USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 976 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 975 HIS : no HE2:sc= -2.65! C(o=-4!,f=-6.1!) USER MOD Set 1.2: A 987 THR OG1 : rot -151:sc= -1.37 USER MOD Single : A 901 HIS : no HD1:sc= -5.07! C(o=-5.1!,f=-6!) USER MOD Single : A 903 GLN : amide:sc= 0.412 K(o=0.41,f=-0.14) USER MOD Single : A 907 HIS : no HD1:sc= -0.234 X(o=-0.23,f=-0.016) USER MOD Single : A 912 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 914 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 THR OG1 : rot 4:sc= 1.04 USER MOD Single : A 916 GLN : amide:sc= -2.72! C(o=-2.7!,f=-2.4!) USER MOD Single : A 917 THR OG1 : rot 63:sc= -0.0534 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 39:sc= -1.96! USER MOD Single : A 927 SER OG : rot 38:sc= -0.226 USER MOD Single : A 929 LYS NZ :NH3+ 164:sc= -0.0271 (180deg=-0.262) USER MOD Single : A 930 TYR OH : rot 180:sc= -0.727 USER MOD Single : A 936 TYR OH : rot 180:sc= -0.545 USER MOD Single : A 937 TYR OH : rot 180:sc= 0 USER MOD Single : A 942 SER OG : rot 30:sc= 0.513 USER MOD Single : A 944 THR OG1 : rot 180:sc= 0 USER MOD Single : A 948 ASN : amide:sc= -2.3 K(o=-2.3,f=-5.5) USER MOD Single : A 952 SER OG : rot 180:sc= 0 USER MOD Single : A 953 SER OG : rot 36:sc= 0.662 USER MOD Single : A 955 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 959 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 961 LYS NZ :NH3+ -136:sc= -3.42! (180deg=-6.17!) USER MOD Single : A 962 SER OG : rot 180:sc= 0 USER MOD Single : A 964 LYS NZ :NH3+ -166:sc= -0.0228 (180deg=-0.269) USER MOD Single : A 965 THR OG1 : rot 180:sc= -0.295 USER MOD Single : A 971 ASN : amide:sc= -2.41! K(o=-2.4!,f=-1.3) USER MOD Single : A 973 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 978 THR OG1 : rot 180:sc= -0.289 USER MOD Single : A 981 GLN : amide:sc= -3.64! C(o=-3.6!,f=-8.9!) USER MOD Single : A 984 SER OG : rot 112:sc= -1.3 USER MOD Single : A 988 TYR OH : rot 80:sc= -0.673 USER MOD Single : A 989 SER OG : rot 180:sc= 0 USER MOD Single : A 991 THR OG1 : rot 180:sc= -0.0138 USER MOD Single : A 992 THR OG1 : rot 180:sc= 0 USER MOD Single : A 994 HIS : no HD1:sc= -1.46 X(o=-1.5,f=-1.9!) USER MOD Single : A 999 HIS : no HD1:sc= -1.87! K(o=-1.9!,f=-0.84) USER MOD Single : A1000 SER OG : rot -31:sc= 0.68 USER MOD Single : A1001 SER OG : rot 37:sc= 0.579 USER MOD Single : A1007 SER OG : rot 180:sc= 0 USER MOD Single : A1009 ASN : amide:sc= -0.331 K(o=-0.33,f=-2!) USER MOD Single : A1010 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 HIS : no HE2:sc= -5.27! C(o=-5.3!,f=-8.9!) USER MOD Single : A1014 SER OG : rot 180:sc= 0 USER MOD Single : A1015 THR OG1 : rot 180:sc= -0.901 USER MOD Single : A1016 LYS NZ :NH3+ -166:sc= -0.0348 (180deg=-0.291) USER MOD Single : A1021 GLN : amide:sc= -1.17! K(o=-1.2!,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 897 38.290 -5.240 -13.050 1.00 0.00 N ATOM 2 CA GLU A 897 37.492 -5.287 -11.796 1.00 0.00 C ATOM 3 C GLU A 897 38.057 -4.333 -10.748 1.00 0.00 C ATOM 4 O GLU A 897 37.312 -3.596 -10.101 1.00 0.00 O ATOM 5 CB GLU A 897 37.502 -6.722 -11.266 1.00 0.00 C ATOM 6 CG GLU A 897 36.699 -6.907 -9.989 1.00 0.00 C ATOM 7 CD GLU A 897 36.722 -8.337 -9.488 1.00 0.00 C ATOM 8 OE1 GLU A 897 37.824 -8.848 -9.200 1.00 0.00 O ATOM 9 OE2 GLU A 897 35.636 -8.947 -9.383 1.00 0.00 O ATOM 0 HA GLU A 897 36.470 -4.973 -12.009 1.00 0.00 H new ATOM 0 HB2 GLU A 897 37.105 -7.386 -12.034 1.00 0.00 H new ATOM 0 HB3 GLU A 897 38.533 -7.025 -11.084 1.00 0.00 H new ATOM 0 HG2 GLU A 897 37.096 -6.249 -9.216 1.00 0.00 H new ATOM 0 HG3 GLU A 897 35.667 -6.605 -10.166 1.00 0.00 H new ATOM 18 N ALA A 898 39.378 -4.352 -10.588 1.00 0.00 N ATOM 19 CA ALA A 898 40.048 -3.489 -9.620 1.00 0.00 C ATOM 20 C ALA A 898 39.508 -3.716 -8.213 1.00 0.00 C ATOM 21 O ALA A 898 39.020 -4.799 -7.889 1.00 0.00 O ATOM 22 CB ALA A 898 39.891 -2.030 -10.023 1.00 0.00 C ATOM 0 H ALA A 898 40.006 -4.957 -11.117 1.00 0.00 H new ATOM 0 HA ALA A 898 41.108 -3.742 -9.614 1.00 0.00 H new ATOM 0 HB1 ALA A 898 40.395 -1.395 -9.294 1.00 0.00 H new ATOM 0 HB2 ALA A 898 40.334 -1.875 -11.007 1.00 0.00 H new ATOM 0 HB3 ALA A 898 38.832 -1.774 -10.057 1.00 0.00 H new ATOM 28 N GLU A 899 39.601 -2.684 -7.383 1.00 0.00 N ATOM 29 CA GLU A 899 39.124 -2.760 -6.007 1.00 0.00 C ATOM 30 C GLU A 899 37.641 -3.119 -5.965 1.00 0.00 C ATOM 31 O GLU A 899 36.838 -2.566 -6.717 1.00 0.00 O ATOM 32 CB GLU A 899 39.364 -1.430 -5.291 1.00 0.00 C ATOM 33 CG GLU A 899 40.829 -1.027 -5.233 1.00 0.00 C ATOM 34 CD GLU A 899 41.043 0.295 -4.521 1.00 0.00 C ATOM 35 OE1 GLU A 899 40.046 0.902 -4.077 1.00 0.00 O ATOM 36 OE2 GLU A 899 42.211 0.726 -4.409 1.00 0.00 O ATOM 0 H GLU A 899 40.003 -1.782 -7.639 1.00 0.00 H new ATOM 0 HA GLU A 899 39.681 -3.545 -5.495 1.00 0.00 H new ATOM 0 HB2 GLU A 899 38.800 -0.647 -5.798 1.00 0.00 H new ATOM 0 HB3 GLU A 899 38.974 -1.498 -4.276 1.00 0.00 H new ATOM 0 HG2 GLU A 899 41.396 -1.806 -4.723 1.00 0.00 H new ATOM 0 HG3 GLU A 899 41.223 -0.957 -6.247 1.00 0.00 H new ATOM 43 N ALA A 900 37.290 -4.057 -5.091 1.00 0.00 N ATOM 44 CA ALA A 900 35.907 -4.504 -4.959 1.00 0.00 C ATOM 45 C ALA A 900 35.037 -3.472 -4.250 1.00 0.00 C ATOM 46 O ALA A 900 35.367 -3.010 -3.157 1.00 0.00 O ATOM 47 CB ALA A 900 35.852 -5.825 -4.212 1.00 0.00 C ATOM 0 H ALA A 900 37.945 -4.523 -4.463 1.00 0.00 H new ATOM 0 HA ALA A 900 35.511 -4.636 -5.966 1.00 0.00 H new ATOM 0 HB1 ALA A 900 34.815 -6.148 -4.120 1.00 0.00 H new ATOM 0 HB2 ALA A 900 36.419 -6.577 -4.761 1.00 0.00 H new ATOM 0 HB3 ALA A 900 36.282 -5.699 -3.219 1.00 0.00 H new ATOM 53 N HIS A 901 33.909 -3.141 -4.873 1.00 0.00 N ATOM 54 CA HIS A 901 32.957 -2.185 -4.312 1.00 0.00 C ATOM 55 C HIS A 901 31.564 -2.430 -4.882 1.00 0.00 C ATOM 56 O HIS A 901 31.414 -2.737 -6.065 1.00 0.00 O ATOM 57 CB HIS A 901 33.381 -0.740 -4.602 1.00 0.00 C ATOM 58 CG HIS A 901 34.648 -0.327 -3.921 1.00 0.00 C ATOM 59 ND1 HIS A 901 35.900 -0.710 -4.353 1.00 0.00 N ATOM 60 CD2 HIS A 901 34.850 0.427 -2.817 1.00 0.00 C ATOM 61 CE1 HIS A 901 36.815 -0.207 -3.543 1.00 0.00 C ATOM 62 NE2 HIS A 901 36.204 0.487 -2.603 1.00 0.00 N ATOM 0 H HIS A 901 33.630 -3.525 -5.776 1.00 0.00 H new ATOM 0 HA HIS A 901 32.940 -2.330 -3.232 1.00 0.00 H new ATOM 0 HB2 HIS A 901 33.503 -0.617 -5.678 1.00 0.00 H new ATOM 0 HB3 HIS A 901 32.580 -0.069 -4.293 1.00 0.00 H new ATOM 0 HD2 HIS A 901 34.086 0.896 -2.214 1.00 0.00 H new ATOM 0 HE1 HIS A 901 37.883 -0.342 -3.635 1.00 0.00 H new ATOM 0 HE2 HIS A 901 36.663 0.987 -1.841 1.00 0.00 H new ATOM 71 N CYS A 902 30.546 -2.298 -4.036 1.00 0.00 N ATOM 72 CA CYS A 902 29.168 -2.510 -4.466 1.00 0.00 C ATOM 73 C CYS A 902 28.617 -1.279 -5.168 1.00 0.00 C ATOM 74 O CYS A 902 28.681 -0.169 -4.640 1.00 0.00 O ATOM 75 CB CYS A 902 28.274 -2.851 -3.274 1.00 0.00 C ATOM 76 SG CYS A 902 28.575 -4.492 -2.551 1.00 0.00 S ATOM 0 H CYS A 902 30.649 -2.046 -3.053 1.00 0.00 H new ATOM 0 HA CYS A 902 29.171 -3.346 -5.166 1.00 0.00 H new ATOM 0 HB2 CYS A 902 28.417 -2.096 -2.501 1.00 0.00 H new ATOM 0 HB3 CYS A 902 27.232 -2.792 -3.589 1.00 0.00 H new ATOM 81 N GLN A 903 28.063 -1.487 -6.355 1.00 0.00 N ATOM 82 CA GLN A 903 27.486 -0.396 -7.122 1.00 0.00 C ATOM 83 C GLN A 903 26.138 0.002 -6.545 1.00 0.00 C ATOM 84 O GLN A 903 25.608 -0.668 -5.654 1.00 0.00 O ATOM 85 CB GLN A 903 27.323 -0.788 -8.590 1.00 0.00 C ATOM 86 CG GLN A 903 28.624 -1.194 -9.257 1.00 0.00 C ATOM 87 CD GLN A 903 29.689 -0.121 -9.154 1.00 0.00 C ATOM 88 OE1 GLN A 903 29.526 0.984 -9.669 1.00 0.00 O ATOM 89 NE2 GLN A 903 30.787 -0.442 -8.479 1.00 0.00 N ATOM 0 H GLN A 903 28.002 -2.400 -6.805 1.00 0.00 H new ATOM 0 HA GLN A 903 28.166 0.454 -7.062 1.00 0.00 H new ATOM 0 HB2 GLN A 903 26.615 -1.614 -8.661 1.00 0.00 H new ATOM 0 HB3 GLN A 903 26.891 0.051 -9.136 1.00 0.00 H new ATOM 0 HG2 GLN A 903 28.992 -2.112 -8.799 1.00 0.00 H new ATOM 0 HG3 GLN A 903 28.436 -1.415 -10.308 1.00 0.00 H new ATOM 0 HE21 GLN A 903 30.880 -1.371 -8.068 1.00 0.00 H new ATOM 0 HE22 GLN A 903 31.537 0.240 -8.371 1.00 0.00 H new ATOM 98 N ALA A 904 25.591 