.809 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -24.902 -1.276 -2.411 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -24.949 -0.595 -4.054 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -24.999 2.343 -3.151 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -26.072 1.675 -4.404 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -26.763 2.512 -2.994 1.00 0.00 H new ATOM 1555 N ILE A 997 -28.391 2.728 -1.427 1.00 0.00 N ATOM 1556 CA ILE A 997 -28.597 4.159 -1.622 1.00 0.00 C ATOM 1557 C ILE A 997 -27.272 4.909 -1.529 1.00 0.00 C ATOM 1558 O ILE A 997 -26.433 4.600 -0.684 1.00 0.00 O ATOM 1559 CB ILE A 997 -29.592 4.746 -0.597 1.00 0.00 C ATOM 1560 CG1 ILE A 997 -31.005 4.243 -0.863 1.00 0.00 C ATOM 1561 CG2 ILE A 997 -29.572 6.259 -0.613 1.00 0.00 C ATOM 1562 CD1 ILE A 997 -31.333 2.986 -0.108 1.00 0.00 C ATOM 0 H ILE A 997 -27.890 2.488 -0.572 1.00 0.00 H new ATOM 0 HA ILE A 997 -29.021 4.286 -2.618 1.00 0.00 H new ATOM 0 HB ILE A 997 -29.278 4.409 0.391 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -31.719 5.020 -0.591 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -31.125 4.060 -1.931 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -30.283 6.640 0.120 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -28.571 6.612 -0.365 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -29.847 6.616 -1.605 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -32.353 2.678 -0.339 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -30.641 2.196 -0.399 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -31.244 3.171 0.963 1.00 0.00 H new ATOM 1574 N GLY A 998 -27.088 5.890 -2.405 1.00 0.00 N ATOM 1575 CA GLY A 998 -25.858 6.657 -2.404 1.00 0.00 C ATOM 1576 C GLY A 998 -24.929 6.265 -3.535 1.00 0.00 C ATOM 1577 O GLY A 998 -25.312 6.306 -4.704 1.00 0.00 O ATOM 0 H GLY A 998 -27.767 6.167 -3.114 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -26.095 7.718 -2.484 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -25.346 6.516 -1.452 1.00 0.00 H new ATOM 1581 N HIS A 999 -23.702 5.892 -3.186 1.00 0.00 N ATOM 1582 CA HIS A 999 -22.711 5.499 -4.181 1.00 0.00 C ATOM 1583 C HIS A 999 -22.944 4.053 -4.632 1.00 0.00 C ATOM 1584 O HIS A 999 -24.084 3.658 -4.877 1.00 0.00 O ATOM 1585 CB HIS A 999 -21.306 5.678 -3.605 1.00 0.00 C ATOM 1586 CG HIS A 999 -20.247 5.825 -4.647 1.00 0.00 C ATOM 1587 ND1 HIS A 999 -20.265 6.818 -5.605 1.00 0.00 N ATOM 1588 CD2 HIS A 999 -19.128 5.105 -4.876 1.00 0.00 C ATOM 1589 CE1 HIS A 999 -19.202 6.700 -6.378 1.00 0.00 C ATOM 1590 NE2 HIS A 999 -18.494 5.668 -5.956 1.00 0.00 N ATOM 0 H HIS A 999 -23.370 5.854 -2.222 1.00 0.00 H new ATOM 0 HA HIS A 999 -22.811 6.138 -5.058 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -21.296 6.558 -2.962 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -21.068 4.820 -2.976 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -18.794 4.246 -4.314 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -18.953 7.338 -7.213 1.00 0.00 H new ATOM 0 HE2 HIS A 999 -17.619 5.342 -6.366 1.00 0.00 H new ATOM 1599 N SER A1000 -21.870 3.263 -4.744 1.00 0.00 N ATOM 1600 CA SER