USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 957 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 999 HIS : no HD1:sc= -4! C(o=-4.9!,f=-18!) USER MOD Set 1.2: A1015 THR OG1 : rot 140:sc= -0.943 USER MOD Set 2.1: A 971 ASN : amide:sc= -3.59! C(o=-6.7!,f=-5!) USER MOD Set 2.2: A 994 HIS : no HD1:sc= -3.08 K(o=-6.7,f=-7.9!) USER MOD Set 3.1: A 978 THR OG1 : rot 180:sc= -0.327 USER MOD Set 3.2: A 984 SER OG : rot -13:sc= -0.105 USER MOD Set 4.1: A 975 HIS : no HE2:sc= -6.57! C(o=-9.2!,f=-7.8!) USER MOD Set 4.2: A 987 THR OG1 : rot -170:sc= -2.67! USER MOD Single : A 901 HIS : no HD1:sc= -2.52 K(o=-2.5,f=-4.7!) USER MOD Single : A 903 GLN : amide:sc= -1.34! K(o=-1.3!,f=0) USER MOD Single : A 907 HIS : no HE2:sc= -0.0479 K(o=-0.048,f=-3.9!) USER MOD Single : A 912 LYS NZ :NH3+ 167:sc= -0.034 (180deg=-0.232) USER MOD Single : A 914 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 THR OG1 : rot 175:sc= -0.489 USER MOD Single : A 916 GLN : amide:sc= -4.28! K(o=-4.3!,f=-2.6) USER MOD Single : A 917 THR OG1 : rot -178:sc= 1.78 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 7:sc= 1.12 USER MOD Single : A 927 SER OG : rot -172:sc= -0.773 USER MOD Single : A 929 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.492) USER MOD Single : A 930 TYR OH : rot 180:sc= -0.204 USER MOD Single : A 936 TYR OH : rot 130:sc= 0.196 USER MOD Single : A 937 TYR OH : rot 180:sc= 0 USER MOD Single : A 942 SER OG : rot 180:sc= 0 USER MOD Single : A 944 THR OG1 : rot 80:sc= -3.06! USER MOD Single : A 948 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 952 SER OG : rot -134:sc= -1.43 USER MOD Single : A 953 SER OG : rot 180:sc= 0 USER MOD Single : A 955 LYS NZ :NH3+ 164:sc= -0.0389 (180deg=-0.305) USER MOD Single : A 959 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 961 LYS NZ :NH3+ 143:sc= -3.74! (180deg=-6.42!) USER MOD Single : A 962 SER OG : rot 180:sc= 0 USER MOD Single : A 964 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 965 THR OG1 : rot 180:sc= -0.228 USER MOD Single : A 973 MET CE :methyl -159:sc= -0.212 (180deg=-0.925) USER MOD Single : A 981 GLN : amide:sc= -6.47! C(o=-6.5!,f=-3.3!) USER MOD Single : A 988 TYR OH : rot 60:sc= -2.52! USER MOD Single : A 989 SER OG : rot 180:sc= -0.0466 USER MOD Single : A 991 THR OG1 : rot 180:sc= 0 USER MOD Single : A 992 THR OG1 : rot 180:sc= 0 USER MOD Single : A1000 SER OG : rot 180:sc= 0 USER MOD Single : A1001 SER OG : rot 30:sc= -0.397 USER MOD Single : A1007 SER OG : rot -49:sc= 0.888 USER MOD Single : A1009 ASN : amide:sc= -2.21 K(o=-2.2,f=-2.7) USER MOD Single : A1010 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 HIS : no HE2:sc= -2.61! C(o=-2.6!,f=-6.2!) USER MOD Single : A1014 SER OG : rot 180:sc=-0.00565 USER MOD Single : A1016 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1021 GLN : amide:sc= -1.03 K(o=-1,f=-4.4!) USER MOD ----------------------------------------------------------------- ATOM 43 N ALA A 900 36.935 -7.013 -4.465 1.00 0.00 N ATOM 44 CA ALA A 900 35.531 -7.279 -4.176 1.00 0.00 C ATOM 45 C ALA A 900 34.794 -6.006 -3.780 1.00 0.00 C ATOM 46 O ALA A 900 35.245 -5.264 -2.908 1.00 0.00 O ATOM 47 CB ALA A 900 35.408 -8.310 -3.068 1.00 0.00 C ATOM 0 HA ALA A 900 35.073 -7.669 -5.085 1.00 0.00 H new ATOM 0 HB1 ALA A 900 34.354 -8.499 -2.862 1.00 0.00 H new ATOM 0 HB2 ALA A 900 35.889 -9.237 -3.379 1.00 0.00 H new ATOM 0 HB3 ALA A 900 35.892 -7.935 -2.166 1.00 0.00 H new ATOM 53 N HIS A 901 33.651 -5.767 -4.418 1.00 0.00 N ATOM 54 CA HIS A 901 32.841 -4.590 -4.127 1.00 0.00 C ATOM 55 C HIS A 901 31.373 -4.843 -4.454 1.00 0.00 C ATOM 56 O HIS A 901 31.045 -5.360 -5.521 1.00 0.00 O ATOM 57 CB HIS A 901 33.335 -3.376 -4.919 1.00 0.00 C ATOM 58 CG HIS A 901 34.726 -2.945 -4.574 1.00 0.00 C ATOM 59 ND1 HIS A 901 35.851 -3.635 -4.970 1.00 0.00 N ATOM 60 CD2 HIS A 901 35.168 -1.893 -3.849 1.00 0.00 C ATOM 61 CE1 HIS A 901 36.927 -3.025 -4.504 1.00 0.00 C ATOM 62 NE2 HIS A 901 36.539 -1.964 -3.821 1.00 0.00 N ATOM 0 H HIS A 901 33.265 -6.375 -5.141 1.00 0.00 H new ATOM 0 HA HIS A 901 32.938 -4.384 -3.061 1.00 0.00 H new ATOM 0 HB2 HIS A 901 33.292 -3.608 -5.983 1.00 0.00 H new ATOM 0 HB3 HIS A 901 32.655 -2.542 -4.747 1.00 0.00 H new ATOM 0 HD2 HIS A 901 34.556 -1.137 -3.379 1.00 0.00 H new ATOM 0 HE1 HIS A 901 37.949 -3.341 -4.656 1.00 0.00 H new ATOM 0 HE2 HIS A 901 37.157 -1.304 -3.349 1.00 0.00 H new ATOM 71 N CYS A 902 30.495 -4.463 -3.531 1.00 0.00 N ATOM 72 CA CYS A 902 29.060 -4.635 -3.723 1.00 0.00 C ATOM 73 C CYS A 902 28.498 -3.494 -4.563 1.00 0.00 C ATOM 74 O CYS A 902 28.443 -2.353 -4.112 1.00 0.00 O ATOM 75 CB CYS A 902 28.350 -4.680 -2.365 1.00 0.00 C ATOM 76 SG CYS A 902 28.649 -3.212 -1.324 1.00 0.00 S ATOM 0 H CYS A 902 30.753 -4.034 -2.642 1.00 0.00 H new ATOM 0 HA CYS A 902 28.889 -5.575 -4.247 1.00 0.00 H new ATOM 0 HB2 CYS A 902 27.278 -4.783 -2.530 1.00 0.00 H new ATOM 0 HB3 CYS A 902 28.677 -5.569 -1.825 1.00 0.00 H new ATOM 81 N GLN A 903 28.084 -3.799 -5.787 1.00 0.00 N ATOM 82 CA GLN A 903 27.533 -2.778 -6.670 1.00 0.00 C ATOM 83 C GLN A 903 26.057 -2.539 -6.383 1.00 0.00 C ATOM 84 O GLN A 903 25.533 -2.981 -5.358 1.00 0.00 O ATOM 85 CB GLN A 903 27.721 -3.173 -8.134 1.00 0.00 C ATOM 86 CG GLN A 903 27.106 -4.516 -8.490 1.00 0.00 C ATOM 87 CD GLN A 903 27.252 -4.856 -9.963 1.00 0.00 C ATOM 88 OE1 GLN A 903 26.841 -5.930 -10.404 1.00 0.00 O ATOM 89 NE2 GLN A 903 27.832 -3.942 -10.733 1.00 0.00 N ATOM 0 H GLN A 903 28.119 -4.736 -6.188 1.00 0.00 H new ATOM 0 HA GLN A 903 28.075 -1.851 -6.480 1.00 0.00 H new ATOM 0 HB2 GLN A 903 27.281 -2.403 -8.768 1.00 0.00 H new ATOM 0 HB3 GLN A 903 28.787 -3.201 -8.359 1.00 0.00 H new ATOM 0 HG2 GLN A 903 27.577 -5.297 -7.893 1.00 0.00 H new ATOM 0 HG3 GLN A 903 26.048 -4.508 -8.226 1.00 0.00 H new ATOM 0 HE21 GLN A 903 28.158 -3.065 -10.326 1.00 0.00 H new ATOM 0 HE22 GLN A 903 27.951 -4.117 -11.731 1.00 0.00 H new ATOM 98 N ALA A 904 25.398 -1.836 -7.299 1.00 0.00 N ATOM 99 CA ALA A 904 23.977 -1.528 -7.163 1.00 0.00 C ATOM 100 C ALA A 904 23.179 -2.775 -6.791 1.00 0.00 C ATOM 101 O ALA A 904 23.247 -3.794 -7.479 1.00 0.00 O ATOM 102 CB ALA A 904 23.449 -0.917 -8.450 1.00 0.00 C ATOM 0 H ALA A 904 25.827 -1.467 -8.148 1.00 0.00 H new ATOM 0 HA ALA A 904 23.858 -0.804 -6.357 1.00 0.00 H new ATOM 0 HB1 ALA A 904 22.389 -0.691 -8.337 1.00 0.00 H new ATOM 0 HB2 ALA A 904 23.994 0.001 -8.667 1.00 0.00 H new ATOM 0 HB3 ALA A 904 23.585 -1.622 -9.270 1.00 0.00 H new ATOM 108 N PRO A 905 22.415 -2.715 -5.686 1.00 0.00 N ATOM 109 CA PRO A 905 21.614 -3.845 -5.217 1.00 0.00 C ATOM 110 C PRO A 905 20.272 -3.974 -5.931 1.00 0.00 C ATOM 111 O PRO A 905 19.464 -3.045 -5.916 1.00 0.00 O ATOM 112 CB PRO A 905 21.396 -3.515 -3.747 1.00 0.00 C ATOM 113 CG PRO A 905 21.369 -2.025 -3.698 1.00 0.00 C ATOM 114 CD PRO A 905 22.284 -1.545 -4.797 1.00 0.00 C ATOM 0 HA PRO A 905 22.113 -4.796 -5.403 1.00 0.00 H new ATOM 0 HB2 PRO A 905 20.463 -3.941 -3.379 1.00 0.00 H new ATOM 0 HB3 PRO A 905 22.197 -3.918 -3.127 1.00 0.00 H new ATOM 0 HG2 PRO A 905 20.356 -1.650 -3.845 1.00 0.00 H new ATOM 0 HG3 PRO A 905 21.705 -1.662 -2.727 1.00 0.00 H new ATOM 0 HD2 PRO A 905 21.862 -0.689 -5.323 1.00 0.00 H new ATOM 0 HD3 PRO A 905 23.251 -1.232 -4.403 1.00 0.00 H new ATOM 122 N ASP A 906 20.040 -5.151 -6.517 1.00 0.00 N ATOM 123 CA ASP A 906 18.793 -5.462 -7.218 1.00 0.00 C ATOM 124 C ASP A 906 18.105 -4.203 -7.754 1.00 0.00 C ATOM 125 O ASP A 906 18.753 -3.310 -8.303 1.00 0.00 O ATOM 126 CB ASP A 906 17.867 -6.216 -6.259 1.00 0.00 C ATOM 127 CG ASP A 906 16.757 -6.965 -6.971 1.00 0.00 C ATOM 128 OD1 ASP A 906 16.778 -7.012 -8.217 1.00 0.00 O ATOM 129 OD2 ASP A 906 15.876 -7.517 -6.280 1.00 0.00 O ATOM 0 H ASP A 906 20.714 -5.917 -6.518 1.00 0.00 H new ATOM 0 HA ASP A 906 19.024 -6.083 -8.083 1.00 0.00 H new ATOM 0 HB2 ASP A 906 18.456 -6.922 -5.674 1.00 0.00 H new ATOM 0 HB3 ASP A 906 17.427 -5.508 -5.556 1.00 0.00 H new ATOM 134 N HIS A 907 16.793 -4.146 -7.587 1.00 0.00 N ATOM 135 CA HIS A 907 15.994 -3.010 -8.037 1.00 0.00 C ATOM 136 C HIS A 907 14.649 -2.996 -7.319 1.00 0.00 C ATOM 137 O HIS A 907 14.140 -4.044 -6.923 1.00 0.00 O ATOM 138 CB HIS A 907 15.772 -3.052 -9.553 1.00 0.00 C ATOM 139 CG HIS A 907 15.040 -4.269 -10.029 1.00 0.00 C ATOM 140 ND1 HIS A 907 15.574 -5.538 -9.973 1.00 0.00 N ATOM 141 CD2 HIS A 907 13.805 -4.406 -10.566 1.00 0.00 C ATOM 142 CE1 HIS A 907 14.699 -6.404 -10.455 1.00 0.00 C ATOM 143 NE2 HIS A 907 13.617 -5.742 -10.821 1.00 0.00 N ATOM 0 H HIS A 907 16.250 -4.883 -7.137 1.00 0.00 H new ATOM 0 HA HIS A 907 16.543 -2.099 -7.797 1.00 0.00 H new ATOM 0 HB2 HIS A 907 15.214 -2.165 -9.853 1.00 0.00 H new ATOM 0 HB3 HIS A 907 16.739 -3.004 -10.053 1.00 0.00 H new ATOM 0 HD1 HIS A 907 16.500 -5.773 -9.615 1.00 0.00 H new ATOM 0 HD2 HIS A 907 13.099 -3.612 -10.758 1.00 0.00 H new ATOM 0 HE1 HIS A 907 14.845 -7.471 -10.536 1.00 0.00 H new ATOM 152 N PHE A 908 14.076 -1.807 -7.149 1.00 0.00 N ATOM 153 CA PHE A 908 12.792 -1.678 -6.470 1.00 0.00 C ATOM 154 C PHE A 908 11.959 -0.553 -7.070 1.00 0.00 C ATOM 155 O PHE A 908 12.454 0.546 -7.317 1.00 0.00 O ATOM 156 CB PHE A 908 12.989 -1.429 -4.975 1.00 0.00 C ATOM 157 CG PHE A 908 13.695 -2.545 -4.265 1.00 0.00 C ATOM 158 CD1 PHE A 908 12.986 -3.635 -3.790 1.00 0.00 C ATOM 159 CD2 PHE A 908 15.066 -2.501 -4.064 1.00 0.00 C ATOM 160 CE1 PHE A 908 13.630 -4.662 -3.127 1.00 0.00 C ATOM 161 CE2 PHE A 908 15.717 -3.524 -3.403 1.00 0.00 C ATOM 162 CZ PHE A 908 14.998 -4.607 -2.934 1.00 0.00 C ATOM 0 H PHE A 908 14.478 -0.926 -7.470 1.00 0.00 H new ATOM 0 HA PHE A 908 12.257 -2.618 -6.607 1.00 0.00 H new ATOM 0 HB2 PHE A 908 13.557 -0.508 -4.841 1.00 0.00 H new ATOM 0 HB3 PHE A 908 12.015 -1.273 -4.510 1.00 0.00 H new ATOM 0 HD1 PHE A 908 11.917 -3.683 -3.939 1.00 0.00 H new ATOM 0 HD2 PHE A 908 15.632 -1.656 -4.429 1.00 0.00 H new ATOM 0 HE1 PHE A 908 13.066 -5.507 -2.760 1.00 0.00 H new ATOM 0 HE2 PHE A 908 16.786 -3.478 -3.253 1.00 0.00 H new ATOM 0 HZ PHE A 908 15.504 -5.409 -2.417 1.00 0.00 H new ATOM 172 N LEU A 909 10.690 -0.855 -7.305 1.00 0.00 N ATOM 173 CA LEU A 909 9.757 0.101 -7.885 1.00 0.00 C ATOM 174 C LEU A 909 9.183 1.028 -6.819 1.00 0.00 C ATOM 175 O LEU A 909 9.171 2.248 -6.985 1.00 0.00 O ATOM 176 CB LEU A 909 8.624 -0.645 -8.592 1.00 0.00 C ATOM 177 CG LEU A 909 9.040 -1.454 -9.828 1.00 0.00 C ATOM 178 CD1 LEU A 909 10.125 -2.466 -9.490 1.00 0.00 C ATOM 179 CD2 LEU A 909 7.835 -2.165 -10.415 1.00 0.00 C ATOM 0 H LEU A 909 10.279 -1.766 -7.100 1.00 0.00 H new ATOM 0 HA LEU A 909 10.299 0.711 -8.608 1.00 0.00 H new ATOM 0 HB2 LEU A 909 8.155 -1.321 -7.877 1.00 0.00 H new ATOM 0 HB3 LEU A 909 7.866 0.079 -8.891 1.00 0.00 H new ATOM 0 HG LEU A 909 9.444 -0.758 -10.563 1.00 0.00 H new ATOM 0 HD11 LEU A 909 10.396 -3.022 -10.387 1.00 0.00 H new ATOM 0 HD12 LEU A 909 11.002 -1.945 -9.107 1.00 0.00 H new ATOM 0 HD13 LEU A 909 9.755 -3.157 -8.733 1.00 0.00 H new ATOM 0 HD21 LEU A 909 8.141 -2.736 -11.292 1.00 0.00 H new ATOM 0 HD22 LEU A 909 7.413 -2.840 -9.671 1.00 0.00 H new ATOM 0 HD23 LEU A 909 7.084 -1.430 -10.705 1.00 0.00 H new ATOM 191 N PHE A 910 8.705 0.441 -5.725 1.00 0.00 N ATOM 192 CA PHE A 910 8.127 1.217 -4.635 1.00 0.00 C ATOM 193 C PHE A 910 9.210 1.709 -3.680 1.00 0.00 C ATOM 194 O PHE A 910 8.959 1.920 -2.494 1.00 0.00 O ATOM 195 CB PHE A 910 7.086 0.382 -3.881 1.00 0.00 C ATOM 196 CG PHE A 910 7.565 -0.989 -3.479 1.00 0.00 C ATOM 197 CD1 PHE A 910 8.704 -1.149 -2.704 1.00 0.00 C ATOM 198 CD2 PHE A 910 6.871 -2.120 -3.881 1.00 0.00 C ATOM 199 CE1 PHE A 910 9.138 -2.409 -2.337 1.00 0.00 C ATOM 200 CE2 PHE A 910 7.301 -3.381 -3.518 1.00 0.00 C ATOM 201 CZ PHE A 910 8.437 -3.526 -2.745 1.00 0.00 C ATOM 0 H PHE A 910 8.707 -0.567 -5.571 1.00 0.00 H new ATOM 0 HA PHE A 910 7.633 2.089 -5.063 1.00 0.00 H new ATOM 0 HB2 PHE A 910 6.781 0.925 -2.986 1.00 0.00 H new ATOM 0 HB3 PHE A 910 6.200 0.276 -4.507 1.00 0.00 H new ATOM 0 HD1 PHE A 910 9.258 -0.279 -2.384 1.00 0.00 H new ATOM 0 HD2 PHE A 910 5.983 -2.013 -4.486 1.00 0.00 H new ATOM 0 HE1 PHE A 910 10.025 -2.520 -1.731 1.00 0.00 H new ATOM 0 HE2 PHE A 910 6.750 -4.253 -3.838 1.00 0.00 H new ATOM 0 HZ PHE A 910 8.776 -4.511 -2.461 1.00 0.00 H new ATOM 211 N ALA A 911 10.413 1.894 -4.212 1.00 0.00 N ATOM 212 CA ALA A 911 11.538 2.366 -3.417 1.00 0.00 C ATOM 213 C ALA A 911 12.585 3.031 -4.301 1.00 0.00 C ATOM 214 O ALA A 911 12.934 2.510 -5.360 1.00 0.00 O ATOM 215 CB ALA A 911 12.155 1.213 -2.640 1.00 0.00 C ATOM 0 H ALA A 911 10.633 1.723 -5.193 1.00 0.00 H new ATOM 0 HA ALA A 911 11.169 3.108 -2.709 1.00 0.00 H new ATOM 0 HB1 ALA A 911 12.995 1.580 -2.050 1.00 0.00 H new ATOM 0 HB2 ALA A 911 11.407 0.780 -1.976 1.00 0.00 H new ATOM 0 HB3 ALA A 911 12.506 0.452 -3.336 1.00 0.00 H new ATOM 221 N LYS A 912 13.087 4.183 -3.865 1.00 0.00 N ATOM 222 CA LYS A 912 14.096 4.904 -4.630 1.00 0.00 C ATOM 223 C LYS A 912 15.206 5.424 -3.725 1.00 0.00 C ATOM 224 O LYS A 912 14.951 6.153 -2.767 1.00 0.00 O ATOM 225 CB LYS A 912 13.478 6.081 -5.394 1.00 0.00 C ATOM 226 CG LYS A 912 12.335 5.698 -6.324 1.00 0.00 C ATOM 227 CD LYS A 912 11.029 5.491 -5.568 1.00 0.00 C ATOM 228 CE LYS A 912 10.568 6.770 -4.886 1.00 0.00 C ATOM 229 NZ LYS A 912 10.341 7.870 -5.863 1.00 0.00 N ATOM 0 H LYS A 912 12.813 4.634 -2.992 1.00 0.00 H new ATOM 0 HA LYS A 912 14.518 4.197 -5.344 1.00 0.00 H new ATOM 0 HB2 LYS A 912 13.114 6.814 -4.674 1.00 0.00 H new ATOM 0 HB3 LYS A 912 14.258 6.568 -5.979 1.00 0.00 H new ATOM 0 HG2 LYS A 912 12.200 6.478 -7.073 1.00 0.00 H new ATOM 0 HG3 LYS A 912 12.593 4.784 -6.858 1.00 0.00 H new ATOM 0 HD2 LYS A 912 10.259 5.148 -6.259 1.00 0.00 H new ATOM 0 HD3 LYS A 912 11.160 4.707 -4.822 1.00 0.00 H new ATOM 0 HE2 LYS A 912 9.647 6.577 -4.337 1.00 0.00 H new ATOM 0 HE3 LYS A 912 11.315 7.081 -4.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 912 9.825 8.645 -5.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 912 11.257 8.222 -6.