1.094 -7.063 1.00 0.00 N ATOM 99 CA ALA A 904 24.300 1.593 -6.616 1.00 0.00 C ATOM 100 C ALA A 904 23.280 0.460 -6.517 1.00 0.00 C ATOM 101 O ALA A 904 23.070 -0.280 -7.478 1.00 0.00 O ATOM 102 CB ALA A 904 23.813 2.673 -7.567 1.00 0.00 C ATOM 0 H ALA A 904 26.025 1.653 -7.797 1.00 0.00 H new ATOM 0 HA ALA A 904 24.415 2.022 -5.620 1.00 0.00 H new ATOM 0 HB1 ALA A 904 22.846 3.045 -7.230 1.00 0.00 H new ATOM 0 HB2 ALA A 904 24.531 3.493 -7.585 1.00 0.00 H new ATOM 0 HB3 ALA A 904 23.712 2.257 -8.569 1.00 0.00 H new ATOM 108 N PRO A 905 22.636 0.305 -5.346 1.00 0.00 N ATOM 109 CA PRO A 905 21.641 -0.752 -5.124 1.00 0.00 C ATOM 110 C PRO A 905 20.497 -0.701 -6.130 1.00 0.00 C ATOM 111 O PRO A 905 19.993 0.373 -6.461 1.00 0.00 O ATOM 112 CB PRO A 905 21.121 -0.467 -3.712 1.00 0.00 C ATOM 113 CG PRO A 905 22.210 0.309 -3.057 1.00 0.00 C ATOM 114 CD PRO A 905 22.833 1.135 -4.145 1.00 0.00 C ATOM 0 HA PRO A 905 22.077 -1.744 -5.241 1.00 0.00 H new ATOM 0 HB2 PRO A 905 20.191 0.101 -3.740 1.00 0.00 H new ATOM 0 HB3 PRO A 905 20.914 -1.391 -3.172 1.00 0.00 H new ATOM 0 HG2 PRO A 905 21.816 0.942 -2.262 1.00 0.00 H new ATOM 0 HG3 PRO A 905 22.944 -0.355 -2.601 1.00 0.00 H new ATOM 0 HD2 PRO A 905 22.348 2.106 -4.242 1.00 0.00 H new ATOM 0 HD3 PRO A 905 23.889 1.324 -3.954 1.00 0.00 H new ATOM 122 N ASP A 906 20.092 -1.872 -6.611 1.00 0.00 N ATOM 123 CA ASP A 906 19.008 -1.972 -7.580 1.00 0.00 C ATOM 124 C ASP A 906 17.702 -1.469 -6.976 1.00 0.00 C ATOM 125 O ASP A 906 17.538 -1.446 -5.756 1.00 0.00 O ATOM 126 CB ASP A 906 18.837 -3.413 -8.041 1.00 0.00 C ATOM 127 CG ASP A 906 18.100 -3.524 -9.363 1.00 0.00 C ATOM 128 OD1 ASP A 906 17.765 -2.472 -9.948 1.00 0.00 O ATOM 129 OD2 ASP A 906 17.865 -4.663 -9.816 1.00 0.00 O ATOM 0 H ASP A 906 20.500 -2.768 -6.344 1.00 0.00 H new ATOM 0 HA ASP A 906 19.263 -1.351 -8.439 1.00 0.00 H new ATOM 0 HB2 ASP A 906 19.818 -3.878 -8.137 1.00 0.00 H new ATOM 0 HB3 ASP A 906 18.293 -3.971 -7.279 1.00 0.00 H new ATOM 134 N HIS A 907 16.775 -1.066 -7.837 1.00 0.00 N ATOM 135 CA HIS A 907 15.482 -0.563 -7.389 1.00 0.00 C ATOM 136 C HIS A 907 14.560 -1.708 -6.989 1.00 0.00 C ATOM 137 O HIS A 907 14.286 -2.603 -7.788 1.00 0.00 O ATOM 138 CB HIS A 907 14.818 0.265 -8.492 1.00 0.00 C ATOM 139 CG HIS A 907 15.617 1.458 -8.917 1.00 0.00 C ATOM 140 ND1 HIS A 907 15.192 2.345 -9.884 1.00 0.00 N ATOM 141 CD2 HIS A 907 16.822 1.909 -8.501 1.00 0.00 C ATOM 142 CE1 HIS A 907 16.103 3.288 -10.044 1.00 0.00 C ATOM 143 NE2 HIS A 907 17.102 3.047 -9.216 1.00 0.00 N ATOM 0 H HIS A 907 16.895 -1.078 -8.850 1.00 0.00 H new ATOM 0 HA HIS A 907 15.655 0.069 -6.518 1.00 0.00 H new ATOM 0 HB2 HIS A 907 14.646 -0.373 -9.359 1.00 0.00 H new ATOM 0 HB3 HIS A 907 13.841 0.599 -8.144 1.00 0.00 H new ATOM 0 HD2 HIS A 907 17.448 1.457 -7.746 1.00 0.00 H new ATOM 0 HE1 HIS A 907 16.041 4.116 -10.735 1.00 0.00 H new ATOM 0 HE2 HIS A 907 17.945 3.614 -9.123 1.00 0.00 H new ATOM 152 N PHE A 908 14.069 -1.667 -5.755 1.00 0.00 N ATOM 153 CA PHE A 908 13.160 -2.697 -5.268 1.00 0.00 C ATOM 154 C PHE A 908 11.728 -2.366 -5.664 1.00 0.00 C ATOM 155 O PHE A 908 10.778 -2.819 -5.029 1.00 0.00 O ATOM 156 CB PHE A 908 13.263 -2.840 -3.748 1.00 0.00 C ATOM 157 CG PHE A 908 14.578 -3.392 -3.275 1.00 0.00 C ATOM 158 CD1 PHE A 908 15.771 -2.772 -3.607 1.00 0.00 C ATOM 159 CD2 PHE A 908 14.617 -4.533 -2.490 1.00 0.00 C ATOM 160 CE1 PHE A 908 16.979 -3.278 -3.168 1.00 0.00 C ATOM 161 CE2 PHE A 908 15.822 -5.046 -2.048 1.00 0.00 C ATOM 162 CZ PHE A 908 17.004 -4.418 -2.387 1.00 0.00 C ATOM 0 H PHE A 908 14.284 -0.936 -5.077 1.00 0.00 H new ATOM 0 HA PHE A 908 13.445 -3.645 -5.724 1.00 0.00 H new ATOM 0 HB2 PHE A 908 13.104 -1.864 -3.290 1.00 0.00 H new ATOM 0 HB3 PHE A 908 12.461 -3.490 -3.399 1.00 0.00 H new ATOM 0 HD1 PHE A 908 15.757 -1.881 -4.217 1.00 0.00 H new ATOM 0 HD2 PHE A 908 13.695 -5.027 -2.220 1.00 0.00 H new ATOM 0 HE1 PHE A 908 17.902 -2.784 -3.434 1.00 0.00 H new ATOM 0 HE2 PHE A 908 15.839 -5.937 -1.438 1.00 0.00 H new ATOM 0 HZ PHE A 908 17.947 -4.817 -2.042 1.00 0.00 H new ATOM 172 N LEU A 909 11.594 -1.576 -6.728 1.00 0.00 N ATOM 173 CA LEU A 909 10.290 -1.169 -7.241 1.00 0.00 C ATOM 174 C LEU A 909 9.515 -0.373 -6.202 1.00 0.00 C ATOM 175 O LEU A 909 9.452 0.854 -6.269 1.00 0.00 O ATOM 176 CB LEU A 909 9.488 -2.397 -7.664 1.00 0.00 C ATOM 177 CG LEU A 909 10.281 -3.434 -8.454 1.00 0.00 C ATOM 178 CD1 LEU A 909 9.355 -4.527 -8.956 1.00 0.00 C ATOM 179 CD2 LEU A 909 11.022 -2.775 -9.609 1.00 0.00 C ATOM 0 H LEU A 909 12.383 -1.202 -7.255 1.00 0.00 H new ATOM 0 HA LEU A 909 10.452 -0.528 -8.108 1.00 0.00 H new ATOM 0 HB2 LEU A 909 9.080 -2.873 -6.772 1.00 0.00 H new ATOM 0 HB3 LEU A 909 8.640 -2.071 -8.267 1.00 0.00 H new ATOM 0 HG LEU A 909 11.022 -3.886 -7.795 1.00 0.00 H new ATOM 0 HD11 LEU A 909 9.931 -5.262 -9.518 1.00 0.00 H new ATOM 0 HD12 LEU A 909 8.874 -5.015 -8.108 1.00 0.00 H new ATOM 0 HD13 LEU A 909 8.594 -4.090 -9.603 1.00 0.00 H new ATOM 0 HD21 LEU A 909 11.582 -3.530 -10.161 1.00 0.00 H new ATOM 0 HD22 LEU A 909 10.305 -2.296 -10.276 1.00 0.00 H new ATOM 0 HD23 LEU A 909 11.711 -2.026 -9.219 1.00 0.00 H new ATOM 191 N PHE A 910 8.940 -1.073 -5.232 1.00 0.00 N ATOM 192 CA PHE A 910 8.182 -0.426 -4.173 1.00 0.00 C ATOM 193 C PHE A 910 9.118 0.085 -3.087 1.00 0.00 C ATOM 194 O PHE A 910 8.786 0.065 -1.902 1.00 0.00 O ATOM 195 CB PHE A 910 7.151 -1.397 -3.584 1.00 0.00 C ATOM 196 CG PHE A 910 7.698 -2.767 -3.282 1.00 0.00 C ATOM 197 CD1 PHE A 910 8.842 -2.928 -2.514 1.00 0.00 C ATOM 198 CD2 PHE A 910 7.062 -3.898 -3.769 1.00 0.00 C ATOM 199 CE1 PHE A 910 9.339 -4.187 -2.238 1.00 0.00 C ATOM 200 CE2 PHE A 910 7.555 -5.160 -3.497 1.00 0.00 C ATOM 201 CZ PHE A 910 8.695 -5.305 -2.730 1.00 0.00 C ATOM 0 H PHE A 910 8.985 -2.089 -5.158 1.00 0.00 H new ATOM 0 HA PHE A 910 7.650 0.426 -4.597 1.00 0.00 H new ATOM 0 HB2 PHE A 910 6.747 -0.969 -2.667 1.00 0.00 H new ATOM 0 HB3 PHE A 910 6.320 -1.495 -4.283 1.00 0.00 H new ATOM 0 HD1 PHE A 910 9.351 -2.058 -2.127 1.00 0.00 H new ATOM 0 HD2 PHE A 910 6.170 -3.792 -4.369 1.00 0.00 H new ATOM 0 HE1 PHE A 910 10.230 -4.297 -1.638 1.00 0.00 H new ATOM 0 HE2 PHE A 910 7.049 -6.032 -3.884 1.00 0.00 H new ATOM 0 HZ PHE A 910 9.082 -6.290 -2.516 1.00 0.00 H new ATOM 211 N ALA A 911 10.295 0.542 -3.506 1.00 0.00 N ATOM 212 CA ALA A 911 11.292 1.059 -2.580 1.00 0.00 C ATOM 213 C ALA A 911 12.222 2.052 -3.268 1.00 0.00 C ATOM 214 O ALA A 911 12.578 1.880 -4.434 1.00 0.00 O ATOM 215 CB ALA A 911 12.093 -0.083 -1.976 1.00 0.00 C ATOM 0 H ALA A 911 10.580 0.564 -4.485 1.00 0.00 H new ATOM 0 HA ALA A 911 10.769 1.586 -1.782 1.00 0.00 H new ATOM 0 HB1 ALA A 911 12.835 0.318 -1.286 1.00 0.00 H new ATOM 0 HB2 ALA A 911 11.422 -0.753 -1.439 1.00 0.00 H new ATOM 0 HB3 ALA A 911 12.597 -0.634 -2.770 1.00 0.00 H new ATOM 221 N LYS A 912 12.611 3.089 -2.536 1.00 0.00 N ATOM 222 CA LYS A 912 13.502 4.114 -3.064 1.00 0.00 C ATOM 223 C LYS A 912 14.468 4.604 -1.992 1.00 0.00 C ATOM 224 O LYS A 912 14.117 4.690 -0.815 1.00 0.00 O ATOM 225 CB LYS A 912 12.703 5.292 -3.627 1.00 0.00 C ATOM 226 CG LYS A 912 11.763 5.933 -2.620 1.00 0.00 C ATOM 227 CD LYS A 912 10.988 7.084 -3.240 1.00 0.00 C ATOM 228 CE LYS A 912 10.033 7.720 -2.242 1.00 0.00 C ATOM 229 NZ LYS A 912 9.269 8.847 -2.844 1.00 0.00 N ATOM 0 H LYS A 912 12.321 3.242 -1.570 1.00 0.00 H new ATOM 0 HA LYS A 912 14.080 3.665 -3.872 1.00 0.00 H new ATOM 0 HB2 LYS A 912 13.398 6.048 -3.994 1.00 0.00 H new ATOM 0 HB3 LYS A 912 12.123 4.949 -4.484 1.00 0.00 H new ATOM 0 HG2 LYS A 912 11.066 5.185 -2.243 1.00 0.00 H new ATOM 0 HG3 LYS A 912 12.335 6.296 -1.766 1.00 0.00 H new ATOM 0 HD2 LYS A 912 11.686 7.837 -3.607 1.00 0.00 H new ATOM 0 HD3 LYS A 912 10.427 6.723 -4.102 1.00 0.00 H new ATOM 0 HE2 LYS A 912 9.337 6.966 -1.874 1.00 0.00 H new ATOM 0 HE3 LYS A 912 10.596 8.082 -1.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 912 8.630 9.253 -2.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 912 9.931 9.579 -3.