A1000 -21.995 1.867 -5.170 1.00 0.00 C ATOM 1601 C SER A1000 -20.649 1.142 -5.148 1.00 0.00 C ATOM 1602 O SER A1000 -20.558 0.001 -4.697 1.00 0.00 O ATOM 1603 CB SER A1000 -22.594 1.794 -6.577 1.00 0.00 C ATOM 1604 OG SER A1000 -21.781 2.478 -7.514 1.00 0.00 O ATOM 0 H SER A1000 -20.915 3.563 -4.548 1.00 0.00 H new ATOM 0 HA SER A1000 -22.658 1.370 -4.462 1.00 0.00 H new ATOM 0 HB2 SER A1000 -22.701 0.751 -6.876 1.00 0.00 H new ATOM 0 HB3 SER A1000 -23.594 2.228 -6.573 1.00 0.00 H new ATOM 0 HG SER A1000 -22.185 2.415 -8.405 1.00 0.00 H new ATOM 1610 N SER A1001 -19.610 1.807 -5.646 1.00 0.00 N ATOM 1611 CA SER A1001 -18.271 1.220 -5.695 1.00 0.00 C ATOM 1612 C SER A1001 -17.209 2.313 -5.714 1.00 0.00 C ATOM 1613 O SER A1001 -17.392 3.351 -6.347 1.00 0.00 O ATOM 1614 CB SER A1001 -18.127 0.331 -6.931 1.00 0.00 C ATOM 1615 OG SER A1001 -18.385 1.062 -8.116 1.00 0.00 O ATOM 0 H SER A1001 -19.668 2.753 -6.022 1.00 0.00 H new ATOM 0 HA SER A1001 -18.130 0.611 -4.802 1.00 0.00 H new ATOM 0 HB2 SER A1001 -17.120 -0.085 -6.968 1.00 0.00 H new ATOM 0 HB3 SER A1001 -18.817 -0.510 -6.861 1.00 0.00 H new ATOM 0 HG SER A1001 -18.616 0.442 -8.839 1.00 0.00 H new ATOM 1621 N ALA A1002 -16.103 2.084 -5.013 1.00 0.00 N ATOM 1622 CA ALA A1002 -15.033 3.073 -4.949 1.00 0.00 C ATOM 1623 C ALA A1002 -13.664 2.424 -4.785 1.00 0.00 C ATOM 1624 O ALA A1002 -13.515 1.418 -4.094 1.00 0.00 O ATOM 1625 CB ALA A1002 -15.289 4.036 -3.801 1.00 0.00 C ATOM 0 H ALA A1002 -15.925 1.229 -4.485 1.00 0.00 H new ATOM 0 HA ALA A1002 -15.029 3.616 -5.894 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -14.487 4.772 -3.758 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -16.240 4.545 -3.958 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -15.324 3.482 -2.863 1.00 0.00 H new ATOM 1631 N GLU A1003 -12.667 3.022 -5.430 1.00 0.00 N ATOM 1632 CA GLU A1003 -11.299 2.526 -5.368 1.00 0.00 C ATOM 1633 C GLU A1003 -10.508 3.268 -4.300 1.00 0.00 C ATOM 1634 O GLU A1003 -10.608 4.490 -4.182 1.00 0.00 O ATOM 1635 CB GLU A1003 -10.609 2.707 -6.721 1.00 0.00 C ATOM 1636 CG GLU A1003 -9.191 2.164 -6.762 1.00 0.00 C ATOM 1637 CD GLU A1003 -8.546 2.325 -8.125 1.00 0.00 C ATOM 1638 OE1 GLU A1003 -9.088 1.775 -9.106 1.00 0.00 O ATOM 1639 OE2 GLU A1003 -7.500 3.001 -8.210 1.00 0.00 O ATOM 0 H GLU A1003 -12.784 3.856 -6.005 1.00 0.00 H new ATOM 0 HA GLU A1003 -11.334 1.466 -5.115 1.00 0.00 H new ATOM 0 HB2 GLU A1003 -11.201 2.210 -7.490 1.00 0.00 H new ATOM 0 HB3 GLU A1003 -10.589 3.768 -6.970 1.00 0.00 H new ATOM 0 HG2 GLU A1003 -8.587 2.678 -6.015 1.00 0.00 H new ATOM 0 HG3 GLU A1003 -9.202 1.108 -6.491 1.00 0.00 H new ATOM 1646 N CYS A1004 -9.703 2.536 -3.540 1.00 0.00 N ATOM 1647 CA CYS A1004 -8.882 3.154 -2.511 1.00 0.00 C ATOM 1648 C CYS A1004 -7.771 3.944 -3.183 1.00 0.00 C ATOM 1649 O CYS A1004 -7.095 3.432 -4.074 1.00 0.00 O ATOM 1650 CB CYS A1004 -8.301 2.089 -1.581 1.00 0.00 C ATOM 1651 SG CYS A1004 -7.379 2.753 -0.158 1.00 0.00 S ATOM 0 H CYS A1004 -9.602 1.524 -3.616 1.00 0.00 H new ATOM 0 HA CYS A1004 -9.492 3.826 -1.907 1.00 0.00 H new ATOM 0 HB2 CYS A1004 -9.114 1.464 -1.212 1.00 0.00 H new ATOM 0 HB3 