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 912 9.783 7.513 -6.665 1.00 0.00 H new ATOM 243 N LEU A 913 16.440 5.052 -4.051 1.00 0.00 N ATOM 244 CA LEU A 913 17.607 5.483 -3.289 1.00 0.00 C ATOM 245 C LEU A 913 17.591 6.990 -3.065 1.00 0.00 C ATOM 246 O LEU A 913 17.154 7.749 -3.932 1.00 0.00 O ATOM 247 CB LEU A 913 18.887 5.084 -4.020 1.00 0.00 C ATOM 248 CG LEU A 913 20.180 5.613 -3.400 1.00 0.00 C ATOM 249 CD1 LEU A 913 20.382 5.044 -2.005 1.00 0.00 C ATOM 250 CD2 LEU A 913 21.362 5.284 -4.292 1.00 0.00 C ATOM 0 H LEU A 913 16.658 4.449 -4.844 1.00 0.00 H new ATOM 0 HA LEU A 913 17.575 4.991 -2.317 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.940 3.996 -4.060 1.00 0.00 H new ATOM 0 HB3 LEU A 913 18.825 5.438 -5.049 1.00 0.00 H new ATOM 0 HG LEU A 913 20.104 6.697 -3.312 1.00 0.00 H new ATOM 0 HD11 LEU A 913 21.308 5.434 -1.583 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.544 5.332 -1.370 1.00 0.00 H new ATOM 0 HD13 LEU A 913 20.438 3.957 -2.060 1.00 0.00 H new ATOM 0 HD21 LEU A 913 22.277 5.666 -3.839 1.00 0.00 H new ATOM 0 HD22 LEU A 913 21.439 4.203 -4.410 1.00 0.00 H new ATOM 0 HD23 LEU A 913 21.220 5.746 -5.269 1.00 0.00 H new ATOM 262 N LYS A 914 18.072 7.422 -1.904 1.00 0.00 N ATOM 263 CA LYS A 914 18.109 8.844 -1.586 1.00 0.00 C ATOM 264 C LYS A 914 19.204 9.148 -0.565 1.00 0.00 C ATOM 265 O LYS A 914 19.114 10.114 0.194 1.00 0.00 O ATOM 266 CB LYS A 914 16.746 9.293 -1.061 1.00 0.00 C ATOM 267 CG LYS A 914 16.596 10.803 -0.970 1.00 0.00 C ATOM 268 CD LYS A 914 15.206 11.208 -0.501 1.00 0.00 C ATOM 269 CE LYS A 914 14.133 10.766 -1.483 1.00 0.00 C ATOM 270 NZ LYS A 914 12.771 11.168 -1.035 1.00 0.00 N ATOM 0 H LYS A 914 18.439 6.813 -1.173 1.00 0.00 H new ATOM 0 HA LYS A 914 18.339 9.398 -2.496 1.00 0.00 H new ATOM 0 HB2 LYS A 914 15.967 8.898 -1.713 1.00 0.00 H new ATOM 0 HB3 LYS A 914 16.586 8.860 -0.074 1.00 0.00 H new ATOM 0 HG2 LYS A 914 17.342 11.201 -0.282 1.00 0.00 H new ATOM 0 HG3 LYS A 914 16.794 11.247 -1.946 1.00 0.00 H new ATOM 0 HD2 LYS A 914 15.009 10.768 0.477 1.00 0.00 H new ATOM 0 HD3 LYS A 914 15.164 12.290 -0.378 1.00 0.00 H new ATOM 0 HE2 LYS A 914 14.336 11.200 -2.462 1.00 0.00 H new ATOM 0 HE3 LYS A 914 14.172 9.683 -1.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 914 12.068 10.848 -1.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 914 12.567 10.734 -0.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 914 12.726 12.203 -0.948 1.00 0.00 H new ATOM 284 N THR A 915 20.246 8.324 -0.560 1.00 0.00 N ATOM 285 CA THR A 915 21.366 8.510 0.353 1.00 0.00 C ATOM 286 C THR A 915 22.176 9.749 -0.035 1.00 0.00 C ATOM 287 O THR A 915 21.696 10.876 0.085 1.00 0.00 O ATOM 288 CB THR A 915 22.281 7.266 0.381 1.00 0.00 C ATOM 289 OG1 THR A 915 21.496 6.089 0.603 1.00 0.00 O ATOM 290 CG2 THR A 915 23.328 7.385 1.478 1.00 0.00 C ATOM 0 H THR A 915 20.338 7.519 -1.180 1.00 0.00 H new ATOM 0 HA THR A 915 20.957 8.653 1.353 1.00 0.00 H new ATOM 0 HB THR A 915 22.788 7.197 -0.581 1.00 0.00 H new ATOM 0 HG1 THR A 915 22.069 5.297 0.539 1.00 0.00 H new ATOM 0 HG21 THR A 915 23.959 6.496 1.476 1.00 0.00 H new ATOM 0 HG22 THR A 915 23.943 8.267 1.300 1.00 0.00 H new ATOM 0 HG23 THR A 915 22.833 7.477 2.445 1.00 0.00 H new ATOM 298 N GLN A 916 23.402 9.532 -0.507 1.00 0.00 N ATOM 299 CA GLN A 916 24.277 10.623 -0.922 1.00 0.00 C ATOM 300 C GLN A 916 25.492 10.078 -1.659 1.00 0.00 C ATOM 301 O GLN A 916 26.597 10.612 -1.559 1.00 0.00 O ATOM 302 CB GLN A 916 24.710 11.453 0.289 1.00 0.00 C ATOM 303 CG GLN A 916 25.206 10.619 1.460 1.00 0.00 C ATOM 304 CD GLN A 916 26.504 9.892 1.166 1.00 0.00 C ATOM 305 OE1 GLN A 916 27.533 10.515 0.902 1.00 0.00 O ATOM 306 NE2 GLN A 916 26.463 8.565 1.210 1.00 0.00 N ATOM 0 H GLN A 916 23.812 8.604 -0.611 1.00 0.00 H new ATOM 0 HA GLN A 916 23.724 11.271 -1.602 1.00 0.00 H new ATOM 0 HB2 GLN A 916 25.500 12.139 -0.016 1.00 0.00 H new ATOM 0 HB3 GLN A 916 23.869 12.062 0.620 1.00 0.00 H new ATOM 0 HG2 GLN A 916 25.347 11.267 2.325 1.00 0.00 H new ATOM 0 HG3 GLN A 916 24.441 9.890 1.729 1.00 0.00 H new ATOM 0 HE21 GLN A 916 25.589 8.089 1.433 1.00 0.00 H new ATOM 0 HE22 GLN A 916 27.306 8.022 1.021 1.00 0.00 H new ATOM 315 N THR A 917 25.265 9.005 -2.403 1.00 0.00 N ATOM 316 CA THR A 917 26.317 8.355 -3.172 1.00 0.00 C ATOM 317 C THR A 917 26.475 8.974 -4.555 1.00 0.00 C ATOM 318 O THR A 917 25.535 9.549 -5.104 1.00 0.00 O ATOM 319 CB THR A 917 26.040 6.851 -3.328 1.00 0.00 C ATOM 320 OG1 THR A 917 26.990 6.270 -4.229 1.00 0.00 O ATOM 321 CG2 THR A 917 24.628 6.614 -3.843 1.00 0.00 C ATOM 0 H THR A 917 24.351 8.562 -2.491 1.00 0.00 H new ATOM 0 HA THR A 917 27.242 8.501 -2.615 1.00 0.00 H new ATOM 0 HB THR A 917 26.136 6.380 -2.350 1.00 0.00 H new ATOM 0 HG1 THR A 917 26.788 5.319 -4.349 1.00 0.00 H new ATOM 0 HG21 THR A 917 24.453 5.543 -3.946 1.00 0.00 H new ATOM 0 HG22 THR A 917 23.909 7.033 -3.139 1.00 0.00 H new ATOM 0 HG23 THR A 917 24.509 7.096 -4.813 1.00 0.00 H new ATOM 329 N THR A 918 27.673 8.842 -5.115 1.00 0.00 N ATOM 330 CA THR A 918 27.971 9.374 -6.438 1.00 0.00 C ATOM 331 C THR A 918 28.767 8.359 -7.254 1.00 0.00 C ATOM 332 O THR A 918 29.773 8.698 -7.878 1.00 0.00 O ATOM 333 CB THR A 918 28.765 10.691 -6.351 1.00 0.00 C ATOM 334 OG1 THR A 918 30.000 10.473 -5.658 1.00 0.00 O ATOM 335 CG2 THR A 918 27.959 11.764 -5.636 1.00 0.00 C ATOM 0 H THR A 918 28.458 8.367 -4.669 1.00 0.00 H new ATOM 0 HA THR A 918 27.019 9.574 -6.930 1.00 0.00 H new ATOM 0 HB THR A 918 28.973 11.032 -7.365 1.00 0.00 H new ATOM 0 HG1 THR A 918 30.500 11.314 -5.608 1.00 0.00 H new ATOM 0 HG21 THR A 918 28.541 12.684 -5.587 1.00 0.00 H new ATOM 0 HG22 THR A 918 27.034 11.948 -6.182 1.00 0.00 H new ATOM 0 HG23 THR A 918 27.724 11.430 -4.626 1.00 0.00 H new ATOM 343 N ALA A 919 28.309 7.111 -7.233 1.00 0.00 N ATOM 344 CA ALA A 919 28.972 6.033 -7.958 1.00 0.00 C ATOM 345 C ALA A 919 28.080 4.798 -8.038 1.00 0.00 C ATOM 346 O ALA A 919 27.151 4.639 -7.245 1.00 0.00 O ATOM 347 CB ALA A 919 30.293 5.689 -7.289 1.00 0.00 C ATOM 0 H ALA A 919 27.477 6.821 -6.719 1.00 0.00 H new ATOM 0 HA ALA A 919 29.168 6.374 -8.975 1.00 0.00 H new ATOM 0 HB1 ALA A 919 30.780 4.883 -7.838 1.00 0.00 H new ATOM 0 HB2 ALA A 919 30.939 6.567 -7.285 1.00 0.00 H new ATOM 0 HB3 ALA A 919 30.109 5.370 -6.263 1.00 0.00 H new ATOM 353 N SER A 920 28.366 3.927 -9.002 1.00 0.00 N ATOM 354 CA SER A 920 27.587 2.707 -9.188 1.00 0.00 C ATOM 355 C SER A 920 28.096 1.591 -8.278 1.00 0.00 C ATOM 356 O SER A 920 27.312 0.800 -7.756 1.00 0.00 O ATOM 357 CB SER A 920 27.647 2.257 -10.650 1.00 0.00 C ATOM 358 OG SER A 920 28.982 1.995 -11.048 1.00 0.00 O ATOM 0 H SER A 920 29.131 4.044 -9.666 1.00 0.00 H new ATOM 0 HA SER A 920 26.552 2.923 -8.923 1.00 0.00 H new ATOM 0 HB2 SER A 920 27.042 1.360 -10.783 1.00 0.00 H new ATOM 0 HB3 SER A 920 27.218 3.029 -11.289 1.00 0.00 H new ATOM 0 HG SER A 920 28.994 1.708 -11.985 1.00 0.00 H new ATOM 364 N ASP A 921 29.411 1.537 -8.094 1.00 0.00 N ATOM 365 CA ASP A 921 30.025 0.522 -7.243 1.00 0.00 C ATOM 366 C ASP A 921 30.010 0.960 -5.780 1.00 0.00 C ATOM 367 O ASP A 921 30.127 2.148 -5.477 1.00 0.00 O ATOM 368 CB ASP A 921 31.461 0.244 -7.696 1.00 0.00 C ATOM 369 CG ASP A 921 32.322 1.494 -7.723 1.00 0.00 C ATOM 370 OD1 ASP A 921 31.800 2.586 -7.416 1.00 0.00 O ATOM 371 OD2 ASP A 921 33.521 1.379 -8.055 1.00 0.00 O ATOM 0 H ASP A 921 30.073 2.184 -8.523 1.00 0.00 H new ATOM 0 HA ASP A 921 29.443 -0.395 -7.334 1.00 0.00 H new ATOM 0 HB2 ASP A 921 31.913 -0.488 -7.027 1.00 0.00 H new ATOM 0 HB3 ASP A 921 31.444 -0.201 -8.691 1.00 0.00 H new ATOM 376 N PHE A 922 29.859 -0.004 -4.875 1.00 0.00 N ATOM 377 CA PHE A 922 29.825 0.292 -3.446 1.00 0.00 C ATOM 378 C PHE A 922 30.692 -0.677 -2.654 1.00 0.00 C ATOM 379 O PHE A 922 30.809 -1.852 -3.001 1.00 0.00 O ATOM 380 CB PHE A 922 28.393 0.257 -2.917 1.00 0.00 C ATOM 381 CG PHE A 922 27.516 1.311 -3.516 1.00 0.00 C ATOM 382 CD1 PHE A 922 26.914 1.121 -4.749 1.00 0.00 C ATOM 383 CD2 PHE A 922 27.307 2.502 -2.847 1.00 0.00 C ATOM 384 CE1 PHE A 922 26.117 2.104 -5.302 1.00 0.00 C ATOM 385 CE2 PHE A 922 26.513 3.486 -3.391 1.00 0.00 C ATOM 386 CZ PHE A 922 25.915 3.290 -4.621 1.00 0.00 C ATOM 0 H PHE A 922 29.759 -0.993 -5.105 1.00 0.00 H new ATOM 0 HA PHE A 922 30.227 1.297 -3.315 1.00 0.00 H new ATOM 0 HB2 PHE A 922 27.962 -0.723 -3.120 1.00 0.00 H new ATOM 0 HB3 PHE A 922 28.410 0.380 -1.834 1.00 0.00 H new ATOM 0 HD1 PHE A 922 27.069 0.195 -5.283 1.00 0.00 H new ATOM 0 HD2 PHE A 922 27.772 2.663 -1.886 1.00 0.00 H new ATOM 0 HE1 PHE A 922 25.653 1.947 -6.264 1.00 0.00 H new ATOM 0 HE2 PHE A 922 26.357 4.411 -2.856 1.00 0.00 H new ATOM 0 HZ PHE A 922 25.292 4.061 -5.049 1.00 0.00 H new ATOM 396 N PRO A 923 31.320 -0.184 -1.576 1.00 0.00 N ATOM 397 CA PRO A 923 32.191 -0.980 -0.719 1.00 0.00 C ATOM 398 C PRO A 923 31.414 -1.750 0.344 1.00 0.00 C ATOM 399 O PRO A 923 30.498 -1.211 0.967 1.00 0.00 O ATOM 400 CB PRO A 923 33.102 0.071 -0.059 1.00 0.00 C ATOM 401 CG PRO A 923 32.620 1.410 -0.540 1.00 0.00 C ATOM 402 CD PRO A 923 31.242 1.196 -1.096 1.00 0.00 C ATOM 0 HA PRO A 923 32.732 -1.740 -1.284 1.00 0.00 H new ATOM 0 HB2 PRO A 923 33.047 0.006 1.028 1.00 0.00 H new ATOM 0 HB3 PRO A 923 34.144 -0.089 -0.336 1.00 0.00 H new ATOM 0 HG2 PRO A 923 32.600 2.131 0.277 1.00 0.00 H new ATOM 0 HG3 PRO A 923 33.288 1.811 -1.303 1.00 0.00 H new ATOM 0 HD2 PRO A 923 30.471 1.321 -0.336 1.00 0.00 H new ATOM 0 HD3 PRO A 923 31.013 1.896 -1.900 1.00 0.00 H new ATOM 410 N ILE A 924 31.792 -3.008 0.558 1.00 0.00 N ATOM 411 CA ILE A 924 31.139 -3.845 1.561 1.00 0.00 C ATOM 412 C ILE A 924 31.156 -3.151 2.917 1.00 0.00 C ATOM 413 O ILE A 924 32.013 -2.305 3.176 1.00 0.00 O ATOM 414 CB ILE A 924 31.820 -5.218 1.683 1.00 0.00 C ATOM 415 CG1 ILE A 924 31.930 -5.880 0.308 1.00 0.00 C ATOM 416 CG2 ILE A 924 31.032 -6.098 2.640 1.00 0.00 C ATOM 417 CD1 ILE A 924 32.697 -7.184 0.323 1.00 0.00 C ATOM 0 H ILE A 924 32.547 -3.470 0.051 1.00 0.00 H new ATOM 0 HA ILE A 924 30.110 -4.000 1.238 1.00 0.00 H new ATOM 0 HB ILE A 924 32.827 -5.084 2.078 1.00 0.00 H new ATOM 0 HG12 ILE A 924 30.928 -6.062 -0.079 1.00 0.00 H new ATOM 0 HG13 ILE A 924 32.417 -5.190 -0.380 1.00 0.00 H new ATOM 0 HG21 ILE A 924 31.518 -7.070 2.724 1.00 0.00 H new ATOM 0 HG22 ILE A 924 30.994 -5.625 3.621 1.00 0.00 H new ATOM 0 HG23 ILE A 924 30.018 -6.230 2.262 1.00 0.00 H new ATOM 0 HD11 ILE A 924 32.734 -7.596 -0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 924 33.711 -7.005 0.680 1.00 0.00 H new ATOM 0 HD13 ILE A 924 32.199 -7.892 0.986 1.00 0.00 H new ATOM 429 N GLY A 925 30.195 -3.486 3.771 1.00 0.00 N ATOM 430 CA GLY A 925 30.124 -2.850 5.070 1.00 0.00 C ATOM 431 C GLY A 925 29.608 -1.435 4.943 1.00 0.00 C ATOM 432 O GLY A 925 30.285 -0.479 5.320 1.00 0.00 O ATOM 0 H GLY A 925 29.471 -4.180 3.588 1.00 0.00 H new ATOM 0 HA2 GLY A 925 29.470 -3.424 5.726 1.00 0.00 H new ATOM 0 HA3 GLY A 925 31.111 -2.843 5.532 1.00 0.00 H new ATOM 436 N THR A 926 28.410 -1.315 4.381 1.00 0.00 N ATOM 437 CA THR A 926 27.775 -0.024 4.153 1.00 0.00 C ATOM 438 C THR A 926 26.364 -0.214 3.604 1.00 0.00 C ATOM 439 O THR A 926 26.159 -0.928 2.622 1.00 0.00 O ATOM 440 CB THR A 926 28.596 0.824 3.155 1.00 0.00 C ATOM 441 OG1 THR A 926 29.753 1.370 3.799 1.00 0.00 O ATOM 442 CG2 THR A 926 27.763 1.948 2.558 1.00 0.00 C ATOM 0 H THR A 926 27.852 -2.111 4.071 1.00 0.00 H new ATOM 0 HA THR A 926 27.727 0.497 5.109 1.00 0.00 H new ATOM 0 HB THR A 926 28.908 0.165 2.345 1.00 0.00 H new ATOM 0 HG1 THR A 926 29.831 0.997 4.702 1.00 0.00 H new ATOM 0 HG21 THR A 926 28.373 2.523 1.861 1.00 0.00 H new ATOM 0 HG22 THR A 926 26.908 1.526 2.029 1.00 0.00 H new ATOM 0 HG23 THR A 926 27.409 2.602 3.355 1.00 0.00 H new ATOM 450 N SER A 927 25.397 0.419 4.258 1.00 0.00 N ATOM 451 CA SER A 927 23.999 0.315 3.857 1.00 0.00 C ATOM 452 C SER A 927 23.514 1.588 3.172 1.00 0.00 C ATOM 453 O SER A 927 23.767 2.696 3.646 1.00 0.00 O ATOM 454 CB SER A 927 23.131 0.027 5.079 1.00 0.00 C ATOM 455 OG SER A 927 23.251 1.055 6.045 1.00 0.00 O ATOM 0 H SER A 927 25.557 1.012 5.072 1.00 0.00 H new ATOM 0 HA SER A 927 23.917 -0.504 3.142 1.00 0.00 H new ATOM 0 HB2 SER A 927 22.089 -0.069 4.774 1.00 0.00 H new ATOM 0 HB3 SER A 927 23.423 -0.926 5.520 1.00 0.00 H new ATOM 0 HG SER A 927 22.787 0.788 6.866 1.00 0.00 H new ATOM 461 N LEU A 928 22.794 1.419 2.067 1.00 0.00 N ATOM 462 CA LEU A 928 22.246 2.557 1.331 1.00 0.00 C ATOM 463 C LEU A 928 20.792 2.799 1.732 1.00 0.00 C ATOM 464 O LEU A 928 19.974 1.881 1.716 1.00 0.00 O ATOM 465 CB LEU A 928 22.332 2.320 -0.177 1.00 0.00 C ATOM 466 CG LEU A 928 23.746 2.191 -0.743 1.00 0.00 C ATOM 467 CD1 LEU A 928 23.688 1.928 -2.240 1.00 0.00 C ATOM 468 CD2 LEU A 928 24.558 3.443 -0.449 1.00 0.00 C ATOM 0 H LEU A 928 22.576 0.509 1.661 1.00 0.00 H new ATOM 0 HA LEU A 928 22.838 3.438 1.581 1.00 0.00 H new ATOM 0 HB2 LEU A 928 21.779 1.412 -0.417 1.00 0.00 H new ATOM 0 HB3 LEU A 928 21.829 3.143 -0.686 1.00 0.00 H new ATOM 0 HG LEU A 928 24.239 1.347 -0.260 1.00 0.00 H new ATOM 0 HD11 LEU A 928 24.701 1.838 -2.633 1.00 0.00 H new ATOM 0 HD12 LEU A 928 23.143 1.003 -2.426 1.00 0.00 H new ATOM 0 HD13 LEU A 928 23.179 2.755 -2.735 1.00 0.00 H new ATOM 0 HD21 LEU A 928 25.561 3.331 -0.860 1.00 0.00 H new ATOM 0 HD22 LEU A 928 24.073 4.306 -0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 928 24.622 3.590 0.629 1.00 0.00 H new ATOM 480 N LYS A 929 20.471 4.033 2.099 1.00 0.00 N ATOM 481 CA LYS A 929 19.113 4.371 2.518 1.00 0.00 C ATOM 482 C LYS A 929 18.210 4.643 1.315 1.00 0.00 C ATOM 483 O LYS A 929 18.478 5.542 0.517 1.00 0.00 O ATOM 484 CB LYS A 929 19.141 5.601 3.429 1.00 0.00 C ATOM 485 CG LYS A 929 17.814 5.889 4.112 1.00 0.00 C ATOM 486 CD LYS A 929 17.484 4.838 5.161 1.00 0.00 C ATOM 487 CE LYS A 929 18.500 4.839 6.292 1.00 0.00 C ATOM 488 NZ LYS A 929 18.172 3.831 7.338 1.00 0.00 N ATOM 0 H LYS A 929 21.127 4.814 2.116 1.00 0.00 H new ATOM 0 HA LYS A 929 18.707 3.518 3.062 1.00 0.00 H new ATOM 0 HB2 LYS A 929 19.908 5.460 4.191 1.00 0.00 H new ATOM 0 HB3 LYS A 929 19.432 6.471 2.840 1.00 0.00 H new ATOM 0 HG2 LYS A 929 17.851 6.872 4.581 1.00 0.00 H new ATOM 0 HG3 LYS A 929 17.020 5.921 3.366 1.00 0.00 H new ATOM 0 HD2 LYS A 929 16.489 5.026 5.565 1.00 0.00 H new ATOM 0 HD3 LYS A 929 17.458 3.853 4.695 1.00 0.00 H new ATOM 0 HE2 LYS A 929 19.492 4.633 5.889 1.00 0.00 H new ATOM 0 HE3 LYS A 929 18.539 5.830 6.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 19.011 3.658 7.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 17.398 4.188 7.