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 912 8.712 8.498 -3.650 1.00 0.00 H new ATOM 243 N LEU A 913 15.687 4.913 -2.417 1.00 0.00 N ATOM 244 CA LEU A 913 16.739 5.390 -1.522 1.00 0.00 C ATOM 245 C LEU A 913 16.225 6.421 -0.516 1.00 0.00 C ATOM 246 O LEU A 913 15.265 7.145 -0.781 1.00 0.00 O ATOM 247 CB LEU A 913 17.874 5.999 -2.341 1.00 0.00 C ATOM 248 CG LEU A 913 19.025 6.584 -1.525 1.00 0.00 C ATOM 249 CD1 LEU A 913 19.764 5.487 -0.772 1.00 0.00 C ATOM 250 CD2 LEU A 913 19.971 7.353 -2.428 1.00 0.00 C ATOM 0 H LEU A 913 15.976 4.841 -3.392 1.00 0.00 H new ATOM 0 HA LEU A 913 17.099 4.530 -0.956 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.274 5.232 -3.005 1.00 0.00 H new ATOM 0 HB3 LEU A 913 17.462 6.785 -2.974 1.00 0.00 H new ATOM 0 HG LEU A 913 18.613 7.275 -0.790 1.00 0.00 H new ATOM 0 HD11 LEU A 913 20.580 5.926 -0.198 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.074 4.982 -0.096 1.00 0.00 H new ATOM 0 HD13 LEU A 913 20.168 4.766 -1.483 1.00 0.00 H new ATOM 0 HD21 LEU A 913 20.787 7.765 -1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 913 20.376 6.682 -3.186 1.00 0.00 H new ATOM 0 HD23 LEU A 913 19.430 8.165 -2.914 1.00 0.00 H new ATOM 262 N LYS A 914 16.891 6.480 0.636 1.00 0.00 N ATOM 263 CA LYS A 914 16.535 7.418 1.696 1.00 0.00 C ATOM 264 C LYS A 914 17.787 7.842 2.462 1.00 0.00 C ATOM 265 O LYS A 914 17.821 7.827 3.692 1.00 0.00 O ATOM 266 CB LYS A 914 15.518 6.791 2.649 1.00 0.00 C ATOM 267 CG LYS A 914 15.003 7.742 3.725 1.00 0.00 C ATOM 268 CD LYS A 914 13.988 8.744 3.184 1.00 0.00 C ATOM 269 CE LYS A 914 14.647 9.844 2.367 1.00 0.00 C ATOM 270 NZ LYS A 914 13.654 10.833 1.863 1.00 0.00 N ATOM 0 H LYS A 914 17.687 5.883 0.859 1.00 0.00 H new ATOM 0 HA LYS A 914 16.082 8.300 1.243 1.00 0.00 H new ATOM 0 HB2 LYS A 914 14.672 6.423 2.069 1.00 0.00 H new ATOM 0 HB3 LYS A 914 15.974 5.926 3.131 1.00 0.00 H new ATOM 0 HG2 LYS A 914 14.545 7.163 4.527 1.00 0.00 H new ATOM 0 HG3 LYS A 914 15.844 8.281 4.161 1.00 0.00 H new ATOM 0 HD2 LYS A 914 13.258 8.222 2.565 1.00 0.00 H new ATOM 0 HD3 LYS A 914 13.441 9.189 4.015 1.00 0.00 H new ATOM 0 HE2 LYS A 914 15.390 10.355 2.979 1.00 0.00 H new ATOM 0 HE3 LYS A 914 15.178 9.402 1.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 914 14.144 11.566 1.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 914 12.960 10.350 1.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 914 13.165 11.274 2.668 1.00 0.00 H new ATOM 284 N THR A 915 18.816 8.215 1.710 1.00 0.00 N ATOM 285 CA THR A 915 20.090 8.642 2.278 1.00 0.00 C ATOM 286 C THR A 915 20.991 9.222 1.194 1.00 0.00 C ATOM 287 O THR A 915 21.080 8.673 0.095 1.00 0.00 O ATOM 288 CB THR A 915 20.826 7.472 2.966 1.00 0.00 C ATOM 289 OG1 THR A 915 20.168 7.120 4.189 1.00 0.00 O ATOM 290 CG2 THR A 915 22.280 7.824 3.247 1.00 0.00 C ATOM 0 H THR A 915 18.791 8.230 0.690 1.00 0.00 H new ATOM 0 HA THR A 915 19.868 9.405 3.024 1.00 0.00 H new ATOM 0 HB THR A 915 20.804 6.620 2.287 1.00 0.00 H new ATOM 0 HG1 THR A 915 19.353 7.655 4.287 1.00 0.00 H new ATOM 0 HG21 THR A 915 22.771 6.980 3.732 1.00 0.00 H new ATOM 0 HG22 THR A 915 22.788 8.050 2.309 1.00 0.00 H new ATOM 0 HG23 THR A 915 22.324 8.694 3.902 1.00 0.00 H new ATOM 298 N GLN A 916 21.659 10.332 1.505 1.00 0.00 N ATOM 299 CA GLN A 916 22.551 10.971 0.546 1.00 0.00 C ATOM 300 C GLN A 916 23.560 9.964 0.002 1.00 0.00 C ATOM 301 O GLN A 916 24.165 9.207 0.759 1.00 0.00 O ATOM 302 CB GLN A 916 23.260 12.170 1.185 1.00 0.00 C ATOM 303 CG GLN A 916 23.860 11.885 2.553 1.00 0.00 C ATOM 304 CD GLN A 916 25.102 11.020 2.492 1.00 0.00 C ATOM 305 OE1 GLN A 916 26.086 11.369 1.838 1.00 0.00 O ATOM 306 NE2 GLN A 916 25.067 9.884 3.181 1.00 0.00 N ATOM 0 H GLN A 916 21.599 10.803 2.408 1.00 0.00 H new ATOM 0 HA GLN A 916 21.956 11.339 -0.290 1.00 0.00 H new ATOM 0 HB2 GLN A 916 24.052 12.507 0.517 1.00 0.00 H new ATOM 0 HB3 GLN A 916 22.549 12.991 1.277 1.00 0.00 H new ATOM 0 HG2 GLN A 916 24.106 12.829 3.038 1.00 0.00 H new ATOM 0 HG3 GLN A 916 23.112 11.393 3.175 1.00 0.00 H new ATOM 0 HE21 GLN A 916 24.231 9.634 3.709 1.00 0.00 H new ATOM 0 HE22 GLN A 916 25.876 9.263 3.181 1.00 0.00 H new ATOM 315 N THR A 917 23.715 9.943 -1.318 1.00 0.00 N ATOM 316 CA THR A 917 24.629 9.009 -1.967 1.00 0.00 C ATOM 317 C THR A 917 25.141 9.561 -3.293 1.00 0.00 C ATOM 318 O THR A 917 24.966 8.938 -4.343 1.00 0.00 O ATOM 319 CB THR A 917 23.950 7.651 -2.234 1.00 0.00 C ATOM 320 OG1 THR A 917 22.822 7.829 -3.097 1.00 0.00 O ATOM 321 CG2 THR A 917 23.503 6.989 -0.939 1.00 0.00 C ATOM 0 H THR A 917 23.219 10.562 -1.959 1.00 0.00 H new ATOM 0 HA THR A 917 25.466 8.870 -1.283 1.00 0.00 H new ATOM 0 HB THR A 917 24.681 7.001 -2.714 1.00 0.00 H new ATOM 0 HG1 THR A 917 23.125 8.169 -3.965 1.00 0.00 H new ATOM 0 HG21 THR A 917 23.028 6.034 -1.164 1.00 0.00 H new ATOM 0 HG22 THR A 917 24.369 6.822 -0.298 1.00 0.00 H new ATOM 0 HG23 THR A 917 22.791 7.636 -0.426 1.00 0.00 H new ATOM 329 N THR A 918 25.775 10.728 -3.245 1.00 0.00 N ATOM 330 CA THR A 918 26.311 11.353 -4.449 1.00 0.00 C ATOM 331 C THR A 918 27.182 10.374 -5.229 1.00 0.00 C ATOM 332 O THR A 918 27.073 10.267 -6.451 1.00 0.00 O ATOM 333 CB THR A 918 27.139 12.608 -4.108 1.00 0.00 C ATOM 334 OG1 THR A 918 26.328 13.553 -3.400 1.00 0.00 O ATOM 335 CG2 THR A 918 27.691 13.255 -5.370 1.00 0.00 C ATOM 0 H THR A 918 25.930 11.259 -2.388 1.00 0.00 H new ATOM 0 HA THR A 918 25.460 11.648 -5.064 1.00 0.00 H new ATOM 0 HB THR A 918 27.975 12.302 -3.480 1.00 0.00 H new ATOM 0 HG1 THR A 918 26.862 14.346 -3.186 1.00 0.00 H new ATOM 0 HG21 THR A 918 28.271 14.138 -5.102 1.00 0.00 H new ATOM 0 HG22 THR A 918 28.332 12.545 -5.893 1.00 0.00 H new ATOM 0 HG23 THR A 918 26.866 13.546 -6.020 1.00 0.00 H new ATOM 343 N ALA A 919 28.042 9.656 -4.512 1.00 0.00 N ATOM 344 CA ALA A 919 28.929 8.677 -5.129 1.00 0.00 C ATOM 345 C ALA A 919 28.147 7.462 -5.621 1.00 0.00 C ATOM 346 O ALA A 919 27.172 7.048 -4.994 1.00 0.00 O ATOM 347 CB ALA A 919 30.009 8.251 -4.147 1.00 0.00 C ATOM 0 H ALA A 919 28.143 9.735 -3.500 1.00 0.00 H new ATOM 0 HA ALA A 919 29.403 9.145 -5.992 1.00 0.00 H new ATOM 0 HB1 ALA A 919 30.664 7.520 -4.621 1.00 0.00 H new ATOM 0 HB2 ALA A 919 30.593 9.122 -3.848 1.00 0.00 H new ATOM 0 HB3 ALA A 919 29.545 7.806 -3.267 1.00 0.00 H new ATOM 353 N SER A 920 28.579 6.895 -6.744 1.00 0.00 N ATOM 354 CA SER A 920 27.916 5.727 -7.314 1.00 0.00 C ATOM 355 C SER A 920 28.465 4.438 -6.710 1.00 0.00 C ATOM 356 O SER A 920 27.710 3.515 -6.404 1.00 0.00 O ATOM 357 CB SER A 920 28.087 5.706 -8.829 1.00 0.00 C ATOM 358 OG SER A 920 27.544 6.873 -9.422 1.00 0.00 O ATOM 0 H SER A 920 29.384 7.225 -7.276 1.00 0.00 H new ATOM 0 HA SER A 920 26.854 5.794 -7.077 1.00 0.00 H new ATOM 0 HB2 SER A 920 29.145 5.628 -9.077 1.00 0.00 H new ATOM 0 HB3 SER A 920 27.597 4.824 -9.241 1.00 0.00 H new ATOM 0 HG SER A 920 27.669 6.835 -10.393 1.00 0.00 H new ATOM 364 N ASP A 921 29.783 4.384 -6.538 1.00 0.00 N ATOM 365 CA ASP A 921 30.434 3.210 -5.964 1.00 0.00 C ATOM 366 C ASP A 921 30.410 3.281 -4.439 1.00 0.00 C ATOM 367 O ASP A 921 30.488 4.365 -3.862 1.00 0.00 O ATOM 368 CB ASP A 921 31.877 3.105 -6.462 1.00 0.00 C ATOM 369 CG ASP A 921 31.963 2.992 -7.971 1.00 0.00 C ATOM 370 OD1 ASP A 921 31.485 3.915 -8.664 1.00 0.00 O ATOM 371 OD2 ASP A 921 32.511 1.982 -8.460 1.00 0.00 O ATOM 0 H ASP A 921 30.421 5.139 -6.788 1.00 0.00 H new ATOM 0 HA ASP A 921 29.887 2.322 -6.282 1.00 0.00 H new ATOM 0 HB2 ASP A 921 32.436 3.981 -6.134 1.00 0.00 H new ATOM 0 HB3 ASP A 921 32.352 2.236 -6.008 1.00 0.00 H new ATOM 376 N PHE A 922 30.292 2.124 -3.790 1.00 0.00 N ATOM 377 CA PHE A 922 30.247 2.077 -2.331 1.00 0.00 C ATOM 378 C PHE A 922 31.141 0.978 -1.766 1.00 0.00 C ATOM 379 O PHE A 922 31.178 -0.138 -2.285 1.00 0.00 O ATOM 380 CB PHE A 922 28.816 1.859 -1.841 1.00 0.00 C ATOM 381 CG PHE A 922 27.899 3.011 -2.114 1.00 0.00 C ATOM 382 CD1 PHE A 922 27.449 3.271 -3.398 1.00 0.00 C ATOM 383 CD2 PHE A 922 27.482 3.833 -1.082 1.00 0.00 C ATOM 384 CE1 PHE A 922 26.603 4.332 -3.647 1.00 0.00 C ATOM 385 CE2 PHE A 922 26.635 4.894 -1.323 1.00 0.00 C ATOM 386 CZ PHE A 922 26.194 5.145 -2.608 1.00 0.00 C ATOM 0 H PHE A 922 