CYS A1004 -7.639 1.443 -2.158 1.00 0.00 H new ATOM 1656 N ILE A1005 -7.603 5.198 -2.790 1.00 0.00 N ATOM 1657 CA ILE A1005 -6.589 6.042 -3.404 1.00 0.00 C ATOM 1658 C ILE A1005 -5.860 6.909 -2.393 1.00 0.00 C ATOM 1659 O ILE A1005 -6.439 7.369 -1.410 1.00 0.00 O ATOM 1660 CB ILE A1005 -7.203 6.948 -4.480 1.00 0.00 C ATOM 1661 CG1 ILE A1005 -8.364 7.748 -3.890 1.00 0.00 C ATOM 1662 CG2 ILE A1005 -7.659 6.111 -5.665 1.00 0.00 C ATOM 1663 CD1 ILE A1005 -8.980 8.731 -4.859 1.00 0.00 C ATOM 0 H ILE A1005 -8.149 5.650 -2.057 1.00 0.00 H new ATOM 0 HA ILE A1005 -5.867 5.362 -3.857 1.00 0.00 H new ATOM 0 HB ILE A1005 -6.450 7.653 -4.832 1.00 0.00 H new ATOM 0 HG12 ILE A1005 -9.134 7.056 -3.550 1.00 0.00 H new ATOM 0 HG13 ILE A1005 -8.011 8.289 -3.012 1.00 0.00 H new ATOM 0 HG21 ILE A1005 -8.094 6.761 -6.424 1.00 0.00 H new ATOM 0 HG22 ILE A1005 -6.805 5.581 -6.087 1.00 0.00 H new ATOM 0 HG23 ILE A1005 -8.406 5.389 -5.335 1.00 0.00 H new ATOM 0 HD11 ILE A1005 -9.797 9.261 -4.369 1.00 0.00 H new ATOM 0 HD12 ILE A1005 -8.224 9.447 -5.181 1.00 0.00 H new ATOM 0 HD13 ILE A1005 -9.364 8.194 -5.727 1.00 0.00 H new ATOM 1675 N LEU A1006 -4.584 7.138 -2.661 1.00 0.00 N ATOM 1676 CA LEU A1006 -3.755 7.966 -1.796 1.00 0.00 C ATOM 1677 C LEU A1006 -3.832 9.430 -2.220 1.00 0.00 C ATOM 1678 O LEU A1006 -3.789 9.743 -3.410 1.00 0.00 O ATOM 1679 CB LEU A1006 -2.300 7.495 -1.829 1.00 0.00 C ATOM 1680 CG LEU A1006 -1.350 8.290 -0.931 1.00 0.00 C ATOM 1681 CD1 LEU A1006 -1.742 8.136 0.530 1.00 0.00 C ATOM 1682 CD2 LEU A1006 0.091 7.846 -1.146 1.00 0.00 C ATOM 0 H LEU A1006 -4.097 6.761 -3.474 1.00 0.00 H new ATOM 0 HA LEU A1006 -4.133 7.872 -0.778 1.00 0.00 H new ATOM 0 HB2 LEU A1006 -2.265 6.446 -1.534 1.00 0.00 H new ATOM 0 HB3 LEU A1006 -1.938 7.549 -2.856 1.00 0.00 H new ATOM 0 HG LEU A1006 -1.428 9.343 -1.200 1.00 0.00 H new ATOM 0 HD11 LEU A1006 -1.055 8.708 1.153 1.00 0.00 H new ATOM 0 HD12 LEU A1006 -2.757 8.505 0.675 1.00 0.00 H new ATOM 0 HD13 LEU A1006 -1.695 7.084 0.810 1.00 0.00 H new ATOM 0 HD21 LEU A1006 0.750 8.424 -0.498 1.00 0.00 H new ATOM 0 HD22 LEU A1006 0.185 6.787 -0.907 1.00 0.00 H new ATOM 0 HD23 LEU A1006 0.371 8.010 -2.187 1.00 0.00 H new ATOM 1694 N SER A1007 -3.941 10.320 -1.242 1.00 0.00 N ATOM 1695 CA SER A1007 -4.017 11.751 -1.518 1.00 0.00 C ATOM 1696 C SER A1007 -2.619 12.357 -1.567 1.00 0.00 C ATOM 1697 O SER A1007 -2.326 13.211 -2.405 1.00 0.00 O ATOM 1698 CB SER A1007 -4.850 12.453 -0.445 1.00 0.00 C ATOM 1699 OG SER A1007 -4.228 12.362 0.825 1.00 0.00 O ATOM 0 H SER A1007 -3.979 10.078 -0.252 1.00 0.00 H new ATOM 0 HA SER A1007 -4.496 11.891 -2.487 1.00 0.00 H new ATOM 0 HB2 SER A1007 -4.985 13.501 -0.713 1.00 0.00 H new ATOM 0 HB3 SER A1007 -5.843 12.005 -0.400 1.00 0.00 H new ATOM 0 HG SER A1007 -4.298 11.443 1.159 1.00 0.00 H new ATOM 1705 N GLY A1008 -1.766 11.907 -0.656 1.00 0.00 N ATOM 1706 CA GLY A1008 -0.404 12.401 -0.588 1.00 0.00 C ATOM 1707 C GLY A1008 0.386 11.697 0.495 1.00 0.00 C ATOM 1708 O GLY A1008 1.579 11.433 0.340 1.00 0.00 O ATOM 0 H GLY A1008 -1.996 11.202 0.044 1.00 0.00 H new ATOM 0 HA2 GLY A1008 0.086 12.255 -1.551 