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 17.878 2.943 6.884 1.00 0.00 H new ATOM 502 N TYR A 930 17.131 3.868 1.197 1.00 0.00 N ATOM 503 CA TYR A 930 16.183 4.038 0.095 1.00 0.00 C ATOM 504 C TYR A 930 14.842 4.561 0.599 1.00 0.00 C ATOM 505 O TYR A 930 14.249 3.988 1.511 1.00 0.00 O ATOM 506 CB TYR A 930 15.961 2.717 -0.647 1.00 0.00 C ATOM 507 CG TYR A 930 17.180 2.205 -1.377 1.00 0.00 C ATOM 508 CD1 TYR A 930 18.318 1.823 -0.683 1.00 0.00 C ATOM 509 CD2 TYR A 930 17.192 2.110 -2.762 1.00 0.00 C ATOM 510 CE1 TYR A 930 19.435 1.361 -1.348 1.00 0.00 C ATOM 511 CE2 TYR A 930 18.306 1.646 -3.435 1.00 0.00 C ATOM 512 CZ TYR A 930 19.425 1.273 -2.723 1.00 0.00 C ATOM 513 OH TYR A 930 20.538 0.815 -3.389 1.00 0.00 O ATOM 0 H TYR A 930 16.892 3.120 1.848 1.00 0.00 H new ATOM 0 HA TYR A 930 16.614 4.767 -0.591 1.00 0.00 H new ATOM 0 HB2 TYR A 930 15.636 1.962 0.068 1.00 0.00 H new ATOM 0 HB3 TYR A 930 15.150 2.848 -1.364 1.00 0.00 H new ATOM 0 HD1 TYR A 930 18.330 1.888 0.395 1.00 0.00 H new ATOM 0 HD2 TYR A 930 16.317 2.403 -3.322 1.00 0.00 H new ATOM 0 HE1 TYR A 930 20.314 1.069 -0.793 1.00 0.00 H new ATOM 0 HE2 TYR A 930 18.300 1.576 -4.513 1.00 0.00 H new ATOM 0 HH TYR A 930 20.365 0.814 -4.354 1.00 0.00 H new ATOM 523 N GLU A 931 14.362 5.640 -0.012 1.00 0.00 N ATOM 524 CA GLU A 931 13.081 6.224 0.370 1.00 0.00 C ATOM 525 C GLU A 931 11.953 5.645 -0.476 1.00 0.00 C ATOM 526 O GLU A 931 11.825 5.958 -1.661 1.00 0.00 O ATOM 527 CB GLU A 931 13.124 7.746 0.220 1.00 0.00 C ATOM 528 CG GLU A 931 14.135 8.420 1.133 1.00 0.00 C ATOM 529 CD GLU A 931 13.784 8.287 2.603 1.00 0.00 C ATOM 530 OE1 GLU A 931 12.711 7.727 2.911 1.00 0.00 O ATOM 531 OE2 GLU A 931 14.579 8.751 3.447 1.00 0.00 O ATOM 0 H GLU A 931 14.839 6.126 -0.771 1.00 0.00 H new ATOM 0 HA GLU A 931 12.891 5.979 1.415 1.00 0.00 H new ATOM 0 HB2 GLU A 931 13.360 7.994 -0.815 1.00 0.00 H new ATOM 0 HB3 GLU A 931 12.133 8.151 0.427 1.00 0.00 H new ATOM 0 HG2 GLU A 931 15.120 7.986 0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 931 14.202 9.477 0.875 1.00 0.00 H new ATOM 538 N CYS A 932 11.143 4.792 0.142 1.00 0.00 N ATOM 539 CA CYS A 932 10.023 4.151 -0.539 1.00 0.00 C ATOM 540 C CYS A 932 9.028 5.174 -1.084 1.00 0.00 C ATOM 541 O CYS A 932 9.190 6.379 -0.896 1.00 0.00 O ATOM 542 CB CYS A 932 9.315 3.188 0.413 1.00 0.00 C ATOM 543 SG CYS A 932 10.384 1.855 1.046 1.00 0.00 S ATOM 0 H CYS A 932 11.243 4.527 1.122 1.00 0.00 H new ATOM 0 HA CYS A 932 10.425 3.597 -1.387 1.00 0.00 H new ATOM 0 HB2 CYS A 932 8.918 3.753 1.256 1.00 0.00 H new ATOM 0 HB3 CYS A 932 8.464 2.744 -0.102 1.00 0.00 H new ATOM 548 N ARG A 933 7.994 4.673 -1.755 1.00 0.00 N ATOM 549 CA ARG A 933 6.957 5.525 -2.331 1.00 0.00 C ATOM 550 C ARG A 933 5.874 5.847 -1.302 1.00 0.00 C ATOM 551 O ARG A 933 5.628 5.066 -0.381 1.00 0.00 O ATOM 552 CB ARG A 933 6.322 4.850 -3.549 1.00 0.00 C ATOM 553 CG ARG A 933 7.277 4.660 -4.715 1.00 0.00 C ATOM 554 CD ARG A 933 6.574 4.032 -5.909 1.00 0.00 C ATOM 555 NE ARG A 933 5.447 4.842 -6.366 1.00 0.00 N ATOM 556 CZ ARG A 933 4.658 4.502 -7.382 1.00 0.00 C ATOM 557 NH1 ARG A 933 4.871 3.371 -8.043 1.00 0.00 N ATOM 558 NH2 ARG A 933 3.654 5.292 -7.736 1.00 0.00 N ATOM 0 H ARG A 933 7.852 3.676 -1.914 1.00 0.00 H new ATOM 0 HA ARG A 933 7.430 6.456 -2.642 1.00 0.00 H new ATOM 0 HB2 ARG A 933 5.931 3.877 -3.250 1.00 0.00 H new ATOM 0 HB3 ARG A 933 5.473 5.447 -3.881 1.00 0.00 H new ATOM 0 HG2 ARG A 933 7.698 5.623 -5.004 1.00 0.00 H new ATOM 0 HG3 ARG A 933 8.110 4.028 -4.407 1.00 0.00 H new ATOM 0 HD2 ARG A 933 7.286 3.907 -6.725 1.00 0.00 H new ATOM 0 HD3 ARG A 933 6.220 3.037 -5.640 1.00 0.00 H new ATOM 0 HE ARG A 933 5.254 5.717 -5.879 1.00 0.00 H new ATOM 0 HH11 ARG A 933 5.641 2.760 -7.773 1.00 0.00 H new ATOM 0 HH12 ARG A 933 4.264 3.113 -8.821 1.00 0.00 H new ATOM 0 HH21 ARG A 933 3.486 6.161 -7.229 1.00 0.00 H new ATOM 0 HH22 ARG A 933 3.050 5.031 -8.515 1.00 0.00 H new ATOM 572 N PRO A 934 5.212 7.011 -1.445 1.00 0.00 N ATOM 573 CA PRO A 934 4.151 7.443 -0.527 1.00 0.00 C ATOM 574 C PRO A 934 3.060 6.393 -0.346 1.00 0.00 C ATOM 575 O PRO A 934 2.517 6.233 0.746 1.00 0.00 O ATOM 576 CB PRO A 934 3.572 8.685 -1.205 1.00 0.00 C ATOM 577 CG PRO A 934 4.682 9.206 -2.051 1.00 0.00 C ATOM 578 CD PRO A 934 5.448 7.999 -2.516 1.00 0.00 C ATOM 0 HA PRO A 934 4.542 7.623 0.474 1.00 0.00 H new ATOM 0 HB2 PRO A 934 2.698 8.436 -1.807 1.00 0.00 H new ATOM 0 HB3 PRO A 934 3.253 9.425 -0.471 1.00 0.00 H new ATOM 0 HG2 PRO A 934 4.295 9.773 -2.898 1.00 0.00 H new ATOM 0 HG3 PRO A 934 5.323 9.880 -1.483 1.00 0.00 H new ATOM 0 HD2 PRO A 934 5.087 7.641 -3.480 1.00 0.00 H new ATOM 0 HD3 PRO A 934 6.509 8.218 -2.634 1.00 0.00 H new ATOM 586 N GLU A 935 2.732 5.690 -1.426 1.00 0.00 N ATOM 587 CA GLU A 935 1.692 4.665 -1.384 1.00 0.00 C ATOM 588 C GLU A 935 2.125 3.456 -0.557 1.00 0.00 C ATOM 589 O GLU A 935 1.478 2.408 -0.591 1.00 0.00 O ATOM 590 CB GLU A 935 1.333 4.224 -2.803 1.00 0.00 C ATOM 591 CG GLU A 935 0.793 5.350 -3.671 1.00 0.00 C ATOM 592 CD GLU A 935 0.472 4.897 -5.082 1.00 0.00 C ATOM 593 OE1 GLU A 935 -0.378 3.995 -5.237 1.00 0.00 O ATOM 594 OE2 GLU A 935 1.070 5.445 -6.031 1.00 0.00 O ATOM 0 H GLU A 935 3.170 5.810 -2.339 1.00 0.00 H new ATOM 0 HA GLU A 935 0.815 5.101 -0.905 1.00 0.00 H new ATOM 0 HB2 GLU A 935 2.218 3.802 -3.279 1.00 0.00 H new ATOM 0 HB3 GLU A 935 0.590 3.428 -2.750 1.00 0.00 H new ATOM 0 HG2 GLU A 935 -0.107 5.758 -3.211 1.00 0.00 H new ATOM 0 HG3 GLU A 935 1.525 6.157 -3.710 1.00 0.00 H new ATOM 601 N TYR A 936 3.216 3.603 0.189 1.00 0.00 N ATOM 602 CA TYR A 936 3.724 2.521 1.026 1.00 0.00 C ATOM 603 C TYR A 936 4.206 3.052 2.370 1.00 0.00 C ATOM 604 O TYR A 936 5.001 3.990 2.430 1.00 0.00 O ATOM 605 CB TYR A 936 4.873 1.786 0.330 1.00 0.00 C ATOM 606 CG TYR A 936 4.454 1.020 -0.902 1.00 0.00 C ATOM 607 CD1 TYR A 936 4.115 1.679 -2.077 1.00 0.00 C ATOM 608 CD2 TYR A 936 4.386 -0.365 -0.885 1.00 0.00 C ATOM 609 CE1 TYR A 936 3.723 0.977 -3.198 1.00 0.00 C ATOM 610 CE2 TYR A 936 3.996 -1.074 -2.002 1.00 0.00 C ATOM 611 CZ TYR A 936 3.664 -0.399 -3.157 1.00 0.00 C ATOM 612 OH TYR A 936 3.272 -1.102 -4.273 1.00 0.00 O ATOM 0 H TYR A 936 3.765 4.461 0.231 1.00 0.00 H new ATOM 0 HA TYR A 936 2.903 1.824 1.193 1.00 0.00 H new ATOM 0 HB2 TYR A 936 5.639 2.510 0.052 1.00 0.00 H new ATOM 0 HB3 TYR A 936 5.330 1.094 1.038 1.00 0.00 H new ATOM 0 HD1 TYR A 936 4.159 2.757 -2.113 1.00 0.00 H new ATOM 0 HD2 TYR A 936 4.643 -0.898 0.019 1.00 0.00 H new ATOM 0 HE1 TYR A 936 3.463 1.504 -4.104 1.00 0.00 H new ATOM 0 HE2 TYR A 936 3.951 -2.153 -1.972 1.00 0.00 H new ATOM 0 HH TYR A 936 3.921 -1.813 -4.456 1.00 0.00 H new ATOM 622 N TYR A 937 3.727 2.437 3.447 1.00 0.00 N ATOM 623 CA TYR A 937 4.122 2.844 4.791 1.00 0.00 C ATOM 624 C TYR A 937 5.260 1.966 5.300 1.00 0.00 C ATOM 625 O TYR A 937 5.248 0.749 5.115 1.00 0.00 O ATOM 626 CB TYR A 937 2.926 2.800 5.754 1.00 0.00 C ATOM 627 CG TYR A 937 2.330 1.423 5.972 1.00 0.00 C ATOM 628 CD1 TYR A 937 2.965 0.481 6.773 1.00 0.00 C ATOM 629 CD2 TYR A 937 1.127 1.069 5.378 1.00 0.00 C ATOM 630 CE1 TYR A 937 2.419 -0.772 6.973 1.00 0.00 C ATOM 631 CE2 TYR A 937 0.574 -0.182 5.572 1.00 0.00 C ATOM 632 CZ TYR A 937 1.223 -1.099 6.370 1.00 0.00 C ATOM 633 OH TYR A 937 0.675 -2.346 6.567 1.00 0.00 O ATOM 0 H TYR A 937 3.068 1.659 3.416 1.00 0.00 H new ATOM 0 HA TYR A 937 4.475 3.874 4.745 1.00 0.00 H new ATOM 0 HB2 TYR A 937 3.240 3.200 6.718 1.00 0.00 H new ATOM 0 HB3 TYR A 937 2.147 3.460 5.373 1.00 0.00 H new ATOM 0 HD1 TYR A 937 3.902 0.733 7.247 1.00 0.00 H new ATOM 0 HD2 TYR A 937 0.614 1.784 4.753 1.00 0.00 H new ATOM 0 HE1 TYR A 937 2.926 -1.492 7.598 1.00 0.00 H new ATOM 0 HE2 TYR A 937 -0.363 -0.440 5.100 1.00 0.00 H new ATOM 0 HH TYR A 937 -0.169 -2.414 6.073 1.00 0.00 H new ATOM 643 N GLY A 938 6.248 2.589 5.929 1.00 0.00 N ATOM 644 CA GLY A 938 7.379 1.840 6.442 1.00 0.00 C ATOM 645 C GLY A 938 8.668 2.625 6.395 1.00 0.00 C ATOM 646 O GLY A 938 8.838 3.509 5.555 1.00 0.00 O ATOM 0 H GLY A 938 6.287 3.595 6.093 1.00 0.00 H new ATOM 0 HA2 GLY A 938 7.176 1.544 7.471 1.00 0.00 H new ATOM 0 HA3 GLY A 938 7.495 0.924 5.863 1.00 0.00 H new ATOM 650 N ARG A 939 9.581 2.298 7.298 1.00 0.00 N ATOM 651 CA ARG A 939 10.867 2.972 7.359 1.00 0.00 C ATOM 652 C ARG A 939 11.765 2.560 6.198 1.00 0.00 C ATOM 653 O ARG A 939 11.780 1.397 5.790 1.00 0.00 O ATOM 654 CB ARG A 939 11.561 2.669 8.684 1.00 0.00 C ATOM 655 CG ARG A 939 10.926 3.368 9.871 1.00 0.00 C ATOM 656 CD ARG A 939 11.623 3.000 11.169 1.00 0.00 C ATOM 657 NE ARG A 939 10.998 3.635 12.326 1.00 0.00 N ATOM 658 CZ ARG A 939 11.399 3.445 13.579 1.00 0.00 C ATOM 659 NH1 ARG A 939 12.422 2.640 13.837 1.00 0.00 N ATOM 660 NH2 ARG A 939 10.779 4.060 14.577 1.00 0.00 N ATOM 0 H ARG A 939 9.453 1.568 7.999 1.00 0.00 H new ATOM 0 HA ARG A 939 10.684 4.044 7.285 1.00 0.00 H new ATOM 0 HB2 ARG A 939 11.546 1.593 8.855 1.00 0.00 H new ATOM 0 HB3 ARG A 939 12.607 2.966 8.614 1.00 0.00 H new ATOM 0 HG2 ARG A 939 10.970 4.447 9.726 1.00 0.00 H new ATOM 0 HG3 ARG A 939 9.872 3.098 9.933 1.00 0.00 H new ATOM 0 HD2 ARG A 939 11.605 1.918 11.296 1.00 0.00 H new ATOM 0 HD3 ARG A 939 12.670 3.297 11.115 1.00 0.00 H new ATOM 0 HE ARG A 939 10.209 4.260 12.163 1.00 0.00 H new ATOM 0 HH11 ARG A 939 12.903 2.165 13.073 1.00 0.00 H new ATOM 0 HH12 ARG A 939 12.728 2.496 14.799 1.00 0.00 H new ATOM 0 HH21 ARG A 939 9.993 4.680 14.384 1.00 0.00 H new ATOM 0 HH22 ARG A 939 11.088 3.913 15.538 1.00 0.00 H new ATOM 674 N PRO A 940 12.534 3.517 5.655 1.00 0.00 N ATOM 675 CA PRO A 940 13.450 3.265 4.536 1.00 0.00 C ATOM 676 C PRO A 940 14.447 2.155 4.857 1.00 0.00 C ATOM 677 O PRO A 940 14.993 2.108 5.960 1.00 0.00 O ATOM 678 CB PRO A 940 14.180 4.601 4.361 1.00 0.00 C ATOM 679 CG PRO A 940 13.282 5.619 4.974 1.00 0.00 C ATOM 680 CD PRO A 940 12.571 4.922 6.098 1.00 0.00 C ATOM 0 HA PRO A 940 12.923 2.935 3.641 1.00 0.00 H new ATOM 0 HB2 PRO A 940 15.152 4.586 4.853 1.00 0.00 H new ATOM 0 HB3 PRO A 940 14.359 4.817 3.308 1.00 0.00 H new ATOM 0 HG2 PRO A 940 13.853 6.471 5.343 1.00 0.00 H new ATOM 0 HG3 PRO A 940 12.572 6.004 4.242 1.00 0.00 H new ATOM 0 HD2 PRO A 940 13.105 5.032 7.042 1.00 0.00 H new ATOM 0 HD3 PRO A 940 11.569 5.323 6.250 1.00 0.00 H new ATOM 688 N PHE A 941 14.682 1.260 3.898 1.00 0.00 N ATOM 689 CA PHE A 941 15.618 0.161 4.116 1.00 0.00 C ATOM 690 C PHE A 941 17.037 0.552 3.713 1.00 0.00 C ATOM 691 O PHE A 941 17.289 0.999 2.593 1.00 0.00 O ATOM 692 CB PHE A 941 15.161 -1.106 3.384 1.00 0.00 C ATOM 693 CG PHE A 941 14.896 -0.926 1.918 1.00 0.00 C ATOM 694 CD1 PHE A 941 15.934 -0.926 1.002 1.00 0.00 C ATOM 695 CD2 PHE A 941 13.600 -0.782 1.455 1.00 0.00 C ATOM 696 CE1 PHE A 941 15.684 -0.779 -0.348 1.00 0.00 C ATOM 697 CE2 PHE A 941 13.343 -0.639 0.107 1.00 0.00 C ATOM 698 CZ PHE A 941 14.386 -0.637 -0.795 1.00 0.00 C ATOM 0 H PHE A 941 14.244 1.274 2.977 1.00 0.00 H new ATOM 0 HA PHE A 941 15.629 -0.058 5.184 1.00 0.00 H new ATOM 0 HB2 PHE A 941 15.923 -1.875 3.509 1.00 0.00 H new ATOM 0 HB3 PHE A 941 14.253 -1.476 3.860 1.00 0.00 H new ATOM 0 HD1 PHE A 941 16.951 -1.042 1.347 1.00 0.00 H new ATOM 0 HD2 PHE A 941 12.780 -0.782 2.157 1.00 0.00 H new ATOM 0 HE1 PHE A 941 16.502 -0.775 -1.053 1.00 0.00 H new ATOM 0 HE2 PHE A 941 12.327 -0.529 -0.241 1.00 0.00 H new ATOM 0 HZ PHE A 941 14.187 -0.524 -1.851 1.00 0.00 H new ATOM 708 N SER A 942 17.948 0.400 4.664 1.00 0.00 N ATOM 709 CA SER A 942 19.356 0.741 4.471 1.00 0.00 C ATOM 710 C SER A 942 20.105 -0.286 3.624 1.00 0.00 C ATOM 711 O SER A 942 20.973 0.067 2.837 1.00 0.00 O ATOM 712 CB SER A 942 20.040 0.899 5.826 1.00 0.00 C ATOM 713 OG SER A 942 19.933 -0.287 6.595 1.00 0.00 O ATOM 0 H SER A 942 17.735 0.037 5.593 1.00 0.00 H new ATOM 0 HA SER A 942 19.385 1.683 3.924 1.00 0.00 H new ATOM 0 HB2 SER A 942 21.091 1.147 5.679 1.00 0.00 H new ATOM 0 HB3 SER A 942 19.590 1.730 6.369 1.00 0.00 H new ATOM 0 HG SER A 942 20.381 -0.159 7.457 1.00 0.00 H new ATOM 719 N ILE A 943 19.790 -1.552 3.829 1.00 0.00 N ATOM 720 CA ILE A 943 20.446 -2.658 3.122 1.00 0.00 C ATOM 721 C ILE A 943 21.969 -2.536 3.171 1.00 0.00 C ATOM 722 O ILE A 943 22.591 -1.855 2.349 1.00 0.00 O ATOM 723 CB ILE A 943 19.966 -2.833 1.659 1.00 0.00 C ATOM 724 CG1 ILE A 943 20.200 -1.580 0.811 1.00 0.00 C ATOM 725 CG2 ILE A 943 18.496 -3.214 1.635 1.00 0.00 C ATOM 726 CD1 ILE A 943 19.905 -1.793 -0.658 1.00 0.00 C ATOM 0 H ILE A 943 19.073 -1.852 4.489 1.00 0.00 H new ATOM 0 HA ILE A 943 20.147 -3.558 3.659 1.00 0.00 H new ATOM 0 HB ILE A 943 20.560 -3.634 1.219 1.00 0.00 H new ATOM 0 HG12 ILE A 943 19.573 -0.772 1.188 1.00 0.00 H new ATOM 0 HG13 ILE A 943 21.236 -1.260 0.925 1.00 0.00 H new ATOM 0 HG21 ILE A 943 18.168 -3.335 0.602 1.00 0.00 H new ATOM 0 HG22 ILE A 943 18.354 -4.152 2.173 1.00 0.00 H new ATOM 0 HG23 ILE A 943 17.909 -2.430 2.113 1.00 0.00 H new ATOM 0 HD11 ILE A 943 20.090 -0.868 -1.204 1.00 0.00 H new ATOM 0 HD12 ILE A 943 20.550 -2.580 -1.048 1.00 0.00 H new ATOM 0 HD13 ILE A 943 18.862 -2.084 -0.781 1.00 0.00 H new ATOM 738 N THR A 944 22.550 -3.202 4.166 1.00 0.00 N ATOM 739 CA THR A 944 23.995 -3.210 4.388 1.00 0.00 C ATOM 740 C THR A 944 24.713 -4.258 3.540 1.00 0.00 C ATOM 741 O THR A 944 24.253 -5.394 3.437 1.00 0.00 O ATOM 742 CB THR A 944 24.313 -3.505 5.867 1.00 0.00 C ATOM 743 OG1 THR A 944 24.001 -2.369 6.683 1.00 0.00 O ATOM 744 CG2 THR A 944 25.774 -3.893 6.050 1.00 0.00 C ATOM 0 H THR A 944 22.028 -3.755 4.846 1.00 0.00 H new ATOM 0 HA THR A 944 24.349 -2.220 4.101 1.00 0.00 H new ATOM 0 HB THR A 944 23.695 -4.347 6.179 1.00 0.00 H new ATOM 0 HG1 THR A 944 23.037 -2.345 6.856 1.00 0.00 H new ATOM 0 HG21 THR A 944 25.968 -4.095 7.103 1.00 0.00 H new ATOM 0 HG22 THR A 944 25.989 -4.786 5.464 1.00 0.00 H new ATOM 0 HG23 THR A 944 26.412 -3.076 5.714 1.00 0.00 H new ATOM 752 N CYS A 945 25.878 -3.900 2.999 1.00 0.00 N ATOM 753 CA CYS A 945 26.675 -4.860 2.246 1.00 0.00 C ATOM 754 C CYS A 945 27.300 -5.817 3.238 1.00 0.00 C ATOM 755 O CYS A 945 27.859 -5.400 4.252 1.00 0.00 O ATOM 756 CB CYS A 945 27.752 -4.172 1.407 1.00 0.00 C ATOM 757 SG CYS A 945 27.109 -3.213 0.000 1.00 0.00 S ATOM 0 H CYS A 945 26.283 -2.967 3.068 1.00 0.00 H new ATOM 0 HA