30.226 1.214 -4.247 1.00 0.00 H new ATOM 0 HA PHE A 922 30.617 3.039 -1.975 1.00 0.00 H new ATOM 0 HB2 PHE A 922 28.412 0.965 -2.316 1.00 0.00 H new ATOM 0 HB3 PHE A 922 28.835 1.669 -0.768 1.00 0.00 H new ATOM 0 HD1 PHE A 922 27.764 2.636 -4.213 1.00 0.00 H new ATOM 0 HD2 PHE A 922 27.824 3.641 -0.076 1.00 0.00 H new ATOM 0 HE1 PHE A 922 26.261 4.527 -4.653 1.00 0.00 H new ATOM 0 HE2 PHE A 922 26.317 5.528 -0.509 1.00 0.00 H new ATOM 0 HZ PHE A 922 25.531 5.975 -2.800 1.00 0.00 H new ATOM 396 N PRO A 923 31.861 1.283 -0.672 1.00 0.00 N ATOM 397 CA PRO A 923 32.746 0.321 -0.009 1.00 0.00 C ATOM 398 C PRO A 923 31.957 -0.771 0.704 1.00 0.00 C ATOM 399 O PRO A 923 30.910 -0.502 1.296 1.00 0.00 O ATOM 400 CB PRO A 923 33.509 1.179 1.002 1.00 0.00 C ATOM 401 CG PRO A 923 32.597 2.318 1.295 1.00 0.00 C ATOM 402 CD PRO A 923 31.852 2.591 0.016 1.00 0.00 C ATOM 0 HA PRO A 923 33.394 -0.200 -0.713 1.00 0.00 H new ATOM 0 HB2 PRO A 923 33.741 0.615 1.905 1.00 0.00 H new ATOM 0 HB3 PRO A 923 34.457 1.526 0.591 1.00 0.00 H new ATOM 0 HG2 PRO A 923 31.908 2.069 2.102 1.00 0.00 H new ATOM 0 HG3 PRO A 923 33.159 3.196 1.615 1.00 0.00 H new ATOM 0 HD2 PRO A 923 30.836 2.937 0.209 1.00 0.00 H new ATOM 0 HD3 PRO A 923 32.343 3.361 -0.579 1.00 0.00 H new ATOM 410 N ILE A 924 32.453 -2.002 0.641 1.00 0.00 N ATOM 411 CA ILE A 924 31.778 -3.126 1.279 1.00 0.00 C ATOM 412 C ILE A 924 31.571 -2.875 2.769 1.00 0.00 C ATOM 413 O ILE A 924 32.413 -2.270 3.433 1.00 0.00 O ATOM 414 CB ILE A 924 32.545 -4.444 1.081 1.00 0.00 C ATOM 415 CG1 ILE A 924 32.896 -4.643 -0.396 1.00 0.00 C ATOM 416 CG2 ILE A 924 31.699 -5.599 1.589 1.00 0.00 C ATOM 417 CD1 ILE A 924 33.719 -5.885 -0.665 1.00 0.00 C ATOM 0 H ILE A 924 33.317 -2.246 0.157 1.00 0.00 H new ATOM 0 HA ILE A 924 30.805 -3.218 0.795 1.00 0.00 H new ATOM 0 HB ILE A 924 33.476 -4.407 1.646 1.00 0.00 H new ATOM 0 HG12 ILE A 924 31.974 -4.697 -0.975 1.00 0.00 H new ATOM 0 HG13 ILE A 924 33.445 -3.771 -0.750 1.00 0.00 H new ATOM 0 HG21 ILE A 924 32.240 -6.535 1.450 1.00 0.00 H new ATOM 0 HG22 ILE A 924 31.487 -5.456 2.649 1.00 0.00 H new ATOM 0 HG23 ILE A 924 30.762 -5.636 1.033 1.00 0.00 H new ATOM 0 HD11 ILE A 924 33.928 -5.959 -1.732 1.00 0.00 H new ATOM 0 HD12 ILE A 924 34.658 -5.826 -0.114 1.00 0.00 H new ATOM 0 HD13 ILE A 924 33.164 -6.766 -0.343 1.00 0.00 H new ATOM 429 N GLY A 925 30.429 -3.330 3.279 1.00 0.00 N ATOM 430 CA GLY A 925 30.104 -3.133 4.679 1.00 0.00 C ATOM 431 C GLY A 925 29.166 -1.960 4.871 1.00 0.00 C ATOM 432 O GLY A 925 28.385 -1.919 5.821 1.00 0.00 O ATOM 0 H GLY A 925 29.721 -3.833 2.744 1.00 0.00 H new ATOM 0 HA2 GLY A 925 29.644 -4.037 5.078 1.00 0.00 H new ATOM 0 HA3 GLY A 925 31.020 -2.965 5.246 1.00 0.00 H new ATOM 436 N THR A 926 29.255 -1.004 3.954 1.00 0.00 N ATOM 437 CA THR A 926 28.426 0.194 3.987 1.00 0.00 C ATOM 438 C THR A 926 26.935 -0.136 4.016 1.00 0.00 C ATOM 439 O THR A 926 26.450 -0.946 3.224 1.00 0.00 O ATOM 440 CB THR A 926 28.716 1.085 2.764 1.00 0.00 C ATOM 441 OG1 THR A 926 30.016 1.674 2.882 1.00 0.00 O ATOM 442 CG2 THR A 926 27.667 2.174 2.616 1.00 0.00 C ATOM 0 H THR A 926 29.903 -1.038 3.167 1.00 0.00 H new ATOM 0 HA THR A 926 28.678 0.724 4.906 1.00 0.00 H new ATOM 0 HB THR A 926 28.683 0.457 1.874 1.00 0.00 H new ATOM 0 HG1 THR A 926 30.638 1.019 3.262 1.00 0.00 H new ATOM 0 HG21 THR A 926 27.899 2.786 1.745 1.00 0.00 H new ATOM 0 HG22 THR A 926 26.685 1.718 2.489 1.00 0.00 H new ATOM 0 HG23 THR A 926 27.664 2.800 3.509 1.00 0.00 H new ATOM 450 N SER A 927 26.212 0.522 4.920 1.00 0.00 N ATOM 451 CA SER A 927 24.770 0.332 5.046 1.00 0.00 C ATOM 452 C SER A 927 24.035 1.428 4.282 1.00 0.00 C ATOM 453 O SER A 927 24.479 2.577 4.260 1.00 0.00 O ATOM 454 CB SER A 927 24.347 0.352 6.518 1.00 0.00 C ATOM 455 OG SER A 927 22.966 0.068 6.655 1.00 0.00 O ATOM 0 H SER A 927 26.605 1.195 5.579 1.00 0.00 H new ATOM 0 HA SER A 927 24.511 -0.639 4.625 1.00 0.00 H new ATOM 0 HB2 SER A 927 24.929 -0.380 7.077 1.00 0.00 H new ATOM 0 HB3 SER A 927 24.565 1.329 6.949 1.00 0.00 H new ATOM 0 HG SER A 927 22.706 -0.614 6.001 1.00 0.00 H new ATOM 461 N LEU A 928 22.916 1.081 3.655 1.00 0.00 N ATOM 462 CA LEU A 928 22.149 2.064 2.897 1.00 0.00 C ATOM 463 C LEU A 928 20.656 1.938 3.197 1.00 0.00 C ATOM 464 O LEU A 928 20.075 0.862 3.074 1.00 0.00 O ATOM 465 CB LEU A 928 22.411 1.892 1.400 1.00 0.00 C ATOM 466 CG LEU A 928 22.390 3.188 0.587 1.00 0.00 C ATOM 467 CD1 LEU A 928 23.422 4.168 1.130 1.00 0.00 C ATOM 468 CD2 LEU A 928 22.653 2.901 -0.883 1.00 0.00 C ATOM 0 H LEU A 928 22.524 0.140 3.655 1.00 0.00 H new ATOM 0 HA LEU A 928 22.470 3.061 3.199 1.00 0.00 H new ATOM 0 HB2 LEU A 928 23.382 1.414 1.269 1.00 0.00 H new ATOM 0 HB3 LEU A 928 21.663 1.212 0.991 1.00 0.00 H new ATOM 0 HG LEU A 928 21.401 3.637 0.677 1.00 0.00 H new ATOM 0 HD11 LEU A 928 23.397 5.086 0.543 1.00 0.00 H new ATOM 0 HD12 LEU A 928 23.194 4.397 2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 928 24.415 3.723 1.066 1.00 0.00 H new ATOM 0 HD21 LEU A 928 22.634 3.835 -1.445 1.00 0.00 H new ATOM 0 HD22 LEU A 928 23.630 2.431 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 928 21.883 2.231 -1.266 1.00 0.00 H new ATOM 480 N LYS A 929 20.049 3.045 3.610 1.00 0.00 N ATOM 481 CA LYS A 929 18.630 3.068 3.953 1.00 0.00 C ATOM 482 C LYS A 929 17.740 3.287 2.736 1.00 0.00 C ATOM 483 O LYS A 929 17.996 4.171 1.919 1.00 0.00 O ATOM 484 CB LYS A 929 18.366 4.170 4.978 1.00 0.00 C ATOM 485 CG LYS A 929 19.089 3.949 6.292 1.00 0.00 C ATOM 486 CD LYS A 929 18.814 5.067 7.280 1.00 0.00 C ATOM 487 CE LYS A 929 19.631 4.894 8.546 1.00 0.00 C ATOM 488 NZ LYS A 929 21.092 5.021 8.287 1.00 0.00 N ATOM 0 H LYS A 929 20.520 3.944 3.716 1.00 0.00 H new ATOM 0 HA LYS A 929 18.383 2.092 4.370 1.00 0.00 H new ATOM 0 HB2 LYS A 929 18.673 5.128 4.559 1.00 0.00 H new ATOM 0 HB3 LYS A 929 17.294 4.233 5.166 1.00 0.00 H new ATOM 0 HG2 LYS A 929 18.777 2.998 6.723 1.00 0.00 H new ATOM 0 HG3 LYS A 929 20.161 3.880 6.110 1.00 0.00 H new ATOM 0 HD2 LYS A 929 19.049 6.027 6.821 1.00 0.00 H new ATOM 0 HD3 LYS A 929 17.753 5.083 7.528 1.00 0.00 H new ATOM 0 HE2 LYS A 929 19.326 5.641 9.279 1.00 0.00 H new ATOM 0 HE3 LYS A 929 19.423 3.916 8.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 21.593 5.168 9.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 21.441 4.152 7.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 21.264 5.832 7.659 1.00 0.00 H new ATOM 502 N TYR A 930 16.679 2.488 2.635 1.00 0.00 N ATOM 503 CA TYR A 930 15.735 2.610 1.528 1.00 0.00 C ATOM 504 C TYR A 930 14.291 2.623 2.026 1.00 0.00 C ATOM 505 O TYR A 930 13.843 1.686 2.685 1.00 0.00 O ATOM 506 CB TYR A 930 15.920 1.469 0.523 1.00 0.00 C ATOM 507 CG TYR A 930 17.020 1.705 -0.487 1.00 0.00 C ATOM 508 CD1 TYR A 930 18.333 1.911 -0.086 1.00 0.00 C ATOM 509 CD2 TYR A 930 16.740 1.720 -1.848 1.00 0.00 C ATOM 510 CE1 TYR A 930 19.335 2.126 -1.011 1.00 0.00 C ATOM 511 CE2 TYR A 930 17.737 1.935 -2.779 1.00 0.00 C ATOM 512 CZ TYR A 930 19.032 2.138 -2.356 1.00 0.00 C ATOM 513 OH TYR A 930 20.026 2.356 -3.281 1.00 0.00 O ATOM 0 H TYR A 930 16.453 1.752 3.304 1.00 0.00 H new ATOM 0 HA TYR A 930 15.941 3.559 1.033 1.00 0.00 H new ATOM 0 HB2 TYR A 930 16.134 0.550 1.069 1.00 0.00 H new ATOM 0 HB3 TYR A 930 14.981 1.312 -0.009 1.00 0.00 H new ATOM 0 HD1 TYR A 930 18.574 1.903 0.967 1.00 0.00 H new ATOM 0 HD2 TYR A 930 15.726 1.561 -2.183 1.00 0.00 H new ATOM 0 HE1 TYR A 930 20.352 2.284 -0.683 1.00 0.00 H new ATOM 0 HE2 TYR A 930 17.503 1.944 -3.833 1.00 0.00 H new ATOM 0 HH TYR A 930 19.644 2.332 -4.183 1.00 0.00 H new ATOM 523 N GLU A 931 13.566 3.686 1.685 1.00 0.00 N ATOM 524 CA GLU A 931 12.164 3.822 2.074 1.00 0.00 C ATOM 525 C GLU A 931 11.255 3.341 0.953 1.00 0.00 C ATOM 526 O GLU A 931 11.419 3.740 -0.198 1.00 0.00 O ATOM 527 CB GLU A 931 11.832 5.279 2.407 1.00 0.00 C ATOM 528 CG GLU A 931 12.403 5.758 3.730 1.00 0.00 C ATOM 529 CD GLU A 931 11.728 5.121 4.930 1.00 0.00 C ATOM 530 OE1 GLU A 931 10.859 4.247 4.732 1.00 0.00 O ATOM 531 OE2 GLU A 931 12.070 5.500 6.069 1.00 0.00 O ATOM 0 H GLU A 931 13.927 4.468 