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -0.414 13.474 -0.394 1.00 0.00 H new ATOM 1712 N ASN A1009 -0.294 11.389 1.593 1.00 0.00 N ATOM 1713 CA ASN A1009 0.319 10.704 2.723 1.00 0.00 C ATOM 1714 C ASN A1009 -0.694 9.771 3.368 1.00 0.00 C ATOM 1715 O ASN A1009 -0.388 8.625 3.698 1.00 0.00 O ATOM 1716 CB ASN A1009 0.812 11.711 3.765 1.00 0.00 C ATOM 1717 CG ASN A1009 1.788 12.723 3.195 1.00 0.00 C ATOM 1718 OD1 ASN A1009 1.442 13.511 2.316 1.00 0.00 O ATOM 1719 ND2 ASN A1009 3.018 12.703 3.697 1.00 0.00 N ATOM 0 H ASN A1009 -1.282 11.606 1.724 1.00 0.00 H new ATOM 0 HA ASN A1009 1.171 10.131 2.356 1.00 0.00 H new ATOM 0 HB2 ASN A1009 -0.044 12.238 4.187 1.00 0.00 H new ATOM 0 HB3 ASN A1009 1.291 11.174 4.584 1.00 0.00 H new ATOM 0 HD21 ASN A1009 3.720 13.359 3.354 1.00 0.00 H new ATOM 0 HD22 ASN A1009 3.261 12.032 4.426 1.00 0.00 H new ATOM 1726 N THR A1010 -1.907 10.282 3.543 1.00 0.00 N ATOM 1727 CA THR A1010 -2.986 9.520 4.148 1.00 0.00 C ATOM 1728 C THR A1010 -3.848 8.845 3.085 1.00 0.00 C ATOM 1729 O THR A1010 -4.263 9.479 2.114 1.00 0.00 O ATOM 1730 CB THR A1010 -3.877 10.427 5.015 1.00 0.00 C ATOM 1731 OG1 THR A1010 -3.099 11.024 6.060 1.00 0.00 O ATOM 1732 CG2 THR A1010 -5.027 9.642 5.620 1.00 0.00 C ATOM 0 H THR A1010 -2.167 11.230 3.271 1.00 0.00 H new ATOM 0 HA THR A1010 -2.529 8.754 4.775 1.00 0.00 H new ATOM 0 HB THR A1010 -4.289 11.208 4.376 1.00 0.00 H new ATOM 0 HG1 THR A1010 -3.673 11.601 6.606 1.00 0.00 H new ATOM 0 HG21 THR A1010 -5.641 10.306 6.228 1.00 0.00 H new ATOM 0 HG22 THR A1010 -5.635 9.214 4.823 1.00 0.00 H new ATOM 0 HG23 THR A1010 -4.632 8.841 6.244 1.00 0.00 H new ATOM 1740 N ALA A1011 -4.117 7.558 3.276 1.00 0.00 N ATOM 1741 CA ALA A1011 -4.934 6.798 2.337 1.00 0.00 C ATOM 1742 C ALA A1011 -6.419 7.012 2.607 1.00 0.00 C ATOM 1743 O ALA A1011 -6.851 7.045 3.759 1.00 0.00 O ATOM 1744 CB ALA A1011 -4.588 5.318 2.415 1.00 0.00 C ATOM 0 H ALA A1011 -3.781 7.019 4.074 1.00 0.00 H new ATOM 0 HA ALA A1011 -4.719 7.157 1.331 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -5.205 4.762 1.709 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -3.536 5.177 2.167 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -4.775 4.953 3.425 1.00 0.00 H new ATOM 1750 N HIS A1012 -7.199 7.157 1.539 1.00 0.00 N ATOM 1751 CA HIS A1012 -8.639 7.369 1.671 1.00 0.00 C ATOM 1752 C HIS A1012 -9.378 6.919 0.413 1.00 0.00 C ATOM 1753 O HIS A1012 -8.888 7.092 -0.702 1.00 0.00 O ATOM 1754 CB HIS A1012 -8.939 8.844 1.957 1.00 0.00 C ATOM 1755 CG HIS A1012 -8.588 9.765 0.830 1.00 0.00 C ATOM 1756 ND1 HIS A1012 -9.190 9.704 -0.410 1.00 0.00 N ATOM 1757 CD2 HIS A1012 -7.690 10.778 0.759 1.00 0.00 C ATOM 1758 CE1 HIS A1012 -8.678 10.636 -1.193 1.00 0.00 C ATOM 1759 NE2 HIS A1012 -7.768 11.300 -0.508 1.00 0.00 N ATOM 0 H HIS A1012 -6.861 7.132 0.577 1.00 0.00 H new ATOM 0 HA HIS A1012 -8.991 6.767 2.509 1.00 0.00 H new ATOM 0 HB2 HIS A1012 -10.000 8.951 2.184 1.00 0.00 H new ATOM 0 HB3 HIS A1012 -8.390 9.150 2.848 1.00 0.00 H new ATOM 0 HD1 HIS A1012 -9.917 9.042 -0.680 1.00 0.00 H new ATOM 0 HD2 HIS A1012 -7.036 11.112 1.551 1.00 0.00 H new ATOM 0 HE1 HIS A1012 -8.957 10.823 -2.220 