CYS A 945 26.034 -5.395 1.546 1.00 0.00 H new ATOM 0 HB2 CYS A 945 28.328 -3.508 2.051 1.00 0.00 H new ATOM 0 HB3 CYS A 945 28.441 -4.928 1.031 1.00 0.00 H new ATOM 762 N LEU A 946 27.136 -7.098 2.984 1.00 0.00 N ATOM 763 CA LEU A 946 27.613 -8.115 3.903 1.00 0.00 C ATOM 764 C LEU A 946 29.081 -8.457 3.764 1.00 0.00 C ATOM 765 O LEU A 946 29.860 -8.224 4.688 1.00 0.00 O ATOM 766 CB LEU A 946 26.743 -9.351 3.763 1.00 0.00 C ATOM 767 CG LEU A 946 25.277 -9.078 4.064 1.00 0.00 C ATOM 768 CD1 LEU A 946 25.164 -8.257 5.334 1.00 0.00 C ATOM 769 CD2 LEU A 946 24.627 -8.371 2.901 1.00 0.00 C ATOM 0 H LEU A 946 26.676 -7.462 2.149 1.00 0.00 H new ATOM 0 HA LEU A 946 27.529 -7.698 4.907 1.00 0.00 H new ATOM 0 HB2 LEU A 946 26.834 -9.741 2.749 1.00 0.00 H new ATOM 0 HB3 LEU A 946 27.109 -10.126 4.437 1.00 0.00 H new ATOM 0 HG LEU A 946 24.756 -10.023 4.214 1.00 0.00 H new ATOM 0 HD11 LEU A 946 24.113 -8.062 5.549 1.00 0.00 H new ATOM 0 HD12 LEU A 946 25.608 -8.807 6.164 1.00 0.00 H new ATOM 0 HD13 LEU A 946 25.689 -7.311 5.204 1.00 0.00 H new ATOM 0 HD21 LEU A 946 23.578 -8.182 3.130 1.00 0.00 H new ATOM 0 HD22 LEU A 946 25.135 -7.424 2.721 1.00 0.00 H new ATOM 0 HD23 LEU A 946 24.697 -8.996 2.010 1.00 0.00 H new ATOM 781 N ASP A 947 29.451 -9.035 2.636 1.00 0.00 N ATOM 782 CA ASP A 947 30.833 -9.442 2.425 1.00 0.00 C ATOM 783 C ASP A 947 30.987 -10.239 1.136 1.00 0.00 C ATOM 784 O ASP A 947 31.948 -10.049 0.390 1.00 0.00 O ATOM 785 CB ASP A 947 31.287 -10.286 3.616 1.00 0.00 C ATOM 786 CG ASP A 947 32.679 -10.859 3.433 1.00 0.00 C ATOM 787 OD1 ASP A 947 33.632 -10.065 3.276 1.00 0.00 O ATOM 788 OD2 ASP A 947 32.817 -12.100 3.446 1.00 0.00 O ATOM 0 H ASP A 947 28.823 -9.233 1.857 1.00 0.00 H new ATOM 0 HA ASP A 947 31.452 -8.549 2.338 1.00 0.00 H new ATOM 0 HB2 ASP A 947 31.266 -9.674 4.518 1.00 0.00 H new ATOM 0 HB3 ASP A 947 30.580 -11.102 3.768 1.00 0.00 H new ATOM 793 N ASN A 948 30.035 -11.123 0.870 1.00 0.00 N ATOM 794 CA ASN A 948 30.073 -11.931 -0.340 1.00 0.00 C ATOM 795 C ASN A 948 29.443 -11.165 -1.494 1.00 0.00 C ATOM 796 O ASN A 948 28.685 -11.723 -2.289 1.00 0.00 O ATOM 797 CB ASN A 948 29.341 -13.257 -0.122 1.00 0.00 C ATOM 798 CG ASN A 948 29.973 -14.092 0.975 1.00 0.00 C ATOM 799 OD1 ASN A 948 31.139 -14.475 0.887 1.00 0.00 O ATOM 800 ND2 ASN A 948 29.202 -14.378 2.018 1.00 0.00 N ATOM 0 H ASN A 948 29.231 -11.298 1.473 1.00 0.00 H new ATOM 0 HA ASN A 948 31.113 -12.148 -0.584 1.00 0.00 H new ATOM 0 HB2 ASN A 948 28.300 -13.057 0.131 1.00 0.00 H new ATOM 0 HB3 ASN A 948 29.339 -13.825 -1.052 1.00 0.00 H new ATOM 0 HD21 ASN A 948 29.572 -14.936 2.788 1.00 0.00 H new ATOM 0 HD22 ASN A 948 28.240 -14.040 2.049 1.00 0.00 H new ATOM 807 N LEU A 949 29.761 -9.874 -1.572 1.00 0.00 N ATOM 808 CA LEU A 949 29.230 -9.011 -2.617 1.00 0.00 C ATOM 809 C LEU A 949 27.710 -9.097 -2.652 1.00 0.00 C ATOM 810 O LEU A 949 27.109 -9.289 -3.710 1.00 0.00 O ATOM 811 CB LEU A 949 29.821 -9.394 -3.973 1.00 0.00 C ATOM 812 CG LEU A 949 31.351 -9.405 -4.026 1.00 0.00 C ATOM 813 CD1 LEU A 949 31.833 -9.738 -5.429 1.00 0.00 C ATOM 814 CD2 LEU A 949 31.913 -8.065 -3.572 1.00 0.00 C ATOM 0 H LEU A 949 30.387 -9.404 -0.919 1.00 0.00 H new ATOM 0 HA LEU A 949 29.512 -7.981 -2.397 1.00 0.00 H new ATOM 0 HB2 LEU A 949 29.455 -10.383 -4.247 1.00 0.00 H new ATOM 0 HB3 LEU A 949 29.450 -8.697 -4.725 1.00 0.00 H new ATOM 0 HG LEU A 949 31.712 -10.176 -3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 949 32.923 -9.741 -5.448 1.00 0.00 H new ATOM 0 HD12 LEU A 949 31.462 -10.722 -5.717 1.00 0.00 H new ATOM 0 HD13 LEU A 949 31.460 -8.990 -6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 949 33.002 -8.093 -3.617 1.00 0.00 H new ATOM 0 HD22 LEU A 949 31.543 -7.275 -4.226 1.00 0.00 H new ATOM 0 HD23 LEU A 949 31.597 -7.866 -2.548 1.00 0.00 H new ATOM 826 N VAL A 950 27.096 -8.963 -1.481 1.00 0.00 N ATOM 827 CA VAL A 950 25.648 -9.036 -1.364 1.00 0.00 C ATOM 828 C VAL A 950 25.085 -7.889 -0.544 1.00 0.00 C ATOM 829 O VAL A 950 25.823 -7.060 -0.003 1.00 0.00 O ATOM 830 CB VAL A 950 25.200 -10.353 -0.709 1.00 0.00 C ATOM 831 CG1 VAL A 950 25.349 -11.512 -1.672 1.00 0.00 C ATOM 832 CG2 VAL A 950 25.975 -10.605 0.576 1.00 0.00 C ATOM 0 H VAL A 950 27.582 -8.803 -0.599 1.00 0.00 H new ATOM 0 HA VAL A 950 25.265 -8.978 -2.383 1.00 0.00 H new ATOM 0 HB VAL A 950 24.144 -10.266 -0.454 1.00 0.00 H new ATOM 0 HG11 VAL A 950 25.026 -12.433 -1.186 1.00 0.00 H new ATOM 0 HG12 VAL A 950 24.735 -11.333 -2.555 1.00 0.00 H new ATOM 0 HG13 VAL A 950 26.393 -11.606 -1.969 1.00 0.00 H new ATOM 0 HG21 VAL A 950 25.643 -11.542 1.024 1.00 0.00 H new ATOM 0 HG22 VAL A 950 27.040 -10.667 0.352 1.00 0.00 H new ATOM 0 HG23 VAL A 950 25.798 -9.787 1.274 1.00 0.00 H new ATOM 842 N TRP A 951 23.763 -7.871 -0.442 1.00 0.00 N ATOM 843 CA TRP A 951 23.058 -6.854 0.313 1.00 0.00 C ATOM 844 C TRP A 951 21.978 -7.500 1.165 1.00 0.00 C ATOM 845 O TRP A 951 21.148 -8.260 0.662 1.00 0.00 O ATOM 846 CB TRP A 951 22.413 -5.829 -0.624 1.00 0.00 C ATOM 847 CG TRP A 951 23.391 -5.049 -1.447 1.00 0.00 C ATOM 848 CD1 TRP A 951 24.159 -5.509 -2.480 1.00 0.00 C ATOM 849 CD2 TRP A 951 23.705 -3.661 -1.303 1.00 0.00 C ATOM 850 NE1 TRP A 951 24.925 -4.488 -2.990 1.00 0.00 N ATOM 851 CE2 TRP A 951 24.665 -3.344 -2.281 1.00 0.00 C ATOM 852 CE3 TRP A 951 23.263 -2.657 -0.441 1.00 0.00 C ATOM 853 CZ2 TRP A 951 25.190 -2.062 -2.419 1.00 0.00 C ATOM 854 CZ3 TRP A 951 23.783 -1.387 -0.577 1.00 0.00 C ATOM 855 CH2 TRP A 951 24.738 -1.098 -1.560 1.00 0.00 C ATOM 0 H TRP A 951 23.154 -8.561 -0.881 1.00 0.00 H new ATOM 0 HA TRP A 951 23.779 -6.344 0.952 1.00 0.00 H new ATOM 0 HB2 TRP A 951 21.725 -6.347 -1.292 1.00 0.00 H new ATOM 0 HB3 TRP A 951 21.819 -5.134 -0.030 1.00 0.00 H new ATOM 0 HD1 TRP A 951 24.163 -6.526 -2.843 1.00 0.00 H new ATOM 0 HE1 TRP A 951 25.579 -4.568 -3.768 1.00 0.00 H new ATOM 0 HE3 TRP A 951 22.527 -2.871 0.319 1.00 0.00 H new ATOM 0 HZ2 TRP A 951 25.927 -1.837 -3.176 1.00 0.00 H new ATOM 0 HZ3 TRP A 951 23.448 -0.602 0.085 1.00 0.00 H new ATOM 0 HH2 TRP A 951 25.126 -0.093 -1.642 1.00 0.00 H new ATOM 866 N SER A 952 22.007 -7.199 2.455 1.00 0.00 N ATOM 867 CA SER A 952 21.042 -7.744 3.401 1.00 0.00 C ATOM 868 C SER A 952 19.642 -7.722 2.799 1.00 0.00 C ATOM 869 O SER A 952 19.325 -6.860 1.978 1.00 0.00 O ATOM 870 CB SER A 952 21.079 -6.951 4.709 1.00 0.00 C ATOM 871 OG SER A 952 22.409 -6.793 5.170 1.00 0.00 O ATOM 0 H SER A 952 22.695 -6.574 2.874 1.00 0.00 H new ATOM 0 HA SER A 952 21.307 -8.779 3.617 1.00 0.00 H new ATOM 0 HB2 SER A 952 20.624 -5.972 4.558 1.00 0.00 H new ATOM 0 HB3 SER A 952 20.486 -7.464 5.466 1.00 0.00 H new ATOM 0 HG SER A 952 22.449 -6.992 6.129 1.00 0.00 H new ATOM 877 N SER A 953 18.814 -8.685 3.184 1.00 0.00 N ATOM 878 CA SER A 953 17.463 -8.777 2.645 1.00 0.00 C ATOM 879 C SER A 953 16.533 -7.748 3.279 1.00 0.00 C ATOM 880 O SER A 953 16.347 -7.730 4.497 1.00 0.00 O ATOM 881 CB SER A 953 16.901 -10.181 2.865 1.00 0.00 C ATOM 882 OG SER A 953 15.612 -10.310 2.293 1.00 0.00 O ATOM 0 H SER A 953 19.052 -9.409 3.863 1.00 0.00 H new ATOM 0 HA SER A 953 17.521 -8.569 1.577 1.00 0.00 H new ATOM 0 HB2 SER A 953 17.573 -10.918 2.425 1.00 0.00 H new ATOM 0 HB3 SER A 953 16.851 -10.393 3.933 1.00 0.00 H new ATOM 0 HG SER A 953 15.276 -11.218 2.446 1.00 0.00 H new ATOM 888 N PRO A 954 15.934 -6.876 2.448 1.00 0.00 N ATOM 889 CA PRO A 954 15.010 -5.835 2.898 1.00 0.00 C ATOM 890 C PRO A 954 13.636 -6.405 3.230 1.00 0.00 C ATOM 891 O PRO A 954 12.624 -5.981 2.671 1.00 0.00 O ATOM 892 CB PRO A 954 14.917 -4.879 1.695 1.00 0.00 C ATOM 893 CG PRO A 954 15.923 -5.373 0.705 1.00 0.00 C ATOM 894 CD PRO A 954 16.106 -6.832 0.993 1.00 0.00 C ATOM 0 HA PRO A 954 15.356 -5.349 3.810 1.00 0.00 H new ATOM 0 HB2 PRO A 954 13.914 -4.883 1.269 1.00 0.00 H new ATOM 0 HB3 PRO A 954 15.133 -3.853 1.993 1.00 0.00 H new ATOM 0 HG2 PRO A 954 15.574 -5.218 -0.316 1.00 0.00 H new ATOM 0 HG3 PRO A 954 16.865 -4.835 0.805 1.00 0.00 H new ATOM 0 HD2 PRO A 954 15.369 -7.446 0.476 1.00 0.00 H new ATOM 0 HD3 PRO A 954 17.089 -7.189 0.687 1.00 0.00 H new ATOM 902 N LYS A 955 13.610 -7.375 4.134 1.00 0.00 N ATOM 903 CA LYS A 955 12.364 -8.015 4.533 1.00 0.00 C ATOM 904 C LYS A 955 11.572 -7.104 5.462 1.00 0.00 C ATOM 905 O LYS A 955 12.078 -6.670 6.498 1.00 0.00 O ATOM 906 CB LYS A 955 12.662 -9.346 5.228 1.00 0.00 C ATOM 907 CG LYS A 955 11.428 -10.194 5.486 1.00 0.00 C ATOM 908 CD LYS A 955 11.784 -11.482 6.210 1.00 0.00 C ATOM 909 CE LYS A 955 10.566 -12.373 6.396 1.00 0.00 C ATOM 910 NZ LYS A 955 9.980 -12.792 5.093 1.00 0.00 N ATOM 0 H LYS A 955 14.439 -7.736 4.606 1.00 0.00 H new ATOM 0 HA LYS A 955 11.766 -8.205 3.642 1.00 0.00 H new ATOM 0 HB2 LYS A 955 13.361 -9.916 4.616 1.00 0.00 H new ATOM 0 HB3 LYS A 955 13.159 -9.146 6.177 1.00 0.00 H new ATOM 0 HG2 LYS A 955 10.712 -9.626 6.080 1.00 0.00 H new ATOM 0 HG3 LYS A 955 10.941 -10.429 4.539 1.00 0.00 H new ATOM 0 HD2 LYS A 955 12.546 -12.019 5.645 1.00 0.00 H new ATOM 0 HD3 LYS A 955 12.215 -11.246 7.183 1.00 0.00 H new ATOM 0 HE2 LYS A 955 10.847 -13.257 6.969 1.00 0.00 H new ATOM 0 HE3 LYS A 955 9.813 -11.842 6.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 9.338 -13.596 5.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 9.450 -11.999 4.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 10.742 -13.074 4.444 1.00 0.00 H new ATOM 924 N ASP A 956 10.332 -6.807 5.078 1.00 0.00 N ATOM 925 CA ASP A 956 9.470 -5.933 5.867 1.00 0.00 C ATOM 926 C ASP A 956 10.130 -4.572 6.063 1.00 0.00 C ATOM 927 O ASP A 956 10.983 -4.408 6.935 1.00 0.00 O ATOM 928 CB ASP A 956 9.159 -6.570 7.223 1.00 0.00 C ATOM 929 CG ASP A 956 8.378 -7.863 7.092 1.00 0.00 C ATOM 930 OD1 ASP A 956 8.884 -8.797 6.435 1.00 0.00 O ATOM 931 OD2 ASP A 956 7.262 -7.940 7.647 1.00 0.00 O ATOM 0 H ASP A 956 9.902 -7.160 4.223 1.00 0.00 H new ATOM 0 HA ASP A 956 8.534 -5.793 5.326 1.00 0.00 H new ATOM 0 HB2 ASP A 956 10.092 -6.765 7.752 1.00 0.00 H new ATOM 0 HB3 ASP A 956 8.590 -5.866 7.830 1.00 0.00 H new ATOM 936 N VAL A 957 9.738 -3.599 5.243 1.00 0.00 N ATOM 937 CA VAL A 957 10.308 -2.258 5.327 1.00 0.00 C ATOM 938 C VAL A 957 9.325 -1.187 4.870 1.00 0.00 C ATOM 939 O VAL A 957 9.361 -0.060 5.360 1.00 0.00 O ATOM 940 CB VAL A 957 11.590 -2.131 4.478 1.00 0.00 C ATOM 941 CG1 VAL A 957 12.735 -2.932 5.077 1.00 0.00 C ATOM 942 CG2 VAL A 957 11.326 -2.562 3.046 1.00 0.00 C ATOM 0 H VAL A 957 9.031 -3.714 4.516 1.00 0.00 H new ATOM 0 HA VAL A 957 10.545 -2.103 6.379 1.00 0.00 H new ATOM 0 HB VAL A 957 11.886 -1.082 4.476 1.00 0.00 H new ATOM 0 HG11 VAL A 957 13.622 -2.820 4.454 1.00 0.00 H new ATOM 0 HG12 VAL A 957 12.948 -2.566 6.081 1.00 0.00 H new ATOM 0 HG13 VAL A 957 12.456 -3.985 5.126 1.00 0.00 H new ATOM 0 HG21 VAL A 957 12.242 -2.466 2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 957 10.996 -3.601 3.034 1.00 0.00 H new ATOM 0 HG23 VAL A 957 10.551 -1.930 2.613 1.00 0.00 H new ATOM 952 N CYS A 958 8.465 -1.531 3.919 1.00 0.00 N ATOM 953 CA CYS A 958 7.497 -0.570 3.392 1.00 0.00 C ATOM 954 C CYS A 958 6.228 -1.240 2.870 1.00 0.00 C ATOM 955 O CYS A 958 5.933 -1.178 1.677 1.00 0.00 O ATOM 956 CB CYS A 958 8.130 0.253 2.267 1.00 0.00 C ATOM 957 SG CYS A 958 9.505 1.323 2.795 1.00 0.00 S ATOM 0 H CYS A 958 8.416 -2.459 3.498 1.00 0.00 H new ATOM 0 HA CYS A 958 7.214 0.077 4.222 1.00 0.00 H new ATOM 0 HB2 CYS A 958 8.491 -0.427 1.496 1.00 0.00 H new ATOM 0 HB3 CYS A 958 7.359 0.873 1.810 1.00 0.00 H new ATOM 962 N LYS A 959 5.465 -1.860 3.766 1.00 0.00 N ATOM 963 CA LYS A 959 4.217 -2.509 3.377 1.00 0.00 C ATOM 964 C LYS A 959 3.262 -1.476 2.777 1.00 0.00 C ATOM 965 O LYS A 959 3.162 -0.356 3.278 1.00 0.00 O ATOM 966 CB LYS A 959 3.576 -3.189 4.587 1.00 0.00 C ATOM 967 CG LYS A 959 4.481 -4.213 5.255 1.00 0.00 C ATOM 968 CD LYS A 959 4.798 -5.374 4.325 1.00 0.00 C ATOM 969 CE LYS A 959 5.717 -6.386 4.991 1.00 0.00 C ATOM 970 NZ LYS A 959 6.031 -7.529 4.090 1.00 0.00 N ATOM 0 H LYS A 959 5.687 -1.927 4.759 1.00 0.00 H new ATOM 0 HA LYS A 959 4.430 -3.270 2.627 1.00 0.00 H new ATOM 0 HB2 LYS A 959 3.299 -2.429 5.317 1.00 0.00 H new ATOM 0 HB3 LYS A 959 2.655 -3.680 4.273 1.00 0.00 H new ATOM 0 HG2 LYS A 959 5.408 -3.732 5.566 1.00 0.00 H new ATOM 0 HG3 LYS A 959 4.000 -4.590 6.157 1.00 0.00 H new ATOM 0 HD2 LYS A 959 3.872 -5.864 4.025 1.00 0.00 H new ATOM 0 HD3 LYS A 959 5.268 -4.996 3.417 1.00 0.00 H new ATOM 0 HE2 LYS A 959 6.643 -5.894 5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 959 5.247 -6.760 5.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 6.660 -8.196 4.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 5.150 -8.014 3.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 6.503 -7.176 3.233 1.00 0.00 H new ATOM 984 N ARG A 960 2.586 -1.839 1.689 1.00 0.00 N ATOM 985 CA ARG A 960 1.674 -0.913 1.019 1.00 0.00 C ATOM 986 C ARG A 960 0.554 -0.439 1.936 1.00 0.00 C ATOM 987 O ARG A 960 -0.072 -1.234 2.638 1.00 0.00 O ATOM 988 CB ARG A 960 1.046 -1.543 -0.224 1.00 0.00 C ATOM 989 CG ARG A 960 0.264 -0.532 -1.048 1.00 0.00 C ATOM 990 CD ARG A 960 -0.429 -1.171 -2.235 1.00 0.00 C ATOM 991 NE ARG A 960 0.517 -1.767 -3.174 1.00 0.00 N ATOM 992 CZ ARG A 960 0.152 -2.399 -4.285 1.00 0.00 C ATOM 993 NH1 ARG A 960 -1.133 -2.513 -4.596 1.00 0.00 N ATOM 994 NH2 ARG A 960 1.071 -2.916 -5.089 1.00 0.00 N ATOM 0 H ARG A 960 2.651 -2.760 1.255 1.00 0.00 H new ATOM 0 HA ARG A 960 2.283 -0.056 0.731 1.00 0.00 H new ATOM 0 HB2 ARG A 960 1.829 -1.984 -0.841 1.00 0.00 H new ATOM 0 HB3 ARG A 960 0.383 -2.354 0.077 1.00 0.00 H new ATOM 0 HG2 ARG A 960 -0.478 -0.047 -0.415 1.00 0.00 H new ATOM 0 HG3 ARG A 960 0.940 0.247 -1.401 1.00 0.00 H new ATOM 0 HD2 ARG A 960 -1.118 -1.938 -1.881 1.00 0.00 H new ATOM 0 HD3 ARG A 960 -1.026 -0.420 -2.752 1.00 0.00 H new ATOM 0 HE ARG A 960 1.513 -1.694 -2.966 1.00 0.00 H new ATOM 0 HH11 ARG A 960 -1.844 -2.115 -3.982 1.00 0.00 H new ATOM 0 HH12 ARG A 960 -1.410 -2.998 -5.449 1.00 0.00 H new ATOM 0 HH21 ARG A 960 2.060 -2.829 -4.855 1.00 0.00 H new ATOM 0 HH22 ARG A 960 0.789 -3.401 -5.941 1.00 0.00 H new ATOM 1008 N LYS A 961 0.290 0.863 1.891 1.00 0.00 N ATOM 1009 CA LYS A 961 -0.777 1.461 2.681 1.00 0.00 C ATOM 1010 C LYS A 961 -2.113 0.804 2.358 1.00 0.00 C ATOM 1011 O LYS A 961 -2.357 0.410 1.219 1.00 0.00 O ATOM 1012 CB LYS A 961 -0.854 2.964 2.414 1.00 0.00 C ATOM 1013 CG LYS A 961 0.339 3.733 2.957 1.00 0.00 C ATOM 1014 CD LYS A 961 0.161 5.231 2.792 1.00 0.00 C ATOM 1015 CE LYS A 961 1.303 6.000 3.438 1.00 0.00 C ATOM 1016 NZ LYS A 961 1.130 7.473 3.303 1.00 0.00 N ATOM 0 H LYS A 961 0.805 1.526 1.312 1.00 0.00 H new ATOM 0 HA LYS A 961 -0.556 1.300 3.736 1.00 0.00 H new ATOM 0 HB2 LYS A 961 -0.927 3.132 1.339 1.00 0.00 H new ATOM 0 HB3 LYS A 961 -1.766 3.359 2.861 1.00 0.00 H new ATOM 0 HG2 LYS A 961 0.475 3.496 4.012 1.00 0.00 H new ATOM 0 HG3 LYS A 961 1.244 3.414 2.440 1.00 0.00 H new ATOM 0 HD2 LYS A 961 0.108 5.478 1.732 1.00 0.00 H new ATOM 0 HD3 LYS A 961 -0.785 5.538 3.239 1.00 0.00 H new ATOM 0 HE2 LYS A 961 1.365 5.738 4.494 1.00 0.00 H new ATOM 0 HE3 LYS A 961 2.246 5.702 2.