1.139 1.00 0.00 H new ATOM 0 HA GLU A 931 12.000 3.210 2.961 1.00 0.00 H new ATOM 0 HB2 GLU A 931 12.209 5.918 1.608 1.00 0.00 H new ATOM 0 HB3 GLU A 931 10.749 5.398 2.427 1.00 0.00 H new ATOM 0 HG2 GLU A 931 13.470 5.538 3.760 1.00 0.00 H new ATOM 0 HG3 GLU A 931 12.299 6.841 3.794 1.00 0.00 H new ATOM 538 N CYS A 932 10.298 2.486 1.291 1.00 0.00 N ATOM 539 CA CYS A 932 9.366 1.952 0.306 1.00 0.00 C ATOM 540 C CYS A 932 8.623 3.072 -0.422 1.00 0.00 C ATOM 541 O CYS A 932 8.922 4.253 -0.240 1.00 0.00 O ATOM 542 CB CYS A 932 8.366 1.024 0.994 1.00 0.00 C ATOM 543 SG CYS A 932 9.146 -0.258 2.029 1.00 0.00 S ATOM 0 H CYS A 932 10.147 2.147 2.241 1.00 0.00 H new ATOM 0 HA CYS A 932 9.937 1.392 -0.434 1.00 0.00 H new ATOM 0 HB2 CYS A 932 7.697 1.621 1.614 1.00 0.00 H new ATOM 0 HB3 CYS A 932 7.751 0.541 0.235 1.00 0.00 H new ATOM 548 N ARG A 933 7.648 2.693 -1.241 1.00 0.00 N ATOM 549 CA ARG A 933 6.856 3.664 -1.990 1.00 0.00 C ATOM 550 C ARG A 933 5.737 4.233 -1.123 1.00 0.00 C ATOM 551 O ARG A 933 5.274 3.578 -0.191 1.00 0.00 O ATOM 552 CB ARG A 933 6.266 3.027 -3.252 1.00 0.00 C ATOM 553 CG ARG A 933 7.264 2.878 -4.390 1.00 0.00 C ATOM 554 CD ARG A 933 6.612 2.281 -5.630 1.00 0.00 C ATOM 555 NE ARG A 933 7.471 2.387 -6.806 1.00 0.00 N ATOM 556 CZ ARG A 933 7.133 1.937 -8.010 1.00 0.00 C ATOM 557 NH1 ARG A 933 5.957 1.351 -8.196 1.00 0.00 N ATOM 558 NH2 ARG A 933 7.969 2.072 -9.030 1.00 0.00 N ATOM 0 H ARG A 933 7.387 1.721 -1.404 1.00 0.00 H new ATOM 0 HA ARG A 933 7.518 4.478 -2.286 1.00 0.00 H new ATOM 0 HB2 ARG A 933 5.868 2.044 -2.999 1.00 0.00 H new ATOM 0 HB3 ARG A 933 5.427 3.632 -3.594 1.00 0.00 H new ATOM 0 HG2 ARG A 933 7.687 3.852 -4.634 1.00 0.00 H new ATOM 0 HG3 ARG A 933 8.090 2.242 -4.070 1.00 0.00 H new ATOM 0 HD2 ARG A 933 6.377 1.233 -5.446 1.00 0.00 H new ATOM 0 HD3 ARG A 933 5.668 2.790 -5.824 1.00 0.00 H new ATOM 0 HE ARG A 933 8.382 2.832 -6.697 1.00 0.00 H new ATOM 0 HH11 ARG A 933 5.311 1.245 -7.414 1.00 0.00 H new ATOM 0 HH12 ARG A 933 5.700 1.006 -9.121 1.00 0.00 H new ATOM 0 HH21 ARG A 933 8.874 2.522 -8.892 1.00 0.00 H new ATOM 0 HH22 ARG A 933 7.707 1.726 -9.953 1.00 0.00 H new ATOM 572 N PRO A 934 5.295 5.472 -1.416 1.00 0.00 N ATOM 573 CA PRO A 934 4.231 6.135 -0.657 1.00 0.00 C ATOM 574 C PRO A 934 3.054 5.209 -0.369 1.00 0.00 C ATOM 575 O PRO A 934 2.488 5.235 0.724 1.00 0.00 O ATOM 576 CB PRO A 934 3.807 7.272 -1.584 1.00 0.00 C ATOM 577 CG PRO A 934 5.044 7.616 -2.338 1.00 0.00 C ATOM 578 CD PRO A 934 5.804 6.327 -2.509 1.00 0.00 C ATOM 0 HA PRO A 934 4.570 6.465 0.325 1.00 0.00 H new ATOM 0 HB2 PRO A 934 3.007 6.960 -2.255 1.00 0.00 H new ATOM 0 HB3 PRO A 934 3.435 8.127 -1.020 1.00 0.00 H new ATOM 0 HG2 PRO A 934 4.801 8.056 -3.305 1.00 0.00 H new ATOM 0 HG3 PRO A 934 5.639 8.350 -1.795 1.00 0.00 H new ATOM 0 HD2 PRO A 934 5.620 5.880 -3.486 1.00 0.00 H new ATOM 0 HD3 PRO A 934 6.880 6.483 -2.428 1.00 0.00 H new ATOM 586 N GLU A 935 2.691 4.391 -1.352 1.00 0.00 N ATOM 587 CA GLU A 935 1.584 3.453 -1.197 1.00 0.00 C ATOM 588 C GLU A 935 1.972 2.291 -0.284 1.00 0.00 C ATOM 589 O GLU A 935 1.365 1.221 -0.331 1.00 0.00 O ATOM 590 CB GLU A 935 1.148 2.920 -2.564 1.00 0.00 C ATOM 591 CG GLU A 935 0.705 4.009 -3.528 1.00 0.00 C ATOM 592 CD GLU A 935 0.307 3.461 -4.885 1.00 0.00 C ATOM 593 OE1 GLU A 935 -0.632 2.640 -4.941 1.00 0.00 O ATOM 594 OE2 GLU A 935 0.935 3.853 -5.891 1.00 0.00 O ATOM 0 H GLU A 935 3.147 4.359 -2.264 1.00 0.00 H new ATOM 0 HA GLU A 935 0.752 3.986 -0.737 1.00 0.00 H new ATOM 0 HB2 GLU A 935 1.974 2.366 -3.009 1.00 0.00 H new ATOM 0 HB3 GLU A 935 0.329 2.214 -2.425 1.00 0.00 H new ATOM 0 HG2 GLU A 935 -0.138 4.549 -3.097 1.00 0.00 H new ATOM 0 HG3 GLU A 935 1.514 4.729 -3.654 1.00 0.00 H new ATOM 601 N TYR A 936 2.989 2.512 0.545 1.00 0.00 N ATOM 602 CA TYR A 936 3.468 1.495 1.476 1.00 0.00 C ATOM 603 C TYR A 936 3.883 2.133 2.795 1.00 0.00 C ATOM 604 O TYR A 936 4.537 3.176 2.809 1.00 0.00 O ATOM 605 CB TYR A 936 4.659 0.730 0.890 1.00 0.00 C ATOM 606 CG TYR A 936 4.336 -0.064 -0.353 1.00 0.00 C ATOM 607 CD1 TYR A 936 4.166 0.560 -1.581 1.00 0.00 C ATOM 608 CD2 TYR A 936 4.196 -1.444 -0.293 1.00 0.00 C ATOM 609 CE1 TYR A 936 3.867 -0.168 -2.716 1.00 0.00 C ATOM 610 CE2 TYR A 936 3.898 -2.179 -1.422 1.00 0.00 C ATOM 611 CZ TYR A 936 3.734 -1.538 -2.632 1.00 0.00 C ATOM 612 OH TYR A 936 3.438 -2.267 -3.760 1.00 0.00 O ATOM 0 H TYR A 936 3.500 3.393 0.590 1.00 0.00 H new ATOM 0 HA TYR A 936 2.650 0.796 1.651 1.00 0.00 H new ATOM 0 HB2 TYR A 936 5.453 1.440 0.658 1.00 0.00 H new ATOM 0 HB3 TYR A 936 5.049 0.052 1.649 1.00 0.00 H new ATOM 0 HD1 TYR A 936 4.269 1.633 -1.650 1.00 0.00 H new ATOM 0 HD2 TYR A 936 4.322 -1.950 0.653 1.00 0.00 H new ATOM 0 HE1 TYR A 936 3.738 0.333 -3.664 1.00 0.00 H new ATOM 0 HE2 TYR A 936 3.794 -3.252 -1.358 1.00 0.00 H new ATOM 0 HH TYR A 936 3.380 -3.218 -3.529 1.00 0.00 H new ATOM 622 N TYR A 937 3.511 1.501 3.902 1.00 0.00 N ATOM 623 CA TYR A 937 3.862 2.018 5.221 1.00 0.00 C ATOM 624 C TYR A 937 5.032 1.243 5.817 1.00 0.00 C ATOM 625 O TYR A 937 5.093 1.008 7.024 1.00 0.00 O ATOM 626 CB TYR A 937 2.649 1.993 6.160 1.00 0.00 C ATOM 627 CG TYR A 937 1.948 0.652 6.258 1.00 0.00 C ATOM 628 CD1 TYR A 937 2.587 -0.461 6.794 1.00 0.00 C ATOM 629 CD2 TYR A 937 0.638 0.503 5.820 1.00 0.00 C ATOM 630 CE1 TYR A 937 1.942 -1.679 6.888 1.00 0.00 C ATOM 631 CE2 TYR A 937 -0.014 -0.711 5.910 1.00 0.00 C ATOM 632 CZ TYR A 937 0.642 -1.799 6.445 1.00 0.00 C ATOM 633 OH TYR A 937 -0.004 -3.011 6.538 1.00 0.00 O ATOM 0 H TYR A 937 2.970 0.636 3.914 1.00 0.00 H new ATOM 0 HA TYR A 937 4.174 3.056 5.104 1.00 0.00 H new ATOM 0 HB2 TYR A 937 2.973 2.291 7.157 1.00 0.00 H new ATOM 0 HB3 TYR A 937 1.930 2.739 5.822 1.00 0.00 H new ATOM 0 HD1 TYR A 937 3.605 -0.371 7.143 1.00 0.00 H new ATOM 0 HD2 TYR A 937 0.120 1.353 5.401 1.00 0.00 H new ATOM 0 HE1 TYR A 937 2.454 -2.533 7.307 1.00 0.00 H new ATOM 0 HE2 TYR A 937 -1.032 -0.808 5.563 1.00 0.00 H new ATOM 0 HH TYR A 937 -0.913 -2.925 6.183 1.00 0.00 H new ATOM 643 N GLY A 938 5.963 0.858 4.952 1.00 0.00 N ATOM 644 CA GLY A 938 7.130 0.115 5.389 1.00 0.00 C ATOM 645 C GLY A 938 8.236 1.012 5.911 1.00 0.00 C ATOM 646 O GLY A 938 8.505 2.072 5.345 1.00 0.00 O ATOM 0 H GLY A 938 5.930 1.048 3.950 1.00 0.00 H new ATOM 0 HA2 GLY A 938 6.837 -0.586 6.171 1.00 0.00 H new ATOM 0 HA3 GLY A 938 7.511 -0.477 4.557 1.00 0.00 H new ATOM 650 N ARG A 939 8.885 0.582 6.989 1.00 0.00 N ATOM 651 CA ARG A 939 9.974 1.344 7.585 1.00 0.00 C ATOM 652 C ARG A 939 11.222 1.265 6.707 1.00 0.00 C ATOM 653 O ARG A 939 11.321 0.399 5.835 1.00 0.00 O ATOM 654 CB ARG A 939 10.287 0.819 8.989 1.00 0.00 C ATOM 655 CG ARG A 939 10.878 -0.580 8.999 1.00 0.00 C ATOM 656 CD ARG A 939 11.254 -1.012 10.406 1.00 0.00 C ATOM 657 NE ARG A 939 11.870 -2.336 10.430 1.00 0.00 N ATOM 658 CZ ARG A 939 13.025 -2.629 9.835 1.00 0.00 C ATOM 659 NH1 ARG A 939 13.695 -1.690 9.179 1.00 0.00 N ATOM 660 NH2 ARG A 939 13.512 -3.859 9.900 1.00 0.00 N ATOM 0 H ARG A 939 8.674 -0.293 7.468 1.00 0.00 H new ATOM 0 HA ARG A 939 9.663 2.386 7.661 1.00 0.00 H new ATOM 0 HB2 ARG A 939 10.983 1.502 9.476 1.00 0.00 H new ATOM 0 HB3 ARG A 939 9.372 0.822 9.581 1.00 0.00 H new ATOM 0 HG2 ARG A 939 10.158 -1.284 8.581 1.00 0.00 H new ATOM 0 HG3 ARG A 939 11.760 -0.609 8.360 1.00 0.00 H new ATOM 0 HD2 ARG A 939 11.943 -0.285 10.836 1.00 0.00 H new ATOM 0 HD3 ARG A 939 10.363 -1.016 11.033 1.00 0.00 H new ATOM 0 HE ARG A 939 11.387 -3.081 10.932 1.00 0.00 H new ATOM 0 HH11 ARG A 939 13.326 -0.740 9.129 1.00 0.00 H new ATOM 0 HH12 ARG A 939 14.579 -1.918 8.724 1.00 0.00 H new ATOM 0 HH21 ARG A 939 13.002 -4.583 10.406 1.00 0.00 H new ATOM 0 HH22 ARG A 939 14.397 -4.082 9.444 1.00 0.00 H new ATOM 674 N PRO A 940 12.196 2.166 6.921 1.00 0.00 N ATOM 675 CA PRO A 940 13.434 2.183 6.138 1.00 0.00 C ATOM 676 C PRO A 940 14.253 0.916 6.338 1.00 0.00 C ATOM 677 O PRO A 940 14.781 0.678 7.425 1.00 0.00 O ATOM 678 CB PRO A 940 14.205 3.393 6.679 1.00 0.00 C ATOM 679 CG PRO A 940 13.594 3.691 8.004 1.00 0.00 C ATOM 680 CD PRO A 940 12.166 3.225 7.939 1.00 0.00 