1.00 0.00 H new ATOM 1768 N TRP A1013 -10.558 6.337 0.603 1.00 0.00 N ATOM 1769 CA TRP A1013 -11.362 5.862 -0.512 1.00 0.00 C ATOM 1770 C TRP A1013 -11.848 7.026 -1.364 1.00 0.00 C ATOM 1771 O TRP A1013 -12.122 8.112 -0.852 1.00 0.00 O ATOM 1772 CB TRP A1013 -12.559 5.053 -0.010 1.00 0.00 C ATOM 1773 CG TRP A1013 -12.180 3.907 0.876 1.00 0.00 C ATOM 1774 CD1 TRP A1013 -12.080 3.920 2.237 1.00 0.00 C ATOM 1775 CD2 TRP A1013 -11.829 2.583 0.460 1.00 0.00 C ATOM 1776 NE1 TRP A1013 -11.709 2.679 2.694 1.00 0.00 N ATOM 1777 CE2 TRP A1013 -11.545 1.841 1.622 1.00 0.00 C ATOM 1778 CE3 TRP A1013 -11.734 1.950 -0.783 1.00 0.00 C ATOM 1779 CZ2 TRP A1013 -11.173 0.500 1.578 1.00 0.00 C ATOM 1780 CZ3 TRP A1013 -11.362 0.620 -0.826 1.00 0.00 C ATOM 1781 CH2 TRP A1013 -11.086 -0.093 0.347 1.00 0.00 C ATOM 0 H TRP A1013 -10.977 6.184 1.520 1.00 0.00 H new ATOM 0 HA TRP A1013 -10.733 5.217 -1.125 1.00 0.00 H new ATOM 0 HB2 TRP A1013 -13.232 5.715 0.535 1.00 0.00 H new ATOM 0 HB3 TRP A1013 -13.113 4.671 -0.867 1.00 0.00 H new ATOM 0 HD1 TRP A1013 -12.265 4.780 2.863 1.00 0.00 H new ATOM 0 HE1 TRP A1013 -11.577 2.423 3.672 1.00 0.00 H new ATOM 0 HE3 TRP A1013 -11.948 2.491 -1.693 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 -10.961 -0.052 2.482 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 -11.283 0.122 -1.781 1.00 0.00 H new ATOM 0 HH2 TRP A1013 -10.799 -1.132 0.279 1.00 0.00 H new ATOM 1792 N SER A1014 -11.956 6.788 -2.664 1.00 0.00 N ATOM 1793 CA SER A1014 -12.413 7.806 -3.598 1.00 0.00 C ATOM 1794 C SER A1014 -13.724 8.432 -3.130 1.00 0.00 C ATOM 1795 O SER A1014 -13.969 9.618 -3.348 1.00 0.00 O ATOM 1796 CB SER A1014 -12.597 7.194 -4.985 1.00 0.00 C ATOM 1797 OG SER A1014 -11.364 6.725 -5.504 1.00 0.00 O ATOM 0 H SER A1014 -11.731 5.892 -3.097 1.00 0.00 H new ATOM 0 HA SER A1014 -11.657 8.590 -3.644 1.00 0.00 H new ATOM 0 HB2 SER A1014 -13.309 6.370 -4.931 1.00 0.00 H new ATOM 0 HB3 SER A1014 -13.020 7.937 -5.661 1.00 0.00 H new ATOM 0 HG SER A1014 -11.084 5.925 -5.011 1.00 0.00 H new ATOM 1803 N THR A1015 -14.562 7.625 -2.485 1.00 0.00 N ATOM 1804 CA THR A1015 -15.850 8.099 -1.989 1.00 0.00 C ATOM 1805 C THR A1015 -16.176 7.496 -0.626 1.00 0.00 C ATOM 1806 O THR A1015 -15.279 7.163 0.148 1.00 0.00 O ATOM 1807 CB THR A1015 -16.987 7.758 -2.970 1.00 0.00 C ATOM 1808 OG1 THR A1015 -17.076 6.340 -3.140 1.00 0.00 O ATOM 1809 CG2 THR A1015 -16.757 8.421 -4.320 1.00 0.00 C ATOM 0 H THR A1015 -14.372 6.641 -2.294 1.00 0.00 H new ATOM 0 HA THR A1015 -15.770 9.182 -1.893 1.00 0.00 H new ATOM 0 HB THR A1015 -17.921 8.135 -2.553 1.00 0.00 H new ATOM 0 HG1 THR A1015 -17.803 5.989 -2.585 1.00 0.00 H new ATOM 0 HG21 THR A1015 -17.574 8.165 -4.995 1.00 0.00 H new ATOM 0 HG22 THR A1015 -16.718 9.503 -4.192 1.00 0.00 H new ATOM 0 HG23 THR A1015 -15.815 8.071 -4.741 1.00 0.00 H new ATOM 1817 N LYS A1016 -17.466 7.367 -0.339 1.00 0.00 N ATOM 1818 CA LYS A1016 -17.917 6.813 0.934 1.00 0.00 C ATOM 1819 C LYS A1016 -18.897 5.658 0.724 1.00 0.00 C ATOM 1820 O LYS A1016 -19.629 5.625 -0.265 1.00 0.00 O ATOM 1821 CB LYS A1016 -18.552 7.912 1.798 1.00 0.00 C ATOM 1822 CG LYS A1016 -19.745 