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 1.464 7.943 4.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 1.681 7.814 2.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 0.124 7.692 3.156 1.00 0.00 H new ATOM 1030 N SER A 962 -2.975 0.690 3.361 1.00 0.00 N ATOM 1031 CA SER A 962 -4.282 0.073 3.167 1.00 0.00 C ATOM 1032 C SER A 962 -5.355 0.786 3.978 1.00 0.00 C ATOM 1033 O SER A 962 -5.148 1.129 5.141 1.00 0.00 O ATOM 1034 CB SER A 962 -4.240 -1.404 3.559 1.00 0.00 C ATOM 1035 OG SER A 962 -3.839 -1.563 4.908 1.00 0.00 O ATOM 0 H SER A 962 -2.795 1.014 4.311 1.00 0.00 H new ATOM 0 HA SER A 962 -4.533 0.159 2.110 1.00 0.00 H new ATOM 0 HB2 SER A 962 -5.224 -1.850 3.414 1.00 0.00 H new ATOM 0 HB3 SER A 962 -3.549 -1.937 2.906 1.00 0.00 H new ATOM 0 HG SER A 962 -3.822 -2.516 5.134 1.00 0.00 H new ATOM 1041 N CYS A 963 -6.505 0.991 3.350 1.00 0.00 N ATOM 1042 CA CYS A 963 -7.628 1.650 3.997 1.00 0.00 C ATOM 1043 C CYS A 963 -8.385 0.658 4.873 1.00 0.00 C ATOM 1044 O CYS A 963 -8.336 -0.550 4.635 1.00 0.00 O ATOM 1045 CB CYS A 963 -8.566 2.250 2.947 1.00 0.00 C ATOM 1046 SG CYS A 963 -7.776 3.457 1.832 1.00 0.00 S ATOM 0 H CYS A 963 -6.684 0.708 2.387 1.00 0.00 H new ATOM 0 HA CYS A 963 -7.247 2.455 4.626 1.00 0.00 H new ATOM 0 HB2 CYS A 963 -8.986 1.442 2.348 1.00 0.00 H new ATOM 0 HB3 CYS A 963 -9.399 2.735 3.456 1.00 0.00 H new ATOM 1051 N LYS A 964 -9.075 1.163 5.888 1.00 0.00 N ATOM 1052 CA LYS A 964 -9.827 0.305 6.795 1.00 0.00 C ATOM 1053 C LYS A 964 -10.980 -0.374 6.062 1.00 0.00 C ATOM 1054 O LYS A 964 -11.783 0.284 5.404 1.00 0.00 O ATOM 1055 CB LYS A 964 -10.364 1.119 7.975 1.00 0.00 C ATOM 1056 CG LYS A 964 -11.115 0.289 9.003 1.00 0.00 C ATOM 1057 CD LYS A 964 -10.210 -0.739 9.663 1.00 0.00 C ATOM 1058 CE LYS A 964 -10.959 -1.557 10.703 1.00 0.00 C ATOM 1059 NZ LYS A 964 -10.075 -2.553 11.368 1.00 0.00 N ATOM 0 H LYS A 964 -9.130 2.159 6.103 1.00 0.00 H new ATOM 0 HA LYS A 964 -9.154 -0.465 7.173 1.00 0.00 H new ATOM 0 HB2 LYS A 964 -9.531 1.622 8.466 1.00 0.00 H new ATOM 0 HB3 LYS A 964 -11.027 1.897 7.596 1.00 0.00 H new ATOM 0 HG2 LYS A 964 -11.536 0.946 9.764 1.00 0.00 H new ATOM 0 HG3 LYS A 964 -11.951 -0.218 8.521 1.00 0.00 H new ATOM 0 HD2 LYS A 964 -9.799 -1.404 8.903 1.00 0.00 H new ATOM 0 HD3 LYS A 964 -9.367 -0.234 10.134 1.00 0.00 H new ATOM 0 HE2 LYS A 964 -11.383 -0.890 11.453 1.00 0.00 H new ATOM 0 HE3 LYS A 964 -11.793 -2.073 10.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 -10.623 -3.090 12.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 -9.690 -3.206 10.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 -9.293 -2.060 11.844 1.00 0.00 H new ATOM 1073 N THR A 965 -11.051 -1.697 6.182 1.00 0.00 N ATOM 1074 CA THR A 965 -12.100 -2.471 5.530 1.00 0.00 C ATOM 1075 C THR A 965 -13.481 -1.982 5.961 1.00 0.00 C ATOM 1076 O THR A 965 -13.710 -1.719 7.142 1.00 0.00 O ATOM 1077 CB THR A 965 -11.973 -3.972 5.857 1.00 0.00 C ATOM 1078 OG1 THR A 965 -10.627 -4.408 5.637 1.00 0.00 O ATOM 1079 CG2 THR A 965 -12.918 -4.802 4.999 1.00 0.00 C ATOM 0 H THR A 965 -10.393 -2.255 6.726 1.00 0.00 H new ATOM 0 HA THR A 965 -11.983 -2.331 4.455 1.00 0.00 H new ATOM 0 HB THR A 965 -12.240 -4.112 6.904 1.00 0.00 H new ATOM 0 HG1 THR A 965 -10.554 -5.362 5.848 1.00 0.00 H new ATOM 0 HG21 THR A 965 -12.807 -5.857 5.251 1.00 0.00 H new ATOM 0 HG22 THR A 965 -13.946 -4.491 5.185 1.00 0.00 H new ATOM 0 HG23 THR A 965 -12.679 -4.654 3.946 1.00 0.00 H new ATOM 1087 N PRO A 966 -14.424 -1.851 5.008 1.00 0.00 N ATOM 1088 CA PRO A 966 -15.784 -1.392 5.300 1.00 0.00 C ATOM 1089 C PRO A 966 -16.395 -2.128 6.489 1.00 0.00 C ATOM 1090 O PRO A 966 -16.195 -3.332 6.651 1.00 0.00 O ATOM 1091 CB PRO A 966 -16.567 -1.704 4.012 1.00 0.00 C ATOM 1092 CG PRO A 966 -15.641 -2.507 3.155 1.00 0.00 C ATOM 1093 CD PRO A 966 -14.251 -2.137 3.580 1.00 0.00 C ATOM 0 HA PRO A 966 -15.805 -0.337 5.572 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -17.477 -2.262 4.233 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -16.870 -0.787 3.507 1.00 0.00 H new ATOM 0 HG2 PRO A 966 -15.817 -3.575 3.286 1.00 0.00 H new ATOM 0 HG3 PRO A 966 -15.797 -2.285 2.099 1.00 0.00 H new ATOM 0 HD2 PRO A 966 -13.545 -2.950 3.411 1.00 0.00 H new ATOM 0 HD3 PRO A 966 -13.876 -1.271 3.035 1.00 0.00 H new ATOM 1101 N PRO A 967 -17.137 -1.406 7.349 1.00 0.00 N ATOM 1102 CA PRO A 967 -17.769 -1.990 8.538 1.00 0.00 C ATOM 1103 C PRO A 967 -18.981 -2.857 8.204 1.00 0.00 C ATOM 1104 O PRO A 967 -20.042 -2.704 8.809 1.00 0.00 O ATOM 1105 CB PRO A 967 -18.195 -0.764 9.345 1.00 0.00 C ATOM 1106 CG PRO A 967 -18.413 0.299 8.327 1.00 0.00 C ATOM 1107 CD PRO A 967 -17.409 0.041 7.235 1.00 0.00 C ATOM 0 HA PRO A 967 -17.090 -2.659 9.068 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -19.104 -0.960 9.914 1.00 0.00 H new ATOM 0 HB3 PRO A 967 -17.426 -0.475 10.062 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -19.430 0.263 7.938 1.00 0.00 H new ATOM 0 HG3 PRO A 967 -18.272 1.289 8.761 1.00 0.00 H new ATOM 0 HD2 PRO A 967 -17.809 0.298 6.254 1.00 0.00 H new ATOM 0 HD3 PRO A 967 -16.504 0.632 7.375 1.00 0.00 H new ATOM 1115 N ASP A 968 -18.804 -3.769 7.247 1.00 0.00 N ATOM 1116 CA ASP A 968 -19.866 -4.683 6.820 1.00 0.00 C ATOM 1117 C ASP A 968 -21.260 -4.105 7.071 1.00 0.00 C ATOM 1118 O ASP A 968 -22.010 -4.612 7.906 1.00 0.00 O ATOM 1119 CB ASP A 968 -19.715 -6.033 7.529 1.00 0.00 C ATOM 1120 CG ASP A 968 -19.540 -5.892 9.030 1.00 0.00 C ATOM 1121 OD1 ASP A 968 -20.450 -5.348 9.689 1.00 0.00 O ATOM 1122 OD2 ASP A 968 -18.491 -6.328 9.547 1.00 0.00 O ATOM 0 H ASP A 968 -17.924 -3.895 6.747 1.00 0.00 H new ATOM 0 HA ASP A 968 -19.763 -4.825 5.744 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -20.594 -6.645 7.326 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -18.856 -6.561 7.116 1.00 0.00 H new ATOM 1127 N PRO A 969 -21.626 -3.030 6.345 1.00 0.00 N ATOM 1128 CA PRO A 969 -22.932 -2.383 6.490 1.00 0.00 C ATOM 1129 C PRO A 969 -24.064 -3.382 6.657 1.00 0.00 C ATOM 1130 O PRO A 969 -24.143 -4.382 5.942 1.00 0.00 O ATOM 1131 CB PRO A 969 -23.077 -1.616 5.180 1.00 0.00 C ATOM 1132 CG PRO A 969 -21.680 -1.250 4.808 1.00 0.00 C ATOM 1133 CD PRO A 969 -20.796 -2.360 5.323 1.00 0.00 C ATOM 0 HA PRO A 969 -22.986 -1.757 7.381 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -23.545 -2.229 4.410 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -23.700 -0.730 5.305 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -21.581 -1.144 3.728 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -21.399 -0.294 5.249 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -20.512 -3.047 4.526 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -19.873 -1.969 5.751 1.00 0.00 H new ATOM 1141 N VAL A 970 -24.930 -3.098 7.617 1.00 0.00 N ATOM 1142 CA VAL A 970 -26.061 -3.945 7.914 1.00 0.00 C ATOM 1143 C VAL A 970 -26.898 -4.228 6.670 1.00 0.00 C ATOM 1144 O VAL A 970 -27.224 -3.317 5.908 1.00 0.00 O ATOM 1145 CB VAL A 970 -26.934 -3.288 8.987 1.00 0.00 C ATOM 1146 CG1 VAL A 970 -27.222 -1.853 8.606 1.00 0.00 C ATOM 1147 CG2 VAL A 970 -28.209 -4.069 9.187 1.00 0.00 C ATOM 0 H VAL A 970 -24.863 -2.271 8.210 1.00 0.00 H new ATOM 0 HA VAL A 970 -25.677 -4.897 8.281 1.00 0.00 H new ATOM 0 HB VAL A 970 -26.396 -3.290 9.935 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -27.843 -1.391 9.373 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -26.284 -1.304 8.519 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -27.746 -1.828 7.651 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -28.815 -3.586 9.953 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -28.766 -4.102 8.251 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -27.968 -5.084 9.502 1.00 0.00 H new ATOM 1157 N ASN A 971 -27.240 -5.499 6.474 1.00 0.00 N ATOM 1158 CA ASN A 971 -28.040 -5.915 5.327 1.00 0.00 C ATOM 1159 C ASN A 971 -27.359 -5.546 4.012 1.00 0.00 C ATOM 1160 O ASN A 971 -27.962 -4.905 3.150 1.00 0.00 O ATOM 1161 CB ASN A 971 -29.433 -5.286 5.390 1.00 0.00 C ATOM 1162 CG ASN A 971 -30.199 -5.692 6.633 1.00 0.00 C ATOM 1163 OD1 ASN A 971 -30.415 -6.878 6.883 1.00 0.00 O ATOM 1164 ND2 ASN A 971 -30.621 -4.707 7.417 1.00 0.00 N ATOM 0 H ASN A 971 -26.974 -6.261 7.098 1.00 0.00 H new ATOM 0 HA ASN A 971 -28.137 -7.000 5.367 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -29.339 -4.200 5.364 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -30.000 -5.578 4.506 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -31.147 -4.920 8.265 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -30.419 -3.738 7.171 1.00 0.00 H new ATOM 1171 N GLY A 972 -26.104 -5.959 3.859 1.00 0.00 N ATOM 1172 CA GLY A 972 -25.373 -5.663 2.640 1.00 0.00 C ATOM 1173 C GLY A 972 -24.252 -6.650 2.380 1.00 0.00 C ATOM 1174 O GLY A 972 -24.319 -7.798 2.819 1.00 0.00 O ATOM 0 H GLY A 972 -25.582 -6.492 4.555 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -26.063 -5.671 1.796 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -24.959 -4.657 2.704 1.00 0.00 H new ATOM 1178 N MET A 973 -23.224 -6.203 1.659 1.00 0.00 N ATOM 1179 CA MET A 973 -22.084 -7.059 1.333 1.00 0.00 C ATOM 1180 C MET A 973 -21.095 -6.326 0.430 1.00 0.00 C ATOM 1181 O MET A 973 -21.468 -5.829 -0.633 1.00 0.00 O ATOM 1182 CB MET A 973 -22.575 -8.327 0.630 1.00 0.00 C ATOM 1183 CG MET A 973 -21.489 -9.358 0.376 1.00 0.00 C ATOM 1184 SD MET A 973 -22.099 -10.783 -0.546 1.00 0.00 S ATOM 1185 CE MET A 973 -23.501 -11.266 0.460 1.00 0.00 C ATOM 0 H MET A 973 -23.157 -5.254 1.290 1.00 0.00 H new ATOM 0 HA MET A 973 -21.577 -7.325 2.261 1.00 0.00 H new ATOM 0 HB2 MET A 973 -23.359 -8.783 1.234 1.00 0.00 H new ATOM 0 HB3 MET A 973 -23.027 -8.049 -0.322 1.00 0.00 H new ATOM 0 HG2 MET A 973 -20.672 -8.893 -0.176 1.00 0.00 H new ATOM 0 HG3 MET A 973 -21.079 -9.693 1.329 1.00 0.00 H new ATOM 0 HE1 MET A 973 -23.752 -12.307 0.258 1.00 0.00 H new ATOM 0 HE2 MET A 973 -23.249 -11.152 1.514 1.00 0.00 H new ATOM 0 HE3 MET A 973 -24.356 -10.633 0.221 1.00 0.00 H new ATOM 1195 N VAL A 974 -19.832 -6.269 0.848 1.00 0.00 N ATOM 1196 CA VAL A 974 -18.804 -5.602 0.056 1.00 0.00 C ATOM 1197 C VAL A 974 -18.085 -6.599 -0.838 1.00 0.00 C ATOM 1198 O VAL A 974 -18.247 -7.812 -0.701 1.00 0.00 O ATOM 1199 CB VAL A 974 -17.770 -4.857 0.934 1.00 0.00 C ATOM 1200 CG1 VAL A 974 -16.686 -5.804 1.435 1.00 0.00 C ATOM 1201 CG2 VAL A 974 -17.138 -3.714 0.153 1.00 0.00 C ATOM 0 H VAL A 974 -19.499 -6.673 1.723 1.00 0.00 H new ATOM 0 HA VAL A 974 -19.317 -4.860 -0.557 1.00 0.00 H new ATOM 0 HB VAL A 974 -18.297 -4.453 1.798 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -15.975 -5.251 2.049 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -17.141 -6.595 2.031 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -16.166 -6.244 0.584 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -16.413 -3.199 0.784 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -16.635 -4.110 -0.729 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -17.913 -3.012 -0.156 1.00 0.00 H new ATOM 1211 N HIS A 975 -17.307 -6.069 -1.761 1.00 0.00 N ATOM 1212 CA HIS A 975 -16.565 -6.881 -2.706 1.00 0.00 C ATOM 1213 C HIS A 975 -15.318 -6.123 -3.152 1.00 0.00 C ATOM 1214 O HIS A 975 -15.394 -5.164 -3.917 1.00 0.00 O ATOM 1215 CB HIS A 975 -17.495 -7.225 -3.869 1.00 0.00 C ATOM 1216 CG HIS A 975 -16.821 -7.530 -5.158 1.00 0.00 C ATOM 1217 ND1 HIS A 975 -15.976 -8.601 -5.354 1.00 0.00 N ATOM 1218 CD2 HIS A 975 -16.907 -6.893 -6.340 1.00 0.00 C ATOM 1219 CE1 HIS A 975 -15.569 -8.609 -6.611 1.00 0.00 C ATOM 1220 NE2 HIS A 975 -16.122 -7.581 -7.232 1.00 0.00 N ATOM 0 H HIS A 975 -17.171 -5.065 -1.877 1.00 0.00 H new ATOM 0 HA HIS A 975 -16.225 -7.814 -2.256 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -18.102 -8.084 -3.584 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -18.178 -6.390 -4.025 1.00 0.00 H new ATOM 0 HD1 HIS A 975 -15.707 -9.280 -4.642 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -17.486 -6.005 -6.548 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -14.900 -9.331 -7.055 1.00 0.00 H new ATOM 1229 N VAL A 976 -14.181 -6.539 -2.609 1.00 0.00 N ATOM 1230 CA VAL A 976 -12.898 -5.904 -2.866 1.00 0.00 C ATOM 1231 C VAL A 976 -12.404 -6.051 -4.304 1.00 0.00 C ATOM 1232 O VAL A 976 -11.595 -5.243 -4.762 1.00 0.00 O ATOM 1233 CB VAL A 976 -11.838 -6.469 -1.915 1.00 0.00 C ATOM 1234 CG1 VAL A 976 -12.180 -6.136 -0.470 1.00 0.00 C ATOM 1235 CG2 VAL A 976 -11.716 -7.962 -2.111 1.00 0.00 C ATOM 0 H VAL A 976 -14.125 -7.334 -1.972 1.00 0.00 H new ATOM 0 HA VAL A 976 -13.055 -4.839 -2.696 1.00 0.00 H new ATOM 0 HB VAL A 976 -10.877 -6.008 -2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 976 -11.415 -6.546 0.189 1.00 0.00 H new ATOM 0 HG12 VAL A 976 -12.223 -5.054 -0.346 1.00 0.00 H new ATOM 0 HG13 VAL A 976 -13.148 -6.569 -0.216 1.00 0.00 H new ATOM 0 HG21 VAL A 976 -10.961 -8.358 -1.432 1.00 0.00 H new ATOM 0 HG22 VAL A 976 -12.675 -8.436 -1.903 1.00 0.00 H new ATOM 0 HG23 VAL A 976 -11.424 -8.171 -3.140 1.00 0.00 H new ATOM 1245 N ILE A 977 -12.860 -7.090 -4.994 1.00 0.00 N ATOM 1246 CA ILE A 977 -12.430 -7.358 -6.371 1.00 0.00 C ATOM 1247 C ILE A 977 -11.032 -7.972 -6.383 1.00 0.00 C ATOM 1248 O ILE A 977 -10.764 -8.916 -7.128 1.00 0.00 O ATOM 1249 CB ILE A 977 -12.430 -6.086 -7.257 1.00 0.00 C ATOM 1250 CG1 ILE A 977 -13.851 -5.613 -7.541 1.00 0.00 C ATOM 1251 CG2 ILE A 977 -11.698 -6.325 -8.562 1.00 0.00 C ATOM 1252 CD1 ILE A 977 -14.364 -4.622 -6.532 1.00 0.00 C ATOM 0 H ILE A 977 -13.530 -7.765 -4.625 1.00 0.00 H new ATOM 0 HA ILE A 977 -13.154 -8.057 -6.789 1.00 0.00 H new ATOM 0 HB ILE A 977 -11.907 -5.307 -6.702 1.00 0.00 H new ATOM 0 HG12 ILE A 977 -13.884 -5.161 -8.532 1.00 0.00 H new ATOM 0 HG13 ILE A 977 -14.516 -6.476 -7.562 1.00 0.00 H new ATOM 0 HG21 ILE A 977 -11.716 -5.415 -9.161 1.00 0.00 H new ATOM 0 HG22 ILE A 977 -10.665 -6.603 -8.354 1.00 0.00 H new ATOM 0 HG23 ILE A 977 -12.187 -7.130 -9.111 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -15.380 -4.328 -6.795 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -14.363 -5.077 -5.542 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -13.721 -3.742 -6.527 1.00 0.00 H new ATOM 1264 N THR A 978 -10.147 -7.436 -5.546 1.00 0.00 N ATOM 1265 CA THR A 978 -8.779 -7.931 -5.449 1.00 0.00 C ATOM 1266 C THR A 978 -8.277 -7.844 -4.018 1.00 0.00 C ATOM 1267 O THR A 978 -7.916 -8.853 -3.413 1.00 0.00 O ATOM 1268 CB THR A 978 -7.818 -7.129 -6.345 1.00 0.00 C ATOM 1269 OG1 THR A 978 -7.800 -5.754 -5.941 1.00 0.00 O ATOM 1270 CG2 THR A 978 -8.228 -7.223 -7.799 1.00 0.00 C ATOM 0 H THR A 978 -10.356 -6.656 -4.923 1.00 0.00 H new ATOM 0 HA THR A 978 -8.798 -8.969 -5.781 1.00 0.00 H new ATOM 0 HB THR A 978 -6.820 -7.554 -6.236 1.00 0.00 H new ATOM 0 HG1 THR A 978 -7.185 -5.252 -6.516 1.00 0.00 H new ATOM 0 HG21 THR A 978 -7.533 -6.648 -8.411 1.00 0.00 H new ATOM 0 HG22 THR A 978 -8.212 -8.266 -8.115 1.00 0.00 H new ATOM 0 HG23 THR A 978 -9.235 -6.823 -7.920 1.00 0.00 H new ATOM 1278 N ASP A 979 -8.257 -6.627 -3.484 1.00 0.00 N ATOM 1279 CA ASP A 979 -7.794 -6.392 -2.126 1.00 0.00 C ATOM 1280 C ASP A 979 -8.375 -5.088 -1.584 1.00 0.00 C ATOM 1281 O ASP A 979 -9.497 -4.714 -1.921 1.00 0.00 O ATOM 1282 CB ASP A 979 -6.265 -6.329 -2.107 1.00 0.00 C ATOM 1283 CG ASP A 979 -5.614 -7.648 -2.473 1.00 0.00 C ATOM 1284 OD1 ASP A 979 -5.846 -8.643 -1.755 1.00 0.00 O ATOM 1285 OD2 ASP A 979 -4.873 -7.686 -3.478 1.00 0.00 O ATOM 0 H ASP A 979 -8.558 -5.786 -3.976 1.00 0.00 H new ATOM 0 HA ASP A 979 -8.130 -7.213 -1.492 1.00 0.00 H new ATOM 0 HB2 ASP A 979 -5.930 -5.559 -2.802 1.00 0.00 H new ATOM 0 HB3 ASP A 979 -5.931 -6.029 -1.114 1.00 0.00 H new ATOM 1290 N ILE A 980 -7.602 -4.391 -0.761 1.00 0.00 N ATOM 1291 CA ILE A 980 -8.044 -3.124 -0.195 1.00 0.00 C ATOM 1292 C ILE A 980 -6.869 -2.184 0.025 1.00 0.00 C ATOM 1293 O ILE A 980 -6.960 -1.222 0.788 1.00 0.00 O ATOM 1294 CB ILE A 980 -8.804 -3.318 1.131 1.00 0.00 C ATOM 1295 CG1 ILE A 980 -8.087 -4.339 2.018 1.00 0.00 C ATOM 1296 CG2 ILE A 980 -10.239 -3.747 0.861 1.00 0.00 C ATOM 1297 CD1 ILE A 980 -8.821 -4.640 3.307 1.00 0.00 C ATOM 0 H ILE A 980 -6.668 -4.681 -0.471 1.00 0.00 H new ATOM 0 HA ILE A 980 -8.728 -2.681 -0.919 1.00 0.00 H new ATOM 0 HB ILE A 980 -8.826 -2.366 1.662 1.00 0.00 H new ATOM 0 HG12 ILE A 980 -7.956 -5.265 1.459 1.00 0.00 H new ATOM 0 HG13 ILE A 980 -7.091 -3.966 2.255 1.00 0.00 H new ATOM 0 HG21 ILE A 980 -10.763 -3.880 1.807 1.00 0.00 H new ATOM 0 HG22 ILE A 980 -10.743 -2.981 0.272 1.00 0.00 H new ATOM 0 HG23 ILE A 980 -10.240 -4.688 0.310 1.00 0.00 H new ATOM 0 HD11 ILE A 980 -8.256 -5.371 3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 980 -8.929 -3.723 3.887 1.00 0.00 H new ATOM 0 HD13 ILE A 980 -9.808 -5.043 3.078 1.00 0.00 H new ATOM 1309 N GLN A 981 -5.775 -2.452 -0.680 1.00 0.00 N ATOM 1310 CA GLN A 981 -4.590 -1.614 -0.599 1.00 0.00 C ATOM 1311 C GLN A 981 -4.827 -0.345 -1.404 1.00 0.00 C ATOM 1312 O GLN A 981 -5.866 -0.203 -2.049 1.00 0.00 O ATOM 1313 CB GLN A 981 -3.365 -2.350 -1.159 1.00 0.00 C ATOM 1314 CG GLN A 981 -3.024 -3.646 -0.437 1.00 0.00 C ATOM 1315 CD GLN A 981 -2.525 -3.436 0.981 1.00 0.00 C ATOM 1316 OE1 GLN A 981 -2.328 -4.394 1.727 1.00 0.00 O ATOM 1317 NE2 GLN A 981 -2.300 -2.183 1.357 1.00 0.00 N ATOM 0 H GLN A 981 -5.687 -3.246 -1.315 1.00 0.00 H new ATOM 0 HA GLN A 981 -4.400 -1.370 0.446 1.00 0.00 H new ATOM 0 HB2 GLN A 981 -3.539 -2.570 -2.212 1.00 0.00 H new ATOM 0 HB3 GLN A 981 -2.503 -1.684 -1.111 1.00 0.00 H new ATOM 0 HG2 GLN A 981 -3.909 -4.282 -0.412 1.00 0.00 H new ATOM 0 HG3 GLN A 981 -2.263 -4.180 -1.006 1.00 0.00 H new ATOM 0 HE21 GLN A 981 -2.476 -1.416 0.708 1.00 0.00 H new ATOM 0 HE22 GLN A 981 -1.951 -1.987 2.295 1.00 0.00 H new ATOM 1326 N VAL A 982 -3.863 0.566 -1.393 1.00 0.00 N ATOM 1327 CA VAL A 982 -3.986 1.799 -2.157 1.00 0.00 C ATOM 1328 C VAL A 982 -4.294 1.476 -3.618 1.00 0.00 C ATOM 1329 O VAL A 982 -4.867 2.283 -4.350 1.00 0.00 O ATOM 1330 CB VAL A 982 -2.702 2.649 -2.068 1.00 0.00 C ATOM 1331 CG1 VAL A 982 -2.675 3.706 -3.158 1.00 0.00 C ATOM 1332 CG2 VAL A 982 -2.576 3.284 -0.691 1.00 0.00 C ATOM 0 H VAL A 982 -2.994 0.475 -0.867 1.00 0.00 H new ATOM 0 HA VAL A 982 -4.804 2.379 -1.730 1.00 0.00 H new ATOM 0 HB VAL A 982 -1.846 1.991 -2.219 1.00 0.00 H new ATOM 0 HG11 VAL A 982 -1.760 4.292 -3.074 1.00 0.00 H new ATOM 0 HG12 VAL A 982 -2.708 3.223 -4.134 1.00 0.00 H new ATOM 0 HG13 VAL A 982 -3.538 4.363 -3.049 1.00 0.00 H new ATOM 0 HG21 VAL A 982 -1.664 3.880 -0.647 1.00 0.00 H new ATOM 0 HG22 VAL A 982 -3.438 3.925 -0.506 1.00 0.00 H new ATOM 0 HG23 VAL A 982 -2.536 2.502 0.068 1.00 0.00 H new ATOM 1342 N GLY A 983 -3.909 0.276 -4.021 1.00 0.00 N ATOM 1343 CA GLY A 983 -4.141 -0.180 -5.378 1.00 0.00 C ATOM 1344 C GLY A 983 -5.224 -1.242 -5.460 1.00 0.00 C ATOM 1345 O GLY A 983 -5.002 -2.320 -6.013 1.00 0.00 O ATOM 0 H GLY A 983 -3.433 -0.400 -3.424 1.00 0.00 H new ATOM 0 HA2 GLY A 983 -4.423 0.670 -6.000 1.00 0.00 H new ATOM 0 HA3 GLY A 983 -3.213 -0.580 -5.787 1.00 0.00 H new ATOM 1349 N SER A 984 -6.397 -0.939 -4.910 1.00 0.00 N ATOM 1350 CA SER A 984 -7.518 -1.871 -4.921 1.00 0.00 C ATOM 1351 C SER A 984 -8.835 -1.128 -4.732 1.00 0.00 C ATOM 1352 O SER A 984 -8.991 -0.339 -3.797 1.00 0.00 O ATOM 1353 CB SER A 984 -7.348 -2.922 -3.822 1.00 0.00 C ATOM 1354 OG SER A 984 -6.159 -3.670 -4.005 1.00 0.00 O ATOM 0 H SER A 984 -6.595 -0.051 -4.449 1.00 0.00 H new ATOM 0 HA SER A 984 -7.536 -2.372 -5.889 1.00 0.00 H new ATOM 0 HB2 SER A 984 -7.326 -2.433 -2.848 1.00 0.00 H new ATOM 0 HB3 SER A 984 -8.206 -3.594 -3.822 1.00 0.00 H new ATOM 0 HG SER A 984 -5.804 -3.505 -4.903 1.00 0.00 H new ATOM 1360 N ARG A 985 -9.775 -1.376 -5.638 1.00 0.00 N ATOM 1361 CA ARG A 985 -11.081 -0.726 -5.595 1.00 0.00 C ATOM 1362 C ARG A 985 -12.156 -1.681 -5.082 1.00 0.00 C ATOM 1363 O ARG A 985 -12.293 -2.797 -5.579 1.00 0.00 O ATOM 1364 CB ARG A 985 -11.442 -0.228 -6.995 1.00 0.00 C ATOM 1365 CG ARG A 985 -12.682 0.647 -7.045 1.00 0.00 C ATOM 1366 CD ARG A 985 -12.971 1.102 -8.467 1.00 0.00 C ATOM 1367 NE ARG A 985 -14.062 2.070 -8.525 1.00 0.00 N ATOM 1368 CZ ARG A 985 -14.511 2.611 -9.654 1.00 0.00 C ATOM 1369 NH1 ARG A 985 -13.960 2.281 -10.815 1.00 0.00 N ATOM 1370 NH2 ARG A 985 -15.509 3.482 -9.623 1.00 0.00 N ATOM 0 H ARG A 985 -9.656 -2.026 -6.415 1.00 0.00 H new ATOM 0 HA ARG A 985 -11.030 0.117 -4.906 1.00 0.00 H new ATOM 0 HB2 ARG A 985 -10.599 0.333 -7.397 1.00 0.00 H new ATOM 0 HB3 ARG A 985 -11.592 -1.089 -7.647 1.00 0.00 H new ATOM 0 HG2 ARG A 985 -13.537 0.095 -6.655 1.00 0.00 H new ATOM 0 HG3 ARG A 985 -12.544 1.516 -6.402 1.00 0.00 H new ATOM 0 HD2 ARG A 985 -12.072 1.545 -8.895 1.00 0.00 H new ATOM 0 HD3 ARG A 985 -13.223 0.236 -9.080 1.00 0.00 H new ATOM 0 HE ARG A 985 -14.506 2.347 -7.649 1.00 0.00 H new ATOM 0 HH11 ARG A 985 -13.191 1.612 -10.843 1.00 0.00 H new ATOM 0 HH12 ARG A 985 -14.305 2.697 -11.680 1.00 0.00 H new ATOM 0 HH21 ARG A 985 -15.934 3.739 -8.732 1.00 0.00 H new ATOM 0 HH22 ARG A 985 -15.852 3.896 -10.490 1.00 0.00 H new ATOM 1384 N ILE A 986 -12.924 -1.232 -4.090 1.00 0.00 N ATOM 1385 CA ILE A 986 -13.997 -2.045 -3.519 1.00 0.00 C ATOM 1386 C ILE A 986 -15.357 -1.583 -4.030 1.00 0.00 C ATOM 1387 O ILE A 986 -15.542 -0.411 -4.356 1.00 0.00 O ATOM 1388 CB ILE A 986 -14.002 -1.997 -1.978 1.00 0.00 C ATOM 1389 CG1 ILE A 986 -14.291 -0.578 -1.484 1.00 0.00 C ATOM 1390 CG2 ILE A 986 -12.674 -2.500 -1.432 1.00 0.00 C ATOM 1391 CD1 ILE A 986 -14.445 -0.477 0.019 1.00 0.00 C ATOM 0 H ILE A 986 -12.823 -0.310 -3.665 1.00 0.00 H new ATOM 0 HA ILE A 986 -13.811 -3.071 -3.835 1.00 0.00 H new ATOM 0 HB ILE A 986 -14.795 -2.649 -1.612 1.00 0.00 H new ATOM 0 HG12 ILE A 986 -13.483 0.080 -1.803 1.00 0.00 H new ATOM 0 HG13 ILE A 986 -15.203 -0.216 -1.959 1.00 0.00 H new ATOM 0 HG21 ILE A 986 -12.690 -2.461 -0.343 1.00 0.00 H new ATOM 0 HG22 ILE A 986 -12.513 -3.528 -1.756 1.00 0.00 H new ATOM 0 HG23 ILE A 986 -11.866 -1.871 -1.805 1.00 0.00 H new ATOM 0 HD11 ILE A 986 -14.648 0.558 0.295 1.00 0.00 H new ATOM 0 HD12 ILE A 986 -15.272 -1.108 0.343 1.00 0.00 H new ATOM 0 HD13 ILE A 986 -13.526 -0.808 0.502 1.00 0.00 H new ATOM 1403 N THR A 987 -16.308 -2.507 -4.088 1.00 0.00 N ATOM 1404 CA THR A 987 -17.654 -2.190 -4.547 1.00 0.00 C ATOM 1405 C THR A 987 -18.700 -2.822 -3.648 1.00 0.00 C ATOM 1406 O THR A 987 -18.558 -3.964 -3.212 1.00 0.00 O ATOM 1407 CB THR A 987 -17.894 -2.642 -5.997 1.00 0.00 C ATOM 1408 OG1 THR A 987 -17.363 -3.955 -6.202 1.00 0.00 O ATOM 1409 CG2 THR A 987 -17.264 -1.662 -6.970 1.00 0.00 C ATOM 0 H THR A 987 -16.172 -3.482 -3.823 1.00 0.00 H new ATOM 0 HA THR A 987 -17.746 -1.105 -4.506 1.00 0.00 H new ATOM 0 HB THR A 987 -18.969 -2.667 -6.178 1.00 0.00 H new ATOM 0 HG1 THR A 987 -17.378 -4.168 -7.158 1.00 0.00 H new ATOM 0 HG21 THR A 987 -17.443 -1.997 -7.992 1.00 0.00 H new ATOM 0 HG22 THR A 987 -17.705 -0.675 -6.829 1.00 0.00 H new ATOM 0 HG23 THR A 987 -16.190 -1.609 -6.789 1.00 0.00 H new ATOM 1417 N TYR A 988 -19.745 -2.058 -3.366 1.00 0.00 N ATOM 1418 CA TYR A 988 -20.821 -2.527 -2.502 1.00 0.00 C ATOM 1419 C TYR A 988 -21.985 -3.079 -3.314 1.00 0.00 C ATOM 1420 O TYR A 988 -22.222 -2.661 -4.448 1.00 0.00 O ATOM 1421 CB TYR A 988 -21.305 -1.402 -1.583 1.00 0.00 C ATOM 1422 CG TYR A 988 -20.247 -0.889 -0.628 1.00 0.00 C ATOM 1423 CD1 TYR A 988 -19.054 -0.352 -1.100 1.00 0.00 C ATOM 1424 CD2 TYR A 988 -20.445 -0.936 0.746 1.00 0.00 C ATOM 1425 CE1 TYR A 988 -18.090 0.120 -0.230 1.00 0.00 C ATOM 1426 CE2 TYR A 988 -19.486 -0.464 1.623 1.00 0.00 C ATOM 1427 CZ TYR A 988 -18.311 0.062 1.130 1.00 0.00 C ATOM 1428 OH TYR A 988 -17.353 0.534 1.998 1.00 0.00 O ATOM 0 H TYR A 988 -19.872 -1.111 -3.722 1.00 0.00 H new ATOM 0 HA TYR A 988 -20.422 -3.336 -1.889 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -21.659 -0.573 -2.196 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -22.158 -1.759 -1.006 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -18.878 -0.303 -2.164 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -21.364 -1.348 1.136 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -17.168 0.532 -0.613 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -19.657 -0.507 2.689 1.00 0.00 H new ATOM 0 HH TYR A 988 -17.192 1.484 1.822 1.00 0.00 H new ATOM 1438 N SER A 989 -22.707 -4.022 -2.720 1.00 0.00 N ATOM 1439 CA SER A 989 -23.849 -4.644 -3.377 1.00 0.00 C ATOM 1440 C SER A 989 -24.849 -5.159 -2.346 1.00 0.00 C ATOM 1441 O SER A 989 -25.008 -6.368 -2.173 1.00 0.00 O ATOM 1442 CB SER A 989 -23.386 -5.793 -4.277 1.00 0.00 C ATOM 1443 OG SER A 989 -22.500 -5.329 -5.280 1.00 0.00 O ATOM 0 H SER A 989 -22.520 -4.373 -1.781 1.00 0.00 H new ATOM 0 HA SER A 989 -24.340 -3.890 -3.992 1.00 0.00 H new ATOM 0 HB2 SER A 989 -22.891 -6.555 -3.674 1.00 0.00 H new ATOM 0 HB3 SER A 989 -24.251 -6.266 -4.742 1.00 0.00 H new ATOM 0 HG SER A 989 -22.217 -6.082 -5.840 1.00 0.00 H new ATOM 1449 N CYS A 990 -25.515 -4.230 -1.661 1.00 0.00 N ATOM 1450 CA CYS A 990 -26.500 -4.578 -0.640 1.00 0.00 C ATOM 1451 C CYS A 990 -27.414 -5.699 -1.129 1.00 0.00 C ATOM 1452 O CYS A 990 -27.653 -5.838 -2.328 1.00 0.00 O ATOM 1453 CB CYS A 990 -27.342 -3.355 -0.264 1.00 0.00 C ATOM 1454 SG CYS A 990 -26.378 -1.932 0.348 1.00 0.00 S ATOM 0 H CYS A 990 -25.389 -3.227 -1.796 1.00 0.00 H new ATOM 0 HA CYS A 990 -25.960 -4.923 0.242 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -27.914 -3.041 -1.137 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -28.062 -3.646 0.501 1.00 0.00 H new ATOM 1459 N THR A 991 -27.918 -6.497 -0.194 1.00 0.00 N ATOM 1460 CA THR A 991 -28.800 -7.606 -0.535 1.00 0.00 C ATOM 1461 C THR A 991 -30.075 -7.107 -1.205 1.00 0.00 C ATOM 1462 O THR A 991 -30.564 -6.021 -0.896 1.00 0.00 O ATOM 1463 CB THR A 991 -29.171 -8.436 0.709 1.00 0.00 C ATOM 1464 OG1 THR A 991 -30.124 -9.446 0.361 1.00 0.00 O ATOM 1465 CG2 THR A 991 -29.738 -7.547 1.805 1.00 0.00 C ATOM 0 H THR A 991 -27.731 -6.397 0.804 1.00 0.00 H new ATOM 0 HA THR A 991 -28.254 -8.242 -1.231 1.00 0.00 H new ATOM 0 HB THR A 991 -28.264 -8.911 1.084 1.00 0.00 H new ATOM 0 HG1 THR A 991 -30.352 -9.969 1.158 1.00 0.00 H new ATOM 0 HG21 THR A 991 -29.992 -8.156 2.672 1.00 0.00 H new ATOM 0 HG22 THR A 991 -28.995 -6.802 2.090 1.00 0.00 H new ATOM 0 HG23 THR A 991 -30.634 -7.045 1.439 1.00 0.00 H new ATOM 1473 N THR A 992 -30.591 -7.905 -2.137 1.00 0.00 N ATOM 1474 CA THR A 992 -31.799 -7.556 -2.883 1.00 0.00 C ATOM 1475 C THR A 992 -32.859 -6.909 -1.994 1.00 0.00 C ATOM 1476 O THR A 992 -33.547 -5.978 -2.416 1.00 0.00 O ATOM 1477 CB THR A 992 -32.410 -8.796 -3.564 1.00 0.00 C ATOM 1478 OG1 THR A 992 -31.444 -9.410 -4.424 1.00 0.00 O ATOM 1479 CG2 THR A 992 -33.645 -8.420 -4.372 1.00 0.00 C ATOM 0 H THR A 992 -30.188 -8.805 -2.396 1.00 0.00 H new ATOM 0 HA THR A 992 -31.491 -6.835 -3.640 1.00 0.00 H new ATOM 0 HB THR A 992 -32.704 -9.500 -2.785 1.00 0.00 H new ATOM 0 HG1 THR A 992 -31.840 -10.198 -4.851 1.00 0.00 H new ATOM 0 HG21 THR A 992 -34.057 -9.312 -4.843 1.00 0.00 H new ATOM 0 HG22 THR A 992 -34.392 -7.980 -3.711 1.00 0.00 H new ATOM 0 HG23 THR A 992 -33.371 -7.698 -5.141 1.00 0.00 H new ATOM 1487 N GLY A 993 -32.991 -7.406 -0.769 1.00 0.00 N ATOM 1488 CA GLY A 993 -33.975 -6.860 0.150 1.00 0.00 C ATOM 1489 C GLY A 993 -33.826 -5.363 0.351 1.00 0.00 C ATOM 1490 O GLY A 993 -34.802 -4.617 0.257 1.00 0.00 O ATOM 0 H GLY A 993 -32.436 -8.176 -0.396 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -34.975 -7.073 -0.227 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -33.884 -7.362 1.113 1.00 0.00 H new ATOM 1494 N HIS A 994 -32.604 -4.923 0.634 1.00 0.00 N ATOM 