C ATOM 0 HA PRO A 940 13.228 2.241 5.069 1.00 0.00 H new ATOM 0 HB2 PRO A 940 15.267 3.170 6.778 1.00 0.00 H new ATOM 0 HB3 PRO A 940 14.120 4.246 6.006 1.00 0.00 H new ATOM 0 HG2 PRO A 940 14.132 3.179 8.802 1.00 0.00 H new ATOM 0 HG3 PRO A 940 13.643 4.758 8.221 1.00 0.00 H new ATOM 0 HD2 PRO A 940 11.823 2.846 8.902 1.00 0.00 H new ATOM 0 HD3 PRO A 940 11.492 4.034 7.657 1.00 0.00 H new ATOM 688 N PHE A 941 14.368 0.108 5.289 1.00 0.00 N ATOM 689 CA PHE A 941 15.140 -1.121 5.380 1.00 0.00 C ATOM 690 C PHE A 941 16.588 -0.876 4.975 1.00 0.00 C ATOM 691 O PHE A 941 16.886 -0.526 3.830 1.00 0.00 O ATOM 692 CB PHE A 941 14.504 -2.236 4.540 1.00 0.00 C ATOM 693 CG PHE A 941 14.388 -1.935 3.072 1.00 0.00 C ATOM 694 CD1 PHE A 941 15.408 -2.277 2.197 1.00 0.00 C ATOM 695 CD2 PHE A 941 13.250 -1.333 2.565 1.00 0.00 C ATOM 696 CE1 PHE A 941 15.295 -2.019 0.846 1.00 0.00 C ATOM 697 CE2 PHE A 941 13.129 -1.075 1.214 1.00 0.00 C ATOM 698 CZ PHE A 941 14.154 -1.418 0.354 1.00 0.00 C ATOM 0 H PHE A 941 13.942 0.280 4.378 1.00 0.00 H new ATOM 0 HA PHE A 941 15.134 -1.452 6.419 1.00 0.00 H new ATOM 0 HB2 PHE A 941 15.092 -3.145 4.664 1.00 0.00 H new ATOM 0 HB3 PHE A 941 13.509 -2.444 4.933 1.00 0.00 H new ATOM 0 HD1 PHE A 941 16.301 -2.751 2.577 1.00 0.00 H new ATOM 0 HD2 PHE A 941 12.447 -1.062 3.234 1.00 0.00 H new ATOM 0 HE1 PHE A 941 16.098 -2.287 0.175 1.00 0.00 H new ATOM 0 HE2 PHE A 941 12.235 -0.606 0.831 1.00 0.00 H new ATOM 0 HZ PHE A 941 14.063 -1.216 -0.703 1.00 0.00 H new ATOM 708 N SER A 942 17.482 -1.037 5.941 1.00 0.00 N ATOM 709 CA SER A 942 18.906 -0.832 5.721 1.00 0.00 C ATOM 710 C SER A 942 19.557 -2.033 5.038 1.00 0.00 C ATOM 711 O SER A 942 19.540 -3.142 5.572 1.00 0.00 O ATOM 712 CB SER A 942 19.609 -0.551 7.050 1.00 0.00 C ATOM 713 OG SER A 942 19.450 -1.634 7.951 1.00 0.00 O ATOM 0 H SER A 942 17.242 -1.312 6.894 1.00 0.00 H new ATOM 0 HA SER A 942 19.013 0.027 5.059 1.00 0.00 H new ATOM 0 HB2 SER A 942 20.670 -0.374 6.873 1.00 0.00 H new ATOM 0 HB3 SER A 942 19.204 0.358 7.494 1.00 0.00 H new ATOM 0 HG SER A 942 19.364 -2.470 7.446 1.00 0.00 H new ATOM 719 N ILE A 943 20.171 -1.802 3.883 1.00 0.00 N ATOM 720 CA ILE A 943 20.872 -2.862 3.170 1.00 0.00 C ATOM 721 C ILE A 943 22.359 -2.782 3.494 1.00 0.00 C ATOM 722 O ILE A 943 22.758 -1.987 4.346 1.00 0.00 O ATOM 723 CB ILE A 943 20.652 -2.794 1.645 1.00 0.00 C ATOM 724 CG1 ILE A 943 20.836 -1.362 1.133 1.00 0.00 C ATOM 725 CG2 ILE A 943 19.271 -3.321 1.288 1.00 0.00 C ATOM 726 CD1 ILE A 943 20.647 -1.229 -0.365 1.00 0.00 C ATOM 0 H ILE A 943 20.197 -0.893 3.422 1.00 0.00 H new ATOM 0 HA ILE A 943 20.464 -3.817 3.502 1.00 0.00 H new ATOM 0 HB ILE A 943 21.398 -3.423 1.160 1.00 0.00 H new ATOM 0 HG12 ILE A 943 20.126 -0.709 1.641 1.00 0.00 H new ATOM 0 HG13 ILE A 943 21.835 -1.015 1.398 1.00 0.00 H new ATOM 0 HG21 ILE A 943 19.129 -3.267 0.209 1.00 0.00 H new ATOM 0 HG22 ILE A 943 19.181 -4.357 1.615 1.00 0.00 H new ATOM 0 HG23 ILE A 943 18.512 -2.717 1.784 1.00 0.00 H new ATOM 0 HD11 ILE A 943 20.792 -0.189 -0.659 1.00 0.00 H new ATOM 0 HD12 ILE A 943 21.374 -1.856 -0.881 1.00 0.00 H new ATOM 0 HD13 ILE A 943 19.639 -1.545 -0.634 1.00 0.00 H new ATOM 738 N THR A 944 23.184 -3.601 2.847 1.00 0.00 N ATOM 739 CA THR A 944 24.613 -3.576 3.142 1.00 0.00 C ATOM 740 C THR A 944 25.450 -4.325 2.115 1.00 0.00 C ATOM 741 O THR A 944 25.143 -5.464 1.759 1.00 0.00 O ATOM 742 CB THR A 944 24.877 -4.181 4.543 1.00 0.00 C ATOM 743 OG1 THR A 944 25.241 -3.147 5.465 1.00 0.00 O ATOM 744 CG2 THR A 944 25.968 -5.249 4.506 1.00 0.00 C ATOM 0 H THR A 944 22.899 -4.273 2.134 1.00 0.00 H new ATOM 0 HA THR A 944 24.914 -2.529 3.110 1.00 0.00 H new ATOM 0 HB THR A 944 23.954 -4.659 4.873 1.00 0.00 H new ATOM 0 HG1 THR A 944 25.405 -3.539 6.348 1.00 0.00 H new ATOM 0 HG21 THR A 944 26.122 -5.647 5.509 1.00 0.00 H new ATOM 0 HG22 THR A 944 25.665 -6.055 3.838 1.00 0.00 H new ATOM 0 HG23 THR A 944 26.897 -4.808 4.145 1.00 0.00 H new ATOM 752 N CYS A 945 26.550 -3.702 1.689 1.00 0.00 N ATOM 753 CA CYS A 945 27.463 -4.354 0.764 1.00 0.00 C ATOM 754 C CYS A 945 28.078 -5.521 1.517 1.00 0.00 C ATOM 755 O CYS A 945 28.714 -5.331 2.552 1.00 0.00 O ATOM 756 CB CYS A 945 28.537 -3.384 0.277 1.00 0.00 C ATOM 757 SG CYS A 945 29.710 -4.101 -0.919 1.00 0.00 S ATOM 0 H CYS A 945 26.823 -2.760 1.968 1.00 0.00 H new ATOM 0 HA CYS A 945 26.937 -4.699 -0.126 1.00 0.00 H new ATOM 0 HB2 CYS A 945 28.051 -2.522 -0.181 1.00 0.00 H new ATOM 0 HB3 CYS A 945 29.094 -3.015 1.138 1.00 0.00 H new ATOM 762 N LEU A 946 27.810 -6.727 1.056 1.00 0.00 N ATOM 763 CA LEU A 946 28.268 -7.912 1.771 1.00 0.00 C ATOM 764 C LEU A 946 29.717 -8.301 1.529 1.00 0.00 C ATOM 765 O LEU A 946 30.481 -8.434 2.486 1.00 0.00 O ATOM 766 CB LEU A 946 27.312 -9.060 1.495 1.00 0.00 C ATOM 767 CG LEU A 946 25.918 -8.792 2.064 1.00 0.00 C ATOM 768 CD1 LEU A 946 24.976 -9.952 1.822 1.00 0.00 C ATOM 769 CD2 LEU A 946 26.029 -8.490 3.547 1.00 0.00 C ATOM 0 H LEU A 946 27.285 -6.916 0.202 1.00 0.00 H new ATOM 0 HA LEU A 946 28.255 -7.659 2.831 1.00 0.00 H new ATOM 0 HB2 LEU A 946 27.240 -9.222 0.419 1.00 0.00 H new ATOM 0 HB3 LEU A 946 27.711 -9.977 1.929 1.00 0.00 H new ATOM 0 HG LEU A 946 25.497 -7.930 1.547 1.00 0.00 H new ATOM 0 HD11 LEU A 946 23.997 -9.720 2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 946 24.879 -10.125 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 946 25.372 -10.848 2.299 1.00 0.00 H new ATOM 0 HD21 LEU A 946 25.036 -8.299 3.955 1.00 0.00 H new ATOM 0 HD22 LEU A 946 26.474 -9.343 4.060 1.00 0.00 H new ATOM 0 HD23 LEU A 946 26.657 -7.611 3.693 1.00 0.00 H new ATOM 781 N ASP A 947 30.099 -8.496 0.280 1.00 0.00 N ATOM 782 CA ASP A 947 31.473 -8.894 -0.025 1.00 0.00 C ATOM 783 C ASP A 947 31.645 -9.222 -1.502 1.00 0.00 C ATOM 784 O ASP A 947 32.572 -8.731 -2.145 1.00 0.00 O ATOM 785 CB ASP A 947 31.860 -10.108 0.826 1.00 0.00 C ATOM 786 CG ASP A 947 33.242 -10.651 0.502 1.00 0.00 C ATOM 787 OD1 ASP A 947 33.951 -10.033 -0.320 1.00 0.00 O ATOM 788 OD2 ASP A 947 33.618 -11.691 1.081 1.00 0.00 O ATOM 0 H ASP A 947 29.492 -8.389 -0.533 1.00 0.00 H new ATOM 0 HA ASP A 947 32.128 -8.055 0.210 1.00 0.00 H new ATOM 0 HB2 ASP A 947 31.823 -9.831 1.880 1.00 0.00 H new ATOM 0 HB3 ASP A 947 31.123 -10.897 0.678 1.00 0.00 H new ATOM 793 N ASN A 948 30.750 -10.039 -2.046 1.00 0.00 N ATOM 794 CA ASN A 948 30.834 -10.392 -3.454 1.00 0.00 C ATOM 795 C ASN A 948 30.166 -9.306 -4.285 1.00 0.00 C ATOM 796 O ASN A 948 29.579 -9.568 -5.337 1.00 0.00 O ATOM 797 CB ASN A 948 30.197 -11.762 -3.716 1.00 0.00 C ATOM 798 CG ASN A 948 28.708 -11.785 -3.441 1.00 0.00 C ATOM 799 OD1 ASN A 948 27.926 -11.160 -4.152 1.00 0.00 O ATOM 800 ND2 ASN A 948 28.310 -12.512 -2.403 1.00 0.00 N ATOM 0 H ASN A 948 29.971 -10.462 -1.542 1.00 0.00 H new ATOM 0 HA ASN A 948 31.882 -10.464 -3.743 1.00 0.00 H new ATOM 0 HB2 ASN A 948 30.374 -12.046 -4.753 1.00 0.00 H new ATOM 0 HB3 ASN A 948 30.688 -12.510 -3.093 1.00 0.00 H new ATOM 0 HD21 ASN A 948 27.319 -12.567 -2.169 1.00 0.00 H new ATOM 0 HD22 ASN A 948 28.996 -13.015 -1.840 1.00 0.00 H new ATOM 807 N LEU A 949 30.285 -8.075 -3.792 1.00 0.00 N ATOM 808 CA LEU A 949 29.729 -6.904 -4.450 1.00 0.00 C ATOM 809 C LEU A 949 28.214 -7.000 -4.582 1.00 0.00 C ATOM 810 O LEU A 949 27.662 -6.911 -5.680 1.00 0.00 O ATOM 811 CB LEU A 949 30.391 -6.705 -5.808 1.00 0.00 C ATOM 812 CG LEU A 949 31.922 -6.697 -5.761 1.00 0.00 C ATOM 813 CD1 LEU A 949 32.499 -6.391 -7.133 1.00 0.00 C ATOM 814 CD2 LEU A 949 32.420 -5.691 -4.730 1.00 0.00 C ATOM 0 H LEU A 949 30.773 -7.865 -2.921 1.00 0.00 H new ATOM 0 HA LEU A 949 29.938 -6.032 -3.830 1.00 0.00 H new ATOM 0 HB2 LEU A 949 30.063 -7.498 -6.480 1.00 0.00 H new ATOM 0 HB3 LEU A 949 30.046 -5.763 -6.234 1.00 0.00 H new ATOM 0 HG LEU A 949 32.262 -7.689 -5.463 1.00 0.00 H new ATOM 0 HD11 LEU A 949 33.588 -6.390 -7.078 1.00 0.00 H new ATOM 0 HD12 LEU A 949 32.172 -7.151 -7.843 1.00 0.00 H new ATOM 0 HD13 LEU A 949 32.152 -5.412 -7.464 1.00 0.00 H new ATOM 0 HD21 LEU A 949 33.510 -5.699 -4.711 1.00 0.00 H new ATOM 0 HD22 LEU A 949 32.069 -4.694 -4.996 1.00 0.00 H new ATOM 0 HD23 LEU A 949 32.038 -5.960 -3.745 1.00 0.00 H new ATOM 826 N VAL A 950 27.552 -7.172 -3.443 1.00 0.00 N ATOM 827 CA VAL A 950 26.100 -7.271 -3.399 1.00 0.00 C ATOM 828 C VAL A 950 25.533 -6.513 -2.211 1.00 0.00 C ATOM 829 O VAL A 950 26.210 -5.695 -1.591 1.00 0.00 O ATOM 830 CB VAL A 950 25.638 -8.731 -3.295 1.00 0.00 C ATOM 831 CG1 VAL A 950 25.654 -9.403 -4.654 1.00 0.00 C ATOM 832 CG2 VAL A 950 26.496 -9.484 -2.293 1.00 0.00 C ATOM 0 H VAL A 950 28.004 -7.246 -2.531 1.00 0.00 H new ATOM 0 HA VAL A 950 25.734 -6.835 -4.329 1.00 0.00 H new ATOM 0 HB VAL A 950 24.608 -8.745 -2.937 1.00 0.00 H new ATOM 0 HG11 VAL A 950 25.323 -10.436 -4.553 1.00 0.00 H new ATOM 0 HG12 VAL A 950 24.984 -8.872 -5.330 1.00 0.00 H new ATOM 0 HG13 VAL A 950 26.667 -9.385 -5.057 1.00 0.00 H new ATOM 0 HG21 VAL A 950 26.158 -10.518 -2.229 1.00 0.00 H new ATOM 0 HG22 VAL A 950 27.537 -9.462 -2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 950 26.410 -9.013 -1.314 1.00 0.00 H new ATOM 842 N TRP A 951 24.288 -6.820 -1.887 1.00 0.00 N ATOM 843 CA TRP A 951 23.609 -6.193 -0.768 1.00 0.00 C ATOM 844 C TRP A 951 22.680 -7.193 -0.106 1.00 0.00 C ATOM 845 O TRP A 951 21.824 -7.785 -0.765 1.00 0.00 O ATOM 846 CB TRP A 951 22.793 -4.980 -1.231 1.00 0.00 C ATOM 847 CG TRP A 951 23.620 -3.873 -1.821 1.00 0.00 C ATOM 848 CD1 TRP A 951 24.125 -3.807 -3.090 1.00 0.00 C ATOM 849 CD2 TRP A 951 24.046 -2.677 -1.160 1.00 0.00 C ATOM 850 NE1 TRP A 951 24.827 -2.635 -3.259 1.00 0.00 N ATOM 851 CE2 TRP A 951 24.796 -1.928 -2.086 1.00 0.00 C ATOM 852 CE3 TRP A 951 23.863 -2.167 0.127 1.00 0.00 C ATOM 853 CZ2 TRP A 951 25.359 -0.696 -1.765 1.00 0.00 C ATOM 854 CZ3 TRP A 951 24.423 -0.945 0.446 1.00 0.00 C ATOM 855 CH2 TRP A 951 25.163 -0.221 -0.497 1.00 0.00 C ATOM 0 H TRP A 951 23.724 -7.506 -2.389 1.00 0.00 H new ATOM 0 HA TRP A 951 24.364 -5.858 -0.057 1.00 0.00 H new ATOM 0 HB2 TRP A 951 22.063 -5.308 -1.971 1.00 0.00 H new ATOM 0 HB3 TRP A 951 22.232 -4.588 -0.383 1.00 0.00 H new ATOM 0 HD1 TRP A 951 23.992 -4.564 -3.849 1.00 0.00 H new ATOM 0 HE1 TRP A 951 25.294 -2.341 -4.117 1.00 0.00 H new ATOM 0 HE3 TRP A 951 23.293 -2.718 0.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 951 25.930 -0.135 -2.491 1.00 0.00 H new ATOM 0 HZ3 TRP A 951 24.288 -0.542 1.439 1.00 0.00 H new ATOM 0 HH2 TRP A 951 25.588 0.732 -0.218 1.00 0.00 H new ATOM 866 N SER A 952 22.860 -7.376 1.197 1.00 0.00 N ATOM 867 CA SER A 952 22.037 -8.306 1.958 1.00 0.00 C ATOM 868 C SER A 952 20.600 -8.241 1.474 1.00 0.00 C ATOM 869 O SER A 952 20.068 -7.158 1.233 1.00 0.00 O ATOM 870 CB SER A 952 22.104 -7.983 3.453 1.00 0.00 C ATOM 871 OG SER A 952 21.308 -8.880 4.205 1.00 0.00 O ATOM 0 H SER A 952 23.569 -6.892 1.748 1.00 0.00 H new ATOM 0 HA SER A 952 22.419 -9.315 1.805 1.00 0.00 H new ATOM 0 HB2 SER A 952 23.138 -8.036 3.794 1.00 0.00 H new ATOM 0 HB3 SER A 952 21.765 -6.961 3.623 1.00 0.00 H new ATOM 0 HG SER A 952 21.370 -8.653 5.156 1.00 0.00 H new ATOM 877 N SER A 953 19.981 -9.400 1.306 1.00 0.00 N ATOM 878 CA SER A 953 18.620 -9.455 0.823 1.00 0.00 C ATOM 879 C SER A 953 17.638 -9.096 1.929 1.00 0.00 C ATOM 880 O SER A 953 17.471 -9.844 2.893 1.00 0.00 O ATOM 881 CB SER A 953 18.324 -10.850 0.288 1.00 0.00 C ATOM 882 OG SER A 953 18.485 -11.831 1.297 1.00 0.00 O ATOM 0 H SER A 953 20.402 -10.309 1.498 1.00 0.00 H new ATOM 0 HA SER A 953 18.504 -8.728 0.019 1.00 0.00 H new ATOM 0 HB2 SER A 953 17.305 -10.886 -0.098 1.00 0.00 H new ATOM 0 HB3 SER A 953 18.989 -11.071 -0.547 1.00 0.00 H new ATOM 0 HG SER A 953 18.193 -11.466 2.158 1.00 0.00 H new ATOM 888 N PRO A 954 16.974 -7.936 1.800 1.00 0.00 N ATOM 889 CA PRO A 954 16.003 -7.469 2.789 1.00 0.00 C ATOM 890 C PRO A 954 14.778 -8.371 2.854 1.00 0.00 C ATOM 891 O PRO A 954 14.200 -8.724 1.826 1.00 0.00 O ATOM 892 CB PRO A 954 15.614 -6.068 2.296 1.00 0.00 C ATOM 893 CG PRO A 954 16.649 -5.697 1.286 1.00 0.00 C ATOM 894 CD PRO A 954 17.116 -6.988 0.684 1.00 0.00 C ATOM 0 HA PRO A 954 16.419 -7.470 3.797 1.00 0.00 H new ATOM 0 HB2 PRO A 954 14.618 -6.071 1.854 1.00 0.00 H new ATOM 0 HB3 PRO A 954 15.596 -5.354 3.119 1.00 0.00 H new ATOM 0 HG2 PRO A 954 16.233 -5.038 0.524 1.00 0.00 H new ATOM 0 HG3 PRO A 954 17.476 -5.162 1.753 1.00 0.00 H new ATOM 0 HD2 PRO A 954 16.509 -7.278 -0.173 1.00 0.00 H new ATOM 0 HD3 PRO A 954 18.147 -6.923 0.337 1.00 0.00 H new ATOM 902 N LYS A 955 14.383 -8.734 4.067 1.00 0.00 N ATOM 903 CA LYS A 955 13.221 -9.589 4.267 1.00 0.00 C ATOM 904 C LYS A 955 11.950 -8.763 4.119 1.00 0.00 C ATOM 905 O LYS A 955 11.829 -7.962 3.192 1.00 0.00 O ATOM 906 CB LYS A 955 13.292 -10.253 5.647 1.00 0.00 C ATOM 907 CG LYS A 955 12.377 -11.460 5.795 1.00 0.00 C ATOM 908 CD LYS A 955 12.504 -12.090 7.173 1.00 0.00 C ATOM 909 CE LYS A 955 11.601 -13.305 7.316 1.00 0.00 C ATOM 910 NZ LYS A 955 11.725 -13.935 8.659 1.00 0.00 N ATOM 0 H LYS A 955 14.851 -8.449 4.928 1.00 0.00 H new ATOM 0 HA LYS A 955 13.210 -10.377 3.514 1.00 0.00 H new ATOM 0 HB2 LYS A 955 14.320 -10.562 5.839 1.00 0.00 H new ATOM 0 HB3 LYS A 955 13.033 -9.517 6.408 1.00 0.00 H new ATOM 0 HG2 LYS A 955 11.344 -11.157 5.626 1.00 0.00 H new ATOM 0 HG3 LYS A 955 12.622 -12.199 5.032 1.00 0.00 H new ATOM 0 HD2 LYS A 955 13.540 -12.383 7.346 1.00 0.00 H new ATOM 0 HD3 LYS A 955 12.249 -11.354 7.936 1.00 0.00 H new ATOM 0 HE2 LYS A 955 10.565 -13.009 7.148 1.00 0.00 H new ATOM 0 HE3 LYS A 955 11.852 -14.036 6.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 11.093 -14.759 8.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 12.708 -14.241 8.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 11.461 -13.246 9.392 1.00 0.00 H new ATOM 924 N ASP A 956 11.015 -8.948 5.030 1.00 0.00 N ATOM 925 CA ASP A 956 9.765 -8.203 4.989 1.00 0.00 C ATOM 926 C ASP A 956 9.970 -6.797 5.542 1.00 0.00 C ATOM 927 O ASP A 956 10.485 -6.622 6.646 1.00 0.00 O ATOM 928 CB ASP A 956 8.675 -8.935 5.779 1.00 0.00 C ATOM 929 CG ASP A 956 9.087 -9.247 7.207 1.00 0.00 C ATOM 930 OD1 ASP A 956 10.245 -8.954 7.572 1.00 0.00 O ATOM 931 OD2 ASP A 956 8.252 -9.794 7.957 1.00 0.00 O ATOM 0 H ASP A 956 11.093 -9.605 5.807 1.00 0.00 H new ATOM 0 HA ASP A 956 9.442 -8.126 3.951 1.00 0.00 H new ATOM 0 HB2 ASP A 956 7.772 -8.325 5.792 1.00 0.00 H new ATOM 0 HB3 ASP A 956 8.425 -9.864 5.267 1.00 0.00 H new ATOM 936 N VAL A 957 9.570 -5.797 4.761 1.00 0.00 N ATOM 937 CA VAL A 957 9.718 -4.403 5.164 1.00 0.00 C ATOM 938 C VAL A 957 8.624 -3.537 4.552 1.00 0.00 C ATOM 939 O VAL A 957 7.973 -2.758 5.247 1.00 0.00 O ATOM 940 CB VAL A 957 11.099 -3.837 4.755 1.00 0.00 C ATOM 941 CG1 VAL A 957 12.220 -4.506 5.538 1.00 0.00 C ATOM 942 CG2 VAL A 957 11.329 -3.999 3.261 1.00 0.00 C ATOM 0 H VAL A 957 9.141 -5.927 3.845 1.00 0.00 H new ATOM 0 HA VAL A 957 9.634 -4.378 6.250 1.00 0.00 H new ATOM 0 HB VAL A 957 11.104 -2.773 4.993 1.00 0.00 H new ATOM 0 HG11 VAL A 957 13.179 -4.089 5.230 1.00 0.00 H new ATOM 0 HG12 VAL A 957 12.074 -4.331 6.604 1.00 0.00 H new ATOM 0 HG13 VAL A 957 12.211 -5.578 5.342 1.00 0.00 H new ATOM 0 HG21 VAL A 957 12.306 -3.594 2.997 1.00 0.00 H new ATOM 0 HG22 VAL A 957 11.292 -5.057 3.000 1.00 0.00 H new ATOM 0 HG23 VAL A 957 10.554 -3.463 2.713 1.00 0.00 H new ATOM 952 N CYS A 958 8.422 -3.688 3.252 1.00 0.00 N ATOM 953 CA CYS A 958 7.401 -2.928 2.538 1.00 0.00 C ATOM 954 C CYS A 958 6.041 -3.604 2.664 1.00 0.00 C ATOM 955 O CYS A 958 5.936 -4.828 2.571 1.00 0.00 O ATOM 956 CB CYS A 958 7.776 -2.774 1.064 1.00 0.00 C ATOM 957 SG CYS A 958 9.318 -1.850 0.784 1.00 0.00 S ATOM 0 H CYS A 958 8.953 -4.332 2.666 1.00 0.00 H new ATOM 0 HA CYS A 958 7.341 -1.937 2.988 1.00 0.00 H new ATOM 0 HB2 CYS A 958 7.872 -3.764 0.619 1.00 0.00 H new ATOM 0 HB3 CYS A 958 6.962 -2.269 0.544 1.00 0.00 H new ATOM 962 N LYS A 959 5.003 -2.803 2.879 1.00 0.00 N ATOM 963 CA LYS A 959 3.650 -3.327 3.021 1.00 0.00 C ATOM 964 C LYS A 959 2.634 -2.376 2.393 1.00 0.00 C ATOM 965 O LYS A 959 2.661 -1.171 2.639 1.00 0.00 O ATOM 966 CB LYS A 959 3.320 -3.538 4.500 1.00 0.00 C ATOM 967 CG LYS A 959 4.271 -4.490 5.213 1.00 0.00 C ATOM 968 CD LYS A 959 4.141 -5.911 4.687 1.00 0.00 C ATOM 969 CE LYS A 959 5.092 -6.856 5.404 1.00 0.00 C ATOM 970 NZ LYS A 959 4.975 -8.251 4.897 1.00 0.00 N ATOM 0 H LYS A 959 5.073 -1.789 2.959 1.00 0.00 H new ATOM 0 HA LYS A 959 3.597 -4.284 2.502 1.00 0.00 H new ATOM 0 HB2 LYS A 959 3.338 -2.574 5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 959 2.304 -3.924 4.584 1.00 0.00 H new ATOM 0 HG2 LYS A 959 5.297 -4.146 5.082 1.00 0.00 H new ATOM 0 HG3 LYS A 959 4.064 -4.477 6.283 1.00 0.00 H new ATOM 0 HD2 LYS A 959 3.115 -6.256 4.817 1.00 0.00 H new ATOM 0 HD3 LYS A 959 4.349 -5.925 3.617 1.00 0.00 H new ATOM 0 HE2 LYS A 959 6.117 -6.507 5.275 1.00 0.00 H new ATOM 0 HE3 LYS A 959 4.882 -6.840 6.