8.610 1.157 1.00 0.00 C ATOM 1823 CD LYS A1016 -21.016 7.779 1.259 1.00 0.00 C ATOM 1824 CE LYS A1016 -22.202 8.489 0.628 1.00 0.00 C ATOM 1825 NZ LYS A1016 -22.466 9.808 1.264 1.00 0.00 N ATOM 0 H LYS A1016 -18.219 7.639 -0.971 1.00 0.00 H new ATOM 0 HA LYS A1016 -17.046 6.416 1.456 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -18.869 7.474 2.745 1.00 0.00 H new ATOM 0 HB3 LYS A1016 -17.792 8.658 2.030 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -19.903 9.574 1.640 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -19.527 8.811 0.108 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -20.863 6.818 0.768 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -21.232 7.571 2.307 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -22.015 8.631 -0.436 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -23.089 7.861 0.715 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -23.406 10.150 0.978 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -22.435 9.707 2.299 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -21.742 10.491 0.961 1.00 0.00 H new ATOM 1839 N PRO A1017 -18.915 4.688 1.657 1.00 0.00 N ATOM 1840 CA PRO A1017 -19.804 3.521 1.576 1.00 0.00 C ATOM 1841 C PRO A1017 -21.278 3.914 1.493 1.00 0.00 C ATOM 1842 O PRO A1017 -21.734 4.793 2.224 1.00 0.00 O ATOM 1843 CB PRO A1017 -19.532 2.768 2.882 1.00 0.00 C ATOM 1844 CG PRO A1017 -18.183 3.224 3.316 1.00 0.00 C ATOM 1845 CD PRO A1017 -18.067 4.649 2.862 1.00 0.00 C ATOM 0 HA PRO A1017 -19.612 2.932 0.679 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -20.287 2.997 3.634 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -19.553 1.689 2.727 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -18.074 3.148 4.398 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -17.401 2.608 2.873 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -18.418 5.344 3.624 1.00 0.00 H new ATOM 0 HD3 PRO A1017 -17.035 4.917 2.637 1.00 0.00 H new ATOM 1853 N PRO A1018 -22.045 3.267 0.594 1.00 0.00 N ATOM 1854 CA PRO A1018 -23.474 3.554 0.417 1.00 0.00 C ATOM 1855 C PRO A1018 -24.290 3.251 1.670 1.00 0.00 C ATOM 1856 O PRO A1018 -23.753 3.182 2.775 1.00 0.00 O ATOM 1857 CB PRO A1018 -23.896 2.621 -0.726 1.00 0.00 C ATOM 1858 CG PRO A1018 -22.626 2.223 -1.396 1.00 0.00 C ATOM 1859 CD PRO A1018 -21.581 2.212 -0.319 1.00 0.00 C ATOM 0 HA PRO A1018 -23.646 4.610 0.209 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -24.430 1.750 -0.346 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -24.566 3.128 -1.421 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -22.720 1.241 -1.860 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -22.365 2.926 -2.187 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -21.522 1.244 0.178 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -20.589 2.427 -0.716 1.00 0.00 H new ATOM 1867 N ILE A1019 -25.596 3.074 1.487 1.00 0.00 N ATOM 1868 CA ILE A1019 -26.492 2.784 2.601 1.00 0.00 C ATOM 1869 C ILE A1019 -27.637 1.868 2.185 1.00 0.00 C ATOM 1870 O ILE A1019 -28.346 2.141 1.216 1.00 0.00 O ATOM 1871 CB ILE A1019 -27.088 4.079 3.181 1.00 0.00 C ATOM 1872 CG1 ILE A1019 -28.102 3.764 4.283 1.00 0.00 C ATOM 1873 CG2 ILE A1019 -27.736 4.901 2.079 1.00 0.00 C ATOM 1874 CD1 ILE A1019 -28.837 4.985 4.792 1.00 0.00 C ATOM 0 H ILE A1019 -26.056 3.126 0.578 1.00 0.00 H new ATOM 0 HA ILE A1019 -25.891 2.280 3.358 1.00 0.00 H new ATOM 0 HB ILE A1019 -26.279 4.663 3.621 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -28.828 3.045 3.904 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -27.585 3.287 5.116 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -28.153 5.814 2.504 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -26.988 5.158 1.329 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -28.532 4.321 1.613 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -29.539 4.688 5.571 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -28.120 5.697 5.202 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -29.382 5.451 3.971 1.00 0.00 H new ATOM 1886 N CYS A1020 -27.834 0.799 2.942 1.00 0.00 N ATOM 1887 CA CYS A1020 -28.917 -0.133 2.671 1.00 0.00 C ATOM 1888 C CYS A1020 -30.202 0.379 3.311 1.00 0.00 C ATOM 1889 O CYS A1020 -30.181 0.890 4.430 1.00 0.00 O ATOM 1890 CB CYS A1020 -28.569 -1.522 3.202 1.00 0.00 C ATOM 1891 SG CYS A1020 -27.080 -2.247 2.444 1.00 0.00 S ATOM 0 H CYS A1020 -27.258 0.556 3.748 1.00 0.00 H new ATOM 0 HA CYS A1020 -29.063 -0.209 1.594 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -28.424 -1.463 4.281 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -29.414 -2.189 3.030 1.00 0.00 H new ATOM 1896 N GLN A1021 -31.314 0.262 2.596 1.00 0.00 N ATOM 1897 CA GLN A1021 -32.591 0.743 3.113 1.00 0.00 C ATOM 1898 C GLN A1021 -33.749 -0.086 2.571 1.00 0.00 C ATOM 1899 O GLN A1021 -33.797 -0.397 1.383 1.00 0.00 O ATOM 1900 CB GLN A1021 -32.773 2.214 2.734 1.00 0.00 C ATOM 1901 CG GLN A1021 -33.985 2.869 3.369 1.00 0.00 C ATOM 1902 CD GLN A1021 -34.183 4.309 2.928 1.00 0.00 C ATOM 1903 OE1 GLN A1021 -33.297 4.801 2.067 1.00 0.00 O flip ATOM 1904 NE2 GLN A1021 -35.126 4.974 3.358 1.00 0.00 N flip ATOM 0 H GLN A1021 -31.359 -0.157 1.667 1.00 0.00 H new ATOM 0 HA GLN A1021 -32.587 0.643 4.198 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -31.880 2.767 3.025 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -32.857 2.292 1.650 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -34.875 2.293 3.118 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -33.881 2.838 4.454 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -35.784 4.559 4.018 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -35.249 5.940 3.054 1.00 0.00 H new ATOM 1913 N ARG A1022 -34.679 -0.443 3.454 1.00 0.00 N ATOM 1914 CA ARG A1022 -35.837 -1.245 3.069 1.00 0.00 C ATOM 1915 C ARG A1022 -36.514 -0.693 1.831 1.00 0.00 C ATOM 1916 O ARG A1022 -36.818 0.497 1.740 1.00 0.00 O ATOM 1917 CB ARG A1022 -36.846 -1.330 4.217 1.00 0.00 C ATOM 1918 CG ARG A1022 -38.196 -1.892 3.794 1.00 0.00 C ATOM 1919 CD ARG A1022 -39.120 -2.090 4.983 1.00 0.00 C ATOM 1920 NE ARG A1022 -39.354 -0.847 5.714 1.00 0.00 N ATOM 1921 CZ ARG A1022 -39.957 0.218 5.192 1.00 0.00 C ATOM 1922 NH1 ARG A1022 -40.400 0.189 3.943 1.00 0.00 N ATOM 1923 NH2 ARG A1022 -40.122 