1495 CA HIS A 994 -32.327 -3.511 0.857 1.00 0.00 C ATOM 1496 C HIS A 994 -31.671 -2.881 -0.370 1.00 0.00 C ATOM 1497 O HIS A 994 -30.833 -3.498 -1.026 1.00 0.00 O ATOM 1498 CB HIS A 994 -31.419 -3.349 2.078 1.00 0.00 C ATOM 1499 CG HIS A 994 -31.976 -3.974 3.321 1.00 0.00 C ATOM 1500 ND1 HIS A 994 -32.408 -5.282 3.378 1.00 0.00 N ATOM 1501 CD2 HIS A 994 -32.167 -3.464 4.563 1.00 0.00 C ATOM 1502 CE1 HIS A 994 -32.843 -5.548 4.597 1.00 0.00 C ATOM 1503 NE2 HIS A 994 -32.706 -4.462 5.334 1.00 0.00 N ATOM 0 H HIS A 994 -31.787 -5.529 0.714 1.00 0.00 H new ATOM 0 HA HIS A 994 -33.272 -2.999 1.037 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -30.448 -3.793 1.861 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -31.251 -2.287 2.258 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -31.937 -2.459 4.885 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -33.243 -6.493 4.933 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -32.960 -4.378 6.318 1.00 0.00 H new ATOM 1512 N ARG A 995 -32.053 -1.645 -0.664 1.00 0.00 N ATOM 1513 CA ARG A 995 -31.503 -0.920 -1.802 1.00 0.00 C ATOM 1514 C ARG A 995 -30.274 -0.125 -1.379 1.00 0.00 C ATOM 1515 O ARG A 995 -30.231 0.428 -0.282 1.00 0.00 O ATOM 1516 CB ARG A 995 -32.556 0.024 -2.385 1.00 0.00 C ATOM 1517 CG ARG A 995 -33.148 0.976 -1.359 1.00 0.00 C ATOM 1518 CD ARG A 995 -34.139 1.937 -1.993 1.00 0.00 C ATOM 1519 NE ARG A 995 -34.794 2.787 -1.001 1.00 0.00 N ATOM 1520 CZ ARG A 995 -34.152 3.670 -0.241 1.00 0.00 C ATOM 1521 NH1 ARG A 995 -32.842 3.837 -0.372 1.00 0.00 N ATOM 1522 NH2 ARG A 995 -34.821 4.391 0.648 1.00 0.00 N ATOM 0 H ARG A 995 -32.745 -1.122 -0.127 1.00 0.00 H new ATOM 0 HA ARG A 995 -31.211 -1.642 -2.565 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -32.107 0.604 -3.191 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -33.358 -0.567 -2.827 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -33.645 0.404 -0.576 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -32.347 1.541 -0.882 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -33.622 2.563 -2.720 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -34.894 1.371 -2.539 1.00 0.00 H new ATOM 0 HE ARG A 995 -35.803 2.698 -0.884 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -32.324 3.287 -1.057 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -32.353 4.515 0.213 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -35.829 4.269 0.749 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -34.328 5.068 1.230 1.00 0.00 H new ATOM 1536 N LEU A 996 -29.271 -0.086 -2.249 1.00 0.00 N ATOM 1537 CA LEU A 996 -28.035 0.631 -1.960 1.00 0.00 C ATOM 1538 C LEU A 996 -28.257 2.145 -2.008 1.00 0.00 C ATOM 1539 O LEU A 996 -28.871 2.664 -2.941 1.00 0.00 O ATOM 1540 CB LEU A 996 -26.946 0.215 -2.957 1.00 0.00 C ATOM 1541 CG LEU A 996 -25.513 0.538 -2.543 1.00 0.00 C ATOM 1542 CD1 LEU A 996 -24.521 -0.175 -3.448 1.00 0.00 C ATOM 1543 CD2 LEU A 996 -25.286 2.032 -2.572 1.00 0.00 C ATOM 0 H LEU A 996 -29.290 -0.543 -3.161 1.00 0.00 H new ATOM 0 HA LEU A 996 -27.711 0.372 -0.952 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -27.023 -0.859 -3.124 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -27.148 0.701 -3.911 1.00 0.00 H new ATOM 0 HG LEU A 996 -25.356 0.184 -1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -23.505 0.068 -3.137 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -24.674 -1.252 -3.379 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -24.672 0.147 -4.478 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -24.260 2.250 -2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -25.459 2.407 -3.581 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -25.975 2.518 -1.881 1.00 0.00 H new ATOM 1555 N ILE A 997 -27.740 2.844 -1.001 1.00 0.00 N ATOM 1556 CA ILE A 997 -27.861 4.297 -0.920 1.00 0.00 C ATOM 1557 C ILE A 997 -26.540 4.974 -1.280 1.00 0.00 C ATOM 1558 O ILE A 997 -25.474 4.559 -0.820 1.00 0.00 O ATOM 1559 CB ILE A 997 -28.307 4.756 0.491 1.00 0.00 C ATOM 1560 CG1 ILE A 997 -29.792 4.479 0.707 1.00 0.00 C ATOM 1561 CG2 ILE A 997 -28.026 6.228 0.705 1.00 0.00 C ATOM 1562 CD1 ILE A 997 -30.122 3.016 0.795 1.00 0.00 C ATOM 0 H ILE A 997 -27.230 2.424 -0.224 1.00 0.00 H new ATOM 0 HA ILE A 997 -28.626 4.593 -1.638 1.00 0.00 H new ATOM 0 HB ILE A 997 -27.729 4.184 1.217 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -30.116 4.972 1.623 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -30.359 4.923 -0.111 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -28.350 6.519 1.704 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -26.957 6.413 0.602 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -28.568 6.814 -0.037 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -31.194 2.893 0.949 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -29.829 2.521 -0.131 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -29.582 2.571 1.631 1.00 0.00 H new ATOM 1574 N GLY A 998 -26.624 6.019 -2.104 1.00 0.00 N ATOM 1575 CA GLY A 998 -25.436 6.744 -2.522 1.00 0.00 C ATOM 1576 C GLY A 998 -24.788 6.136 -3.752 1.00 0.00 C ATOM 1577 O GLY A 998 -25.480 5.723 -4.683 1.00 0.00 O ATOM 0 H GLY A 998 -27.498 6.376 -2.490 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -25.701 7.781 -2.730 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -24.715 6.757 -1.704 1.00 0.00 H new ATOM 1581 N HIS A 999 -23.458 6.079 -3.757 1.00 0.00 N ATOM 1582 CA HIS A 999 -22.723 5.512 -4.884 1.00 0.00 C ATOM 1583 C HIS A 999 -22.734 3.987 -4.806 1.00 0.00 C ATOM 1584 O HIS A 999 -23.773 3.392 -4.528 1.00 0.00 O ATOM 1585 CB HIS A 999 -21.289 6.055 -4.906 1.00 0.00 C ATOM 1586 CG HIS A 999 -20.532 5.825 -3.637 1.00 0.00 C ATOM 1587 ND1 HIS A 999 -20.068 4.588 -3.243 1.00 0.00 N ATOM 1588 CD2 HIS A 999 -20.160 6.690 -2.666 1.00 0.00 C ATOM 1589 CE1 HIS A 999 -19.443 4.704 -2.085 1.00 0.00 C ATOM 1590 NE2 HIS A 999 -19.483 5.969 -1.713 1.00 0.00 N ATOM 0 H HIS A 999 -22.869 6.417 -2.996 1.00 0.00 H new ATOM 0 HA HIS A 999 -23.211 5.806 -5.813 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -20.748 5.589 -5.729 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -21.320 7.125 -5.110 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -20.359 7.751 -2.644 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -18.978 3.899 -1.536 1.00 0.00 H new ATOM 0 HE2 HIS A 999 -19.078 6.349 -0.858 1.00 0.00 H new ATOM 1599 N SER A1000 -21.588 3.351 -5.045 1.00 0.00 N ATOM 1600 CA SER A1000 -21.504 1.893 -4.984 1.00 0.00 C ATOM 1601 C SER A1000 -20.080 1.408 -5.232 1.00 0.00 C ATOM 1602 O SER A1000 -19.859 0.229 -5.510 1.00 0.00 O ATOM 1603 CB SER A1000 -22.448 1.262 -6.010 1.00 0.00 C ATOM 1604 OG SER A1000 -22.117 1.669 -7.327 1.00 0.00 O ATOM 0 H SER A1000 -20.712 3.818 -5.281 1.00 0.00 H new ATOM 0 HA SER A1000 -21.802 1.587 -3.981 1.00 0.00 H new ATOM 0 HB2 SER A1000 -22.395 0.176 -5.938 1.00 0.00 H new ATOM 0 HB3 SER A1000 -23.476 1.546 -5.786 1.00 0.00 H new ATOM 0 HG SER A1000 -22.734 1.251 -7.963 1.00 0.00 H new ATOM 1610 N SER A1001 -19.115 2.316 -5.130 1.00 0.00 N ATOM 1611 CA SER A1001 -17.718 1.962 -5.346 1.00 0.00 C ATOM 1612 C SER A1001 -16.779 2.980 -4.704 1.00 0.00 C ATOM 1613 O SER A1001 -17.068 4.177 -4.677 1.00 0.00 O ATOM 1614 CB SER A1001 -17.428 1.853 -6.842 1.00 0.00 C ATOM 1615 OG SER A1001 -16.102 1.411 -7.072 1.00 0.00 O ATOM 0 H SER A1001 -19.274 3.297 -4.900 1.00 0.00 H new ATOM 0 HA SER A1001 -17.541 0.996 -4.873 1.00 0.00 H new ATOM 0 HB2 SER A1001 -18.131 1.159 -7.303 1.00 0.00 H new ATOM 0 HB3 SER A1001 -17.579 2.822 -7.317 1.00 0.00 H new ATOM 0 HG SER A1001 -15.815 0.838 -6.331 1.00 0.00 H new ATOM 1621 N ALA A1002 -15.650 2.494 -4.196 1.00 0.00 N ATOM 1622 CA ALA A1002 -14.659 3.355 -3.560 1.00 0.00 C ATOM 1623 C ALA A1002 -13.278 2.706 -3.588 1.00 0.00 C ATOM 1624 O ALA A1002 -13.099 1.588 -3.111 1.00 0.00 O ATOM 1625 CB ALA A1002 -15.071 3.666 -2.130 1.00 0.00 C ATOM 0 H ALA A1002 -15.399 1.506 -4.213 1.00 0.00 H new ATOM 0 HA ALA A1002 -14.607 4.289 -4.120 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -14.322 4.309 -1.667 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -16.035 4.174 -2.132 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -15.151 2.738 -1.564 1.00 0.00 H new ATOM 1631 N GLU A1003 -12.308 3.416 -4.153 1.00 0.00 N ATOM 1632 CA GLU A1003 -10.942 2.909 -4.248 1.00 0.00 C ATOM 1633 C GLU A1003 -10.067 3.471 -3.137 1.00 0.00 C ATOM 1634 O GLU A1003 -10.125 4.664 -2.838 1.00 0.00 O ATOM 1635 CB GLU A1003 -10.337 3.275 -5.605 1.00 0.00 C ATOM 1636 CG GLU A1003 -8.939 2.717 -5.820 1.00 0.00 C ATOM 1637 CD GLU A1003 -8.381 3.057 -7.188 1.00 0.00 C ATOM 1638 OE1 GLU A1003 -8.996 2.651 -8.197 1.00 0.00 O ATOM 1639 OE2 GLU A1003 -7.330 3.728 -7.251 1.00 0.00 O ATOM 0 H GLU A1003 -12.441 4.345 -4.553 1.00 0.00 H new ATOM 0 HA GLU A1003 -10.982 1.825 -4.144 1.00 0.00 H new ATOM 0 HB2 GLU A1003 -10.991 2.908 -6.396 1.00 0.00 H new ATOM 0 HB3 GLU A1003 -10.304 4.361 -5.697 1.00 0.00 H new ATOM 0 HG2 GLU A1003 -8.273 3.110 -5.052 1.00 0.00 H new ATOM 0 HG3 GLU A1003 -8.961 1.634 -5.699 1.00 0.00 H new ATOM 1646 N CYS A1004 -9.234 2.620 -2.544 1.00 0.00 N ATOM 1647 CA CYS A1004 -8.333 3.068 -1.492 1.00 0.00 C ATOM 1648 C CYS A1004 -7.243 3.931 -2.110 1.00 0.00 C ATOM 1649 O CYS A1004 -6.563 3.500 -3.038 1.00 0.00 O ATOM 1650 CB CYS A1004 -7.712 1.872 -0.766 1.00 0.00 C ATOM 1651 SG CYS A1004 -6.610 2.320 0.616 1.00 0.00 S ATOM 0 H CYS A1004 -9.166 1.628 -2.772 1.00 0.00 H new ATOM 0 HA CYS A1004 -8.895 3.650 -0.762 1.00 0.00 H new ATOM 0 HB2 CYS A1004 -8.513 1.238 -0.386 1.00 0.00 H new ATOM 0 HB3 CYS A1004 -7.149 1.278 -1.486 1.00 0.00 H new ATOM 1656 N ILE A1005 -7.091 5.153 -1.620 1.00 0.00 N ATOM 1657 CA ILE A1005 -6.087 6.054 -2.170 1.00 0.00 C ATOM 1658 C ILE A1005 -5.273 6.735 -1.077 1.00 0.00 C ATOM 1659 O ILE A1005 -5.129 6.207 0.027 1.00 0.00 O ATOM 1660 CB ILE A1005 -6.741 7.125 -3.064 1.00 0.00 C ATOM 1661 CG1 ILE A1005 -7.777 7.920 -2.267 1.00 0.00 C ATOM 1662 CG2 ILE A1005 -7.380 6.476 -4.287 1.00 0.00 C ATOM 1663 CD1 ILE A1005 -8.471 8.998 -3.073 1.00 0.00 C ATOM 0 H ILE A1005 -7.641 5.540 -0.853 1.00 0.00 H new ATOM 0 HA ILE A1005 -5.412 5.444 -2.770 1.00 0.00 H new ATOM 0 HB ILE A1005 -5.970 7.815 -3.407 1.00 0.00 H new ATOM 0 HG12 ILE A1005 -8.527 7.232 -1.876 1.00 0.00 H new ATOM 0 HG13 ILE A1005 -7.287 8.380 -1.409 1.00 0.00 H new ATOM 0 HG21 ILE A1005 -7.838 7.245 -4.909 1.00 0.00 H new ATOM 0 HG22 ILE A1005 -6.616 5.952 -4.861 1.00 0.00 H new ATOM 0 HG23 ILE A1005 -8.143 5.767 -3.966 1.00 0.00 H new ATOM 0 HD11 ILE A1005 -9.191 9.518 -2.441 1.00 0.00 H new ATOM 0 HD12 ILE A1005 -7.732 9.709 -3.442 1.00 0.00 H new ATOM 0 HD13 ILE A1005 -8.991 8.544 -3.917 1.00 0.00 H new ATOM 1675 N LEU A1006 -4.732 7.907 -1.398 1.00 0.00 N ATOM 1676 CA LEU A1006 -3.914 8.657 -0.452 1.00 0.00 C ATOM 1677 C LEU A1006 -3.957 10.149 -0.785 1.00 0.00 C ATOM 1678 O LEU A1006 -3.664 10.550 -1.910 1.00 0.00 O ATOM 1679 CB LEU A1006 -2.471 8.139 -0.518 1.00 0.00 C ATOM 1680 CG LEU A1006 -1.620 8.349 0.738 1.00 0.00 C ATOM 1681 CD1 LEU A1006 -0.231 7.762 0.533 1.00 0.00 C ATOM 1682 CD2 LEU A1006 -1.521 9.821 1.096 1.00 0.00 C ATOM 0 H LEU A1006 -4.846 8.357 -2.306 1.00 0.00 H new ATOM 0 HA LEU A1006 -4.304 8.520 0.557 1.00 0.00 H new ATOM 0 HB2 LEU A1006 -2.500 7.072 -0.738 1.00 0.00 H new ATOM 0 HB3 LEU A1006 -1.971 8.624 -1.356 1.00 0.00 H new ATOM 0 HG LEU A1006 -2.107 7.834 1.566 1.00 0.00 H new ATOM 0 HD11 LEU A1006 0.366 7.917 1.432 1.00 0.00 H new ATOM 0 HD12 LEU A1006 -0.313 6.694 0.332 1.00 0.00 H new ATOM 0 HD13 LEU A1006 0.251 8.254 -0.312 1.00 0.00 H new ATOM 0 HD21 LEU A1006 -0.911 9.937 1.992 1.00 0.00 H new ATOM 0 HD22 LEU A1006 -1.062 10.366 0.271 1.00 0.00 H new ATOM 0 HD23 LEU A1006 -2.519 10.218 1.283 1.00 0.00 H new ATOM 1694 N SER A1007 -4.326 10.963 0.201 1.00 0.00 N ATOM 1695 CA SER A1007 -4.410 12.409 0.008 1.00 0.00 C ATOM 1696 C SER A1007 -3.083 13.088 0.337 1.00 0.00 C ATOM 1697 O SER A1007 -3.052 14.135 0.984 1.00 0.00 O ATOM 1698 CB SER A1007 -5.527 12.993 0.877 1.00 0.00 C ATOM 1699 OG SER A1007 -5.649 14.392 0.682 1.00 0.00 O ATOM 0 H SER A1007 -4.571 10.647 1.139 1.00 0.00 H new ATOM 0 HA SER A1007 -4.636 12.596 -1.042 1.00 0.00 H new ATOM 0 HB2 SER A1007 -6.472 12.506 0.636 1.00 0.00 H new ATOM 0 HB3 SER A1007 -5.321 12.786 1.927 1.00 0.00 H new ATOM 0 HG SER A1007 -4.766 14.810 0.753 1.00 0.00 H new ATOM 1705 N GLY A1008 -1.988 12.482 -0.113 1.00 0.00 N ATOM 1706 CA GLY A1008 -0.669 13.035 0.141 1.00 0.00 C ATOM 1707 C GLY A1008 -0.424 13.311 1.613 1.00 0.00 C ATOM 1708 O GLY A1008 0.375 14.179 1.962 1.00 0.00 O ATOM 0 H GLY A1008 -1.991 11.615 -0.651 1.00 0.00 H new ATOM 0 HA2 GLY A1008 0.088 12.342 -0.225 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -0.553 13.961 -0.422 1.00 0.00 H new ATOM 1712 N ASN A1009 -1.109 12.562 2.475 1.00 0.00 N ATOM 1713 CA ASN A1009 -0.971 12.717 3.922 1.00 0.00 C ATOM 1714 C ASN A1009 -1.430 11.454 4.640 1.00 0.00 C ATOM 1715 O ASN A1009 -0.752 10.952 5.536 1.00 0.00 O ATOM 1716 CB ASN A1009 -1.804 13.901 4.423 1.00 0.00 C ATOM 1717 CG ASN A1009 -1.393 15.223 3.805 1.00 0.00 C ATOM 1718 OD1 ASN A1009 -0.262 15.678 3.977 1.00 0.00 O ATOM 1719 ND2 ASN A1009 -2.313 15.847 3.079 1.00 0.00 N ATOM 0 H ASN A1009 -1.769 11.837 2.194 1.00 0.00 H new ATOM 0 HA ASN A1009 0.082 12.899 4.137 1.00 0.00 H new ATOM 0 HB2 ASN A1009 -2.856 13.716 4.204 1.00 0.00 H new ATOM 0 HB3 ASN A1009 -1.712 13.969 5.507 1.00 0.00 H new ATOM 0 HD21 ASN A1009 -2.095 16.740 2.637 1.00 0.00 H new ATOM 0 HD22 ASN A1009 -3.238 15.433 2.963 1.00 0.00 H new ATOM 1726 N THR A1010 -2.596 10.956 4.243 1.00 0.00 N ATOM 1727 CA THR A1010 -3.167 9.762 4.849 1.00 0.00 C ATOM 1728 C THR A1010 -3.976 8.963 3.830 1.00 0.00 C ATOM 1729 O THR A1010 -4.643 9.535 2.968 1.00 0.00 O ATOM 1730 CB THR A1010 -4.072 10.129 6.039 1.00 0.00 C ATOM 1731 OG1 THR A1010 -3.314 10.830 7.032 1.00 0.00 O ATOM 1732 CG2 THR A1010 -4.692 8.887 6.656 1.00 0.00 C ATOM 0 H THR A1010 -3.165 11.364 3.501 1.00 0.00 H new ATOM 0 HA THR A1010 -2.338 9.150 5.204 1.00 0.00 H new ATOM 0 HB THR A1010 -4.873 10.769 5.670 1.00 0.00 H new ATOM 0 HG1 THR A1010 -3.897 11.062 7.785 1.00 0.00 H new ATOM 0 HG21 THR A1010 -5.326 9.175 7.494 1.00 0.00 H new ATOM 0 HG22 THR A1010 -5.292 8.370 5.908 1.00 0.00 H new ATOM 0 HG23 THR A1010 -3.903 8.224 7.010 1.00 0.00 H new ATOM 1740 N ALA A1011 -3.915 7.639 3.936 1.00 0.00 N ATOM 1741 CA ALA A1011 -4.645 6.766 3.024 1.00 0.00 C ATOM 1742 C ALA A1011 -6.110 6.662 3.431 1.00 0.00 C ATOM 1743 O ALA A1011 -6.425 6.440 4.600 1.00 0.00 O ATOM 1744 CB ALA A1011 -4.005 5.387 2.985 1.00 0.00 C ATOM 0 H ALA A1011 -3.368 7.148 4.643 1.00 0.00 H new ATOM 0 HA ALA A1011 -4.599 7.200 2.025 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -4.561 4.747 2.300 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -2.974 5.474 2.644 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -4.021 4.950 3.983 1.00 0.00 H new ATOM 1750 N HIS A1012 -7.002 6.830 2.460 1.00 0.00 N ATOM 1751 CA HIS A1012 -8.438 6.761 2.722 1.00 0.00 C ATOM 1752 C HIS A1012 -9.220 6.498 1.439 1.00 0.00 C ATOM 1753 O HIS A1012 -8.750 6.798 0.343 1.00 0.00 O ATOM 1754 CB HIS A1012 -8.923 8.057 3.376 1.00 0.00 C ATOM 1755 CG HIS A1012 -8.653 9.282 2.560 1.00 0.00 C ATOM 1756 ND1 HIS A1012 -9.148 9.463 1.285 1.00 0.00 N ATOM 1757 CD2 HIS A1012 -7.936 10.395 2.843 1.00 0.00 C ATOM 1758 CE1 HIS A1012 -8.746 10.634 0.821 1.00 0.00 C ATOM 1759 NE2 HIS A1012 -8.010 11.219 1.747 1.00 0.00 N ATOM 0 H HIS A1012 -6.758 7.014 1.487 1.00 0.00 H new ATOM 0 HA HIS A1012 -8.614 5.930 3.405 1.00 0.00 H new ATOM 0 HB2 HIS A1012 -9.995 7.982 3.558 1.00 0.00 H new ATOM 0 HB3 HIS A1012 -8.441 8.165 4.348 1.00 0.00 H new ATOM 0 HD1 HIS A1012 -9.733 8.797 0.779 1.00 0.00 H new ATOM 0 HD2 HIS A1012 -7.404 10.597 3.761 1.00 0.00 H new ATOM 0 HE1 HIS A1012 -8.980 11.042 -0.151 1.00 0.00 H new ATOM 1768 N TRP A1013 -10.417 5.935 1.585 1.00 0.00 N ATOM 1769 CA TRP A1013 -11.264 5.632 0.439 1.00 0.00 C ATOM 1770 C TRP A1013 -11.682 6.908 -0.275 1.00 0.00 C ATOM 1771 O TRP A1013 -11.907 7.941 0.356 1.00 0.00 O ATOM 1772 CB TRP A1013 -12.508 4.856 0.872 1.00 0.00 C ATOM 1773 CG TRP A1013 -12.194 3.586 1.599 1.00 0.00 C ATOM 1774 CD1 TRP A1013 -12.205 3.393 2.949 1.00 0.00 C ATOM 1775 CD2 TRP A1013 -11.800 2.339 1.017 1.00 0.00 C ATOM 1776 NE1 TRP A1013 -11.859 2.097 3.243 1.00 0.00 N ATOM 1777 CE2 TRP A1013 -11.603 1.430 2.073 1.00 0.00 C ATOM 1778 CE3 TRP A1013 -11.601 1.900 -0.295 1.00 0.00 C ATOM 1779 CZ2 TRP A1013 -11.215 0.110 1.859 1.00 0.00 C ATOM 1780 CZ3 TRP A1013 -11.214 0.591 -0.507 1.00 0.00 C ATOM 1781 CH2 TRP A1013 -11.026 -0.291 0.565 1.00 0.00 C ATOM 0 H TRP A1013 -10.820 5.680 2.486 1.00 0.00 H new ATOM 0 HA TRP A1013 -10.684 5.015 -0.247 1.00 0.00 H new ATOM 0 HB2 TRP A1013 -13.118 5.492 1.513 1.00 0.00 H new ATOM 0 HB3 TRP A1013 -13.107 4.623 -0.009 1.00 0.00 H new ATOM 0 HD1 TRP A1013 -12.450 4.149 3.680 1.00 0.00 H new ATOM 0 HE1 TRP A1013 -11.802 1.696 4.179 1.00 0.00 H new ATOM 0 HE3 TRP A1013 -11.747 2.572 -1.128 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 -11.069 -0.572 2.684 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 -11.054 0.242 -1.516 1.00 0.00 H new ATOM 0 HH2 TRP A1013 -10.726 -1.309 0.366 1.00 0.00 H new ATOM 1792 N SER A1014 -11.786 6.823 -1.592 1.00 0.00 N ATOM 1793 CA SER A1014 -12.179 7.963 -2.406 1.00 0.00 C ATOM 1794 C SER A1014 -13.502 8.547 -1.922 1.00 0.00 C ATOM 1795 O SER A1014 -13.724 9.756 -2.004 1.00 0.00 O ATOM 1796 CB SER A1014 -12.294 7.543 -3.870 1.00 0.00 C ATOM 1797 OG SER A1014 -13.311 6.572 -4.044 1.00 0.00 O ATOM 0 H SER A1014 -11.603 5.971 -2.123 1.00 0.00 H new ATOM 0 HA SER A1014 -11.413 8.733 -2.313 1.00 0.00 H new ATOM 0 HB2 SER A1014 -12.511 8.416 -4.486 1.00 0.00 H new ATOM 0 HB3 SER A1014 -11.340 7.141 -4.212 1.00 0.00 H new ATOM 0 HG SER A1014 -13.365 6.321 -4.990 1.00 0.00 H new ATOM 1803 N THR A1015 -14.380 7.683 -1.419 1.00 0.00 N ATOM 1804 CA THR A1015 -15.680 8.120 -0.923 1.00 0.00 C ATOM 1805 C THR A1015 -16.160 7.283 0.252 1.00 0.00 C ATOM 1806 O THR A1015 -15.876 6.090 0.347 1.00 0.00 O ATOM 1807 CB THR A1015 -16.758 8.073 -2.017 1.00 0.00 C ATOM 1808 OG1 THR A1015 -18.051 8.248 -1.428 1.00 0.00 O ATOM 1809 CG2 THR A1015 -16.706 6.758 -2.779 1.00 0.00 C ATOM 0 H THR A1015 -14.215 6.679 -1.345 1.00 0.00 H new ATOM 0 HA THR A1015 -15.533 9.150 -0.597 1.00 0.00 H new ATOM 0 HB THR A1015 -16.568 8.881 -2.723 1.00 0.00 H new ATOM 0 HG1 THR A1015 -18.598 8.822 -2.004 1.00 0.00 H new ATOM 0 HG21 THR A1015 -17.479 6.752 -3.547 1.00 0.00 H new ATOM 0 HG22 THR A1015 -15.728 6.648 -3.248 1.00 0.00 H new ATOM 0 HG23 THR A1015 -16.873 5.931 -2.089 1.00 0.00 H new ATOM 1817 N LYS A1016 -16.905 7.934 1.133 1.00 0.00 N ATOM 1818 CA LYS A1016 -17.465 7.291 2.309 1.00 0.00 C ATOM 1819 C LYS A1016 -18.364 6.118 1.916 1.00 0.00 C ATOM 1820 O LYS A1016 -19.140 6.217 0.966 1.00 0.00 O ATOM 1821 CB LYS A1016 -18.262 8.322 3.105 1.00 0.00 C ATOM 1822 CG LYS A1016 -19.057 7.736 4.261 1.00 0.00 C ATOM 1823 CD LYS A1016 -19.765 8.819 5.060 1.00 0.00 C ATOM 1824 CE LYS A1016 -20.763 9.587 4.208 1.00 0.00 C ATOM 1825 NZ LYS A1016 -21.458 10.650 4.986 1.00 0.00 N ATOM 0 H LYS A1016 -17.138 8.924 1.051 1.00 0.00 H new ATOM 0 HA LYS A1016 -16.653 6.898 2.920 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -17.576 9.074 3.495 1.00 0.00 H new ATOM 0 HB3 LYS A1016 -18.947 8.835 2.430 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -19.791 7.028 3.876 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -18.389 7.178 4.917 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -20.282 8.367 5.907 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -19.028 9.510 5.468 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -20.246 10.037 3.361 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -21.500 8.895 3.801 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -22.129 11.149 4.368 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -21.973 10.219 5.780 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -20.758 11.325 5.354 1.00 0.00 H new ATOM 1839 N PRO A1017 -18.271 4.988 2.641 1.00 0.00 N ATOM 1840 CA PRO A1017 -19.078 3.795 2.358 1.00 0.00 C ATOM 1841 C PRO A1017 -20.569 4.108 2.236 1.00 0.00 C ATOM 1842 O PRO A1017 -21.113 4.888 3.018 1.00 0.00 O ATOM 1843 CB PRO A1017 -18.821 2.898 3.570 1.00 0.00 C ATOM 1844 CG PRO A1017 -17.478 3.308 4.065 1.00 0.00 C ATOM 1845 CD PRO A1017 -17.367 4.782 3.791 1.00 0.00 C ATOM 0 HA PRO A1017 -18.807 3.341 1.405 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -19.585 3.038 4.335 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -18.836 1.844 3.293 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -17.375 3.100 5.130 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -16.689 2.756 3.555 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -17.673 5.375 4.653 1.00 0.00 H new ATOM 0 HD3 PRO A1017 -16.343 5.070 3.553 1.00 0.00 H new ATOM 1853 N PRO A1018 -21.252 3.501 1.245 1.00 0.00 N ATOM 1854 CA PRO A1018 -22.688 3.719 1.020 1.00 0.00 C ATOM 1855 C PRO A1018 -23.535 3.251 2.197 1.00 0.00 C ATOM 1856 O PRO A1018 -23.035 3.086 3.310 1.00 0.00 O ATOM 1857 CB PRO A1018 -23.001 2.869 -0.219 1.00 0.00 C ATOM 1858 CG PRO A1018 -21.681 2.578 -0.848 1.00 0.00 C ATOM 1859 CD PRO A1018 -20.680 2.561 0.269 1.00 0.00 C ATOM 0 HA PRO A1018 -22.916 4.778 0.896 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -23.516 1.948 0.057 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -23.654 3.405 -0.908 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -21.700 1.620 -1.368 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -21.426 3.337 -1.587 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -20.564 1.563 0.691 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -19.694 2.881 -0.068 1.00 0.00 H new ATOM 1867 N ILE A1019 -24.823 3.032 1.944 1.00 0.00 N ATOM 1868 CA ILE A1019 -25.735 2.577 2.991 1.00 0.00 C ATOM 1869 C ILE A1019 -26.742 1.568 2.469 1.00 0.00 C ATOM 1870 O ILE A1019 -27.349 1.771 1.421 1.00 0.00 O ATOM 1871 CB ILE A1019 -26.551 3.731 3.594 1.00 0.00 C ATOM 1872 CG1 ILE A1019 -25.661 4.893 4.016 1.00 0.00 C ATOM 1873 CG2 ILE A1019 -27.358 3.228 4.783 1.00 0.00 C ATOM 1874 CD1 ILE A1019 -26.463 6.075 4.505 1.00 0.00 C ATOM 0 H ILE A1019 -25.257 3.161 1.030 1.00 0.00 H new ATOM 0 HA ILE A1019 -25.090 2.127 3.746 1.00 0.00 H new ATOM 0 HB ILE A1019 -27.228 4.100 2.824 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -24.985 4.563 4.805 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -25.042 5.200 3.173 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -27.934 4.051 5.206 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -28.037 2.441 4.455 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -26.682 2.832 5.540 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -25.786 6.879 4.795 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -27.120 6.423 3.708 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -27.062 5.777 5.365 1.00 0.00 H new ATOM 1886 N CYS A1020 -26.965 0.513 3.234 1.00 0.00 N ATOM 1887 CA CYS A1020 -27.957 -0.481 2.864 1.00 0.00 C ATOM 1888 C CYS A1020 -29.254 -0.178 3.605 1.00 0.00 C ATOM 1889 O CYS A1020 -29.257 -0.048 4.830 1.00 0.00 O ATOM 1890 CB CYS A1020 -27.469 -1.894 3.189 1.00 0.00 C ATOM 1891 SG CYS A1020 -25.971 -2.400 2.282 1.00 0.00 S ATOM 0 H CYS A1020 -26.476 0.324 4.109 1.00 0.00 H new ATOM 0 HA CYS A1020 -28.127 -0.435 1.788 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -27.271 -1.960 4.259 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -28.269 -2.601 2.969 1.00 0.00 H new ATOM 1896 N GLN A1021 -30.347 -0.040 2.865 1.00 0.00 N ATOM 1897 CA GLN A1021 -31.634 0.279 3.475 1.00 0.00 C ATOM 1898 C GLN A1021 -32.764 -0.449 2.759 1.00 0.00 C ATOM 1899 O GLN A1021 -32.876 -0.384 1.538 1.00 0.00 O ATOM 1900 CB GLN A1021 -31.870 1.790 3.413 1.00 0.00 C ATOM 1901 CG GLN A1021 -32.435 2.386 4.691 1.00 0.00 C ATOM 1902 CD GLN A1021 -31.469 2.290 5.854 1.00 0.00 C ATOM 1903 OE1 GLN A1021 -31.136 1.199 6.316 1.00 0.00 O ATOM 1904 NE2 GLN A1021 -31.003 3.442 6.327 1.00 0.00 N ATOM 0 H GLN A1021 -30.370 -0.143 1.850 1.00 0.00 H new ATOM 0 HA GLN A1021 -31.618 -0.047 4.515 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -30.927 2.284 3.181 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -32.553 2.006 2.592 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -32.688 3.432 4.519 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -33.361 1.872 4.949 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -31.307 4.323 5.913 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -30.342 3.444 7.104 1.00 0.00 H new ATOM 1913 N ARG A1022 -33.591 -1.148 3.530 1.00 0.00 N ATOM 1914 CA ARG A1022 -34.709 -1.905 2.974 1.00 0.00 C ATOM 1915 C ARG A1022 -35.503 -1.078 1.985 1.00 0.00 C ATOM 1916 O ARG A1022 -35.734 0.115 2.181 1.00 0.00 O ATOM 1917 CB ARG A1022 -35.633 -2.405 4.084 1.00 0.00 C ATOM 1918 CG ARG A1022 -36.339 -1.290 4.835 1.00 0.00 C ATOM 1919 CD ARG A1022 -37.446 -1.835 5.718 1.00 0.00 C ATOM 1920 NE ARG A1022 -36.936 -2.742 6.743 1.00 0.00 N ATOM 1921 CZ ARG A1022 -37.708 -3.361 7.631 1.00 0.00 C ATOM 1922 NH1 ARG A1022 -39.021 -3.176 7.617 1.00 0.00 N ATOM 1923 NH2 ARG A1022 -37.167 -4.166 8.535 1.00 0.00 N ATOM 0 H ARG A1022 -33.508 -1.206 4.545 1.00 0.00 H new ATOM 0 HA ARG A1022 -34.287 -2.761 2.447 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -36.380 -3.070 3.651 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -35.051 -2.996 4.791 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -35.618 -0.747 5.446 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -36.756 -0.577 4.124 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -37.969 -1.006 6.196 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -38.176 -2.359 5.101 1.00 0.00 H new ATOM 0 HE ARG A1022 -35.931 -2.910 6.780 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -39.441 -2.557 6.924 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -39.610 -3.652 8.300 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -36.157 -4.311 8.550 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -37.760 -4.640 9.216 1.00 0.00 H new ATOM 1937 N ILE A1023 -35.913 -1.737 0.915 1.00 0.00 N ATOM 1938 CA ILE A1023 -36.680 -1.098 -0.130 1.00 0.00 C ATOM 1939 C ILE A1023 -38.125 -0.865 0.310 1.00 0.00 C ATOM 1940 O ILE A1023 -38.781 -1.777 0.815 1.00 0.00 O ATOM 1941 CB ILE A1023 -36.669 -1.953 -1.404 1.00 0.00 C ATOM 1942 CG1 ILE A1023 -35.231 -2.219 -1.857 1.00 0.00 C ATOM 1943 CG2 ILE A1023 -37.454 -1.258 -2.492 1.00 0.00 C ATOM 1944 CD1 ILE A1023 -35.131 -3.087 -3.093 1.00 0.00 C ATOM 0 H ILE A1023 -35.723 -2.725 0.750 1.00 0.00 H new ATOM 0 HA ILE A1023 -36.216 -0.133 -0.336 1.00 0.00 H new ATOM 0 HB ILE A1023 -37.139 -2.914 -1.193 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -34.739 -1.266 -2.053 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -34.686 -2.697 -1.043 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -37.444 -1.869 -3.395 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -38.483 -1.114 -2.163 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -37.002 -0.289 -2.704 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -34.082 -3.231 -3.353 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -35.592 -4.055 -2.896 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -35.646 -2.601 -3.921 1.00 0.00 H new ATOM 1956 N PRO A1024 -38.642 0.363 0.123 1.00 0.00 N ATOM 1957 CA PRO A1024 -40.016 0.714 0.503 1.00 0.00 C ATOM 1958 C PRO A1024 -41.052 -0.143 -0.218 1.00 0.00 C ATOM 1959 O PRO A1024 -41.868 -0.789 0.473 1.00 0.00 O ATOM 1960 CB PRO A1024 -40.141 2.180 0.072 1.00 0.00 C ATOM 1961 CG PRO A1024 -38.740 2.675 0.024 1.00 0.00 C ATOM 1962 CD PRO A1024 -37.935 1.512 -0.468 1.00 0.00 C ATOM 1963 OXT PRO A1024 -41.038 -0.161 -1.466 1.00 0.00 O ATOM 0 HA PRO A1024 -40.200 0.551 1.565 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -40.626 2.268 -0.900 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -40.740 2.752 0.780 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -38.646 3.531 -0.645 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -38.402 3.001 1.008 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -37.918 1.462 -1.557 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -36.899 1.566 -0.135 1.00 0.00 H new