1.312 5.923 1.00 0.00 N ATOM 0 H ARG A1022 -34.653 -0.189 4.442 1.00 0.00 H new ATOM 0 HA ARG A1022 -35.472 -2.246 2.840 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -36.433 -1.955 5.009 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -36.991 -0.335 4.638 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -38.664 -1.216 3.078 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -38.050 -2.844 3.284 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -40.073 -2.491 4.637 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -38.688 -2.830 5.657 1.00 0.00 H new ATOM 0 HE ARG A1022 -39.036 -0.792 6.682 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -40.279 -0.652 3.378 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -40.862 1.008 3.547 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -39.787 1.337 6.886 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -40.584 2.128 5.522 1.00 0.00 H new ATOM 1937 N ILE A1023 -36.751 -1.585 0.885 1.00 0.00 N ATOM 1938 CA ILE A1023 -37.398 -1.231 -0.359 1.00 0.00 C ATOM 1939 C ILE A1023 -38.894 -1.017 -0.145 1.00 0.00 C ATOM 1940 O ILE A1023 -39.578 -1.878 0.407 1.00 0.00 O ATOM 1941 CB ILE A1023 -37.185 -2.332 -1.409 1.00 0.00 C ATOM 1942 CG1 ILE A1023 -35.689 -2.550 -1.653 1.00 0.00 C ATOM 1943 CG2 ILE A1023 -37.891 -1.963 -2.695 1.00 0.00 C ATOM 1944 CD1 ILE A1023 -35.387 -3.676 -2.619 1.00 0.00 C ATOM 0 H ILE A1023 -36.500 -2.571 0.960 1.00 0.00 H new ATOM 0 HA ILE A1023 -36.953 -0.303 -0.717 1.00 0.00 H new ATOM 0 HB ILE A1023 -37.609 -3.265 -1.037 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -35.254 -1.627 -2.037 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -35.201 -2.760 -0.701 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -37.735 -2.749 -3.434 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -38.958 -1.851 -2.505 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -37.489 -1.023 -3.074 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -34.308 -3.770 -2.742 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -35.791 -4.610 -2.227 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -35.844 -3.460 -3.584 1.00 0.00 H new ATOM 1956 N PRO A1024 -39.426 0.139 -0.576 1.00 0.00 N ATOM 1957 CA PRO A1024 -40.849 0.459 -0.422 1.00 0.00 C ATOM 1958 C PRO A1024 -41.745 -0.518 -1.177 1.00 0.00 C ATOM 1959 O PRO A1024 -41.667 -0.550 -2.423 1.00 0.00 O ATOM 1960 CB PRO A1024 -40.965 1.868 -1.021 1.00 0.00 C ATOM 1961 CG PRO A1024 -39.580 2.411 -0.982 1.00 0.00 C ATOM 1962 CD PRO A1024 -38.695 1.230 -1.240 1.00 0.00 C ATOM 1963 OXT PRO A1024 -42.518 -1.241 -0.515 1.00 0.00 O ATOM 0 HA PRO A1024 -41.172 0.397 0.617 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -41.348 1.834 -2.041 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -41.650 2.489 -0.443 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -39.437 3.184 -1.737 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -39.361 2.865 -0.016 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -38.566 1.043 -2.306 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -37.699 1.368 -0.818 1.00 0.00 H new TER 1971 PRO A1024