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 5.639 -8.864 5.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 4.004 -8.593 5.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 5.200 -8.271 3.882 1.00 0.00 H new ATOM 984 N ARG A 960 1.743 -2.931 1.576 1.00 0.00 N ATOM 985 CA ARG A 960 0.718 -2.139 0.900 1.00 0.00 C ATOM 986 C ARG A 960 -0.176 -1.398 1.887 1.00 0.00 C ATOM 987 O ARG A 960 -0.943 -2.014 2.626 1.00 0.00 O ATOM 988 CB ARG A 960 -0.144 -3.041 0.015 1.00 0.00 C ATOM 989 CG ARG A 960 0.399 -3.222 -1.390 1.00 0.00 C ATOM 990 CD ARG A 960 0.150 -1.989 -2.242 1.00 0.00 C ATOM 991 NE ARG A 960 0.731 -2.117 -3.575 1.00 0.00 N ATOM 992 CZ ARG A 960 0.631 -1.185 -4.517 1.00 0.00 C ATOM 993 NH1 ARG A 960 -0.029 -0.060 -4.276 1.00 0.00 N ATOM 994 NH2 ARG A 960 1.192 -1.377 -5.704 1.00 0.00 N ATOM 0 H ARG A 960 1.710 -3.928 1.365 1.00 0.00 H new ATOM 0 HA ARG A 960 1.233 -1.398 0.289 1.00 0.00 H new ATOM 0 HB2 ARG A 960 -0.234 -4.019 0.488 1.00 0.00 H new ATOM 0 HB3 ARG A 960 -1.148 -2.622 -0.045 1.00 0.00 H new ATOM 0 HG2 ARG A 960 1.469 -3.425 -1.345 1.00 0.00 H new ATOM 0 HG3 ARG A 960 -0.071 -4.089 -1.855 1.00 0.00 H new ATOM 0 HD2 ARG A 960 -0.923 -1.820 -2.329 1.00 0.00 H new ATOM 0 HD3 ARG A 960 0.571 -1.115 -1.746 1.00 0.00 H new ATOM 0 HE ARG A 960 1.243 -2.971 -3.796 1.00 0.00 H new ATOM 0 HH11 ARG A 960 -0.462 0.092 -3.365 1.00 0.00 H new ATOM 0 HH12 ARG A 960 -0.104 0.653 -5.002 1.00 0.00 H new ATOM 0 HH21 ARG A 960 1.701 -2.241 -5.894 1.00 0.00 H new ATOM 0 HH22 ARG A 960 1.115 -0.661 -6.426 1.00 0.00 H new ATOM 1008 N LYS A 961 -0.093 -0.071 1.870 1.00 0.00 N ATOM 1009 CA LYS A 961 -0.921 0.752 2.738 1.00 0.00 C ATOM 1010 C LYS A 961 -2.393 0.460 2.462 1.00 0.00 C ATOM 1011 O LYS A 961 -2.721 -0.171 1.458 1.00 0.00 O ATOM 1012 CB LYS A 961 -0.609 2.237 2.526 1.00 0.00 C ATOM 1013 CG LYS A 961 -1.291 3.154 3.529 1.00 0.00 C ATOM 1014 CD LYS A 961 -0.739 4.570 3.465 1.00 0.00 C ATOM 1015 CE LYS A 961 -1.032 5.234 2.129 1.00 0.00 C ATOM 1016 NZ LYS A 961 -0.484 6.617 2.069 1.00 0.00 N ATOM 0 H LYS A 961 0.539 0.454 1.265 1.00 0.00 H new ATOM 0 HA LYS A 961 -0.703 0.511 3.778 1.00 0.00 H new ATOM 0 HB2 LYS A 961 0.469 2.385 2.586 1.00 0.00 H new ATOM 0 HB3 LYS A 961 -0.914 2.523 1.519 1.00 0.00 H new ATOM 0 HG2 LYS A 961 -2.363 3.173 3.334 1.00 0.00 H new ATOM 0 HG3 LYS A 961 -1.157 2.756 4.535 1.00 0.00 H new ATOM 0 HD2 LYS A 961 -1.173 5.165 4.269 1.00 0.00 H new ATOM 0 HD3 LYS A 961 0.338 4.547 3.630 1.00 0.00 H new ATOM 0 HE2 LYS A 961 -0.603 4.637 1.324 1.00 0.00 H new ATOM 0 HE3 LYS A 961 -2.109 5.262 1.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 -1.191 7.253 1.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 -0.255 6.942 3.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 0.378 6.624 1.486 1.00 0.00 H new ATOM 1030 N SER A 962 -3.280 0.902 3.345 1.00 0.00 N ATOM 1031 CA SER A 962 -4.705 0.652 3.159 1.00 0.00 C ATOM 1032 C SER A 962 -5.548 1.825 3.646 1.00 0.00 C ATOM 1033 O SER A 962 -5.237 2.451 4.660 1.00 0.00 O ATOM 1034 CB SER A 962 -5.116 -0.626 3.890 1.00 0.00 C ATOM 1035 OG SER A 962 -4.985 -0.479 5.293 1.00 0.00 O ATOM 0 H SER A 962 -3.043 1.428 4.186 1.00 0.00 H new ATOM 0 HA SER A 962 -4.884 0.531 2.091 1.00 0.00 H new ATOM 0 HB2 SER A 962 -6.148 -0.874 3.643 1.00 0.00 H new ATOM 0 HB3 SER A 962 -4.499 -1.457 3.550 1.00 0.00 H new ATOM 0 HG SER A 962 -5.256 -1.310 5.736 1.00 0.00 H new ATOM 1041 N CYS A 963 -6.613 2.116 2.906 1.00 0.00 N ATOM 1042 CA CYS A 963 -7.511 3.214 3.244 1.00 0.00 C ATOM 1043 C CYS A 963 -8.510 2.792 4.316 1.00 0.00 C ATOM 1044 O CYS A 963 -9.668 3.207 4.294 1.00 0.00 O ATOM 1045 CB CYS A 963 -8.266 3.680 1.994 1.00 0.00 C ATOM 1046 SG CYS A 963 -7.201 4.093 0.574 1.00 0.00 S ATOM 0 H CYS A 963 -6.876 1.604 2.064 1.00 0.00 H new ATOM 0 HA CYS A 963 -6.909 4.035 3.634 1.00 0.00 H new ATOM 0 HB2 CYS A 963 -8.962 2.897 1.693 1.00 0.00 H new ATOM 0 HB3 CYS A 963 -8.862 4.556 2.251 1.00 0.00 H new ATOM 1051 N LYS A 964 -8.046 1.971 5.252 1.00 0.00 N ATOM 1052 CA LYS A 964 -8.884 1.482 6.344 1.00 0.00 C ATOM 1053 C LYS A 964 -10.080 0.693 5.811 1.00 0.00 C ATOM 1054 O LYS A 964 -10.815 1.168 4.947 1.00 0.00 O ATOM 1055 CB LYS A 964 -9.361 2.655 7.200 1.00 0.00 C ATOM 1056 CG LYS A 964 -10.340 2.262 8.296 1.00 0.00 C ATOM 1057 CD LYS A 964 -9.708 1.312 9.300 1.00 0.00 C ATOM 1058 CE LYS A 964 -10.687 0.933 10.400 1.00 0.00 C ATOM 1059 NZ LYS A 964 -11.164 2.125 11.154 1.00 0.00 N ATOM 0 H LYS A 964 -7.086 1.627 5.277 1.00 0.00 H new ATOM 0 HA LYS A 964 -8.286 0.809 6.959 1.00 0.00 H new ATOM 0 HB2 LYS A 964 -8.495 3.135 7.655 1.00 0.00 H new ATOM 0 HB3 LYS A 964 -9.833 3.395 6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 964 -10.688 3.157 8.811 1.00 0.00 H new ATOM 0 HG3 LYS A 964 -11.216 1.790 7.850 1.00 0.00 H new ATOM 0 HD2 LYS A 964 -9.369 0.412 8.787 1.00 0.00 H new ATOM 0 HD3 LYS A 964 -8.827 1.779 9.740 1.00 0.00 H new ATOM 0 HE2 LYS A 964 -11.540 0.414 9.963 1.00 0.00 H new ATOM 0 HE3 LYS A 964 -10.208 0.236 11.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 -11.632 1.817 12.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 -10.354 2.734 11.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 -11.839 2.658 10.570 1.00 0.00 H new ATOM 1073 N THR A 965 -10.273 -0.516 6.332 1.00 0.00 N ATOM 1074 CA THR A 965 -11.384 -1.357 5.899 1.00 0.00 C ATOM 1075 C THR A 965 -12.718 -0.673 6.192 1.00 0.00 C ATOM 1076 O THR A 965 -12.932 -0.163 7.290 1.00 0.00 O ATOM 1077 CB THR A 965 -11.360 -2.734 6.594 1.00 0.00 C ATOM 1078 OG1 THR A 965 -10.045 -3.296 6.521 1.00 0.00 O ATOM 1079 CG2 THR A 965 -12.355 -3.687 5.942 1.00 0.00 C ATOM 0 H THR A 965 -9.679 -0.932 7.049 1.00 0.00 H new ATOM 0 HA THR A 965 -11.274 -1.507 4.825 1.00 0.00 H new ATOM 0 HB THR A 965 -11.641 -2.594 7.638 1.00 0.00 H new ATOM 0 HG1 THR A 965 -10.037 -4.169 6.966 1.00 0.00 H new ATOM 0 HG21 THR A 965 -12.321 -4.652 6.449 1.00 0.00 H new ATOM 0 HG22 THR A 965 -13.360 -3.272 6.019 1.00 0.00 H new ATOM 0 HG23 THR A 965 -12.097 -3.820 4.891 1.00 0.00 H new ATOM 1087 N PRO A 966 -13.636 -0.650 5.207 1.00 0.00 N ATOM 1088 CA PRO A 966 -14.950 -0.019 5.368 1.00 0.00 C ATOM 1089 C PRO A 966 -15.717 -0.571 6.567 1.00 0.00 C ATOM 1090 O PRO A 966 -15.754 -1.781 6.787 1.00 0.00 O ATOM 1091 CB PRO A 966 -15.684 -0.354 4.061 1.00 0.00 C ATOM 1092 CG PRO A 966 -14.885 -1.440 3.423 1.00 0.00 C ATOM 1093 CD PRO A 966 -13.469 -1.227 3.867 1.00 0.00 C ATOM 0 HA PRO A 966 -14.861 1.051 5.554 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -16.705 -0.681 4.257 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -15.748 0.519 3.412 1.00 0.00 H new ATOM 0 HG2 PRO A 966 -15.246 -2.422 3.729 1.00 0.00 H new ATOM 0 HG3 PRO A 966 -14.964 -1.396 2.337 1.00 0.00 H new ATOM 0 HD2 PRO A 966 -12.908 -2.161 3.895 1.00 0.00 H new ATOM 0 HD3 PRO A 966 -12.932 -0.553 3.200 1.00 0.00 H new ATOM 1101 N PRO A 967 -16.339 0.320 7.366 1.00 0.00 N ATOM 1102 CA PRO A 967 -17.107 -0.075 8.550 1.00 0.00 C ATOM 1103 C PRO A 967 -18.474 -0.657 8.199 1.00 0.00 C ATOM 1104 O PRO A 967 -19.492 -0.214 8.727 1.00 0.00 O ATOM 1105 CB PRO A 967 -17.264 1.238 9.314 1.00 0.00 C ATOM 1106 CG PRO A 967 -17.256 2.287 8.256 1.00 0.00 C ATOM 1107 CD PRO A 967 -16.337 1.785 7.174 1.00 0.00 C ATOM 0 HA PRO A 967 -16.608 -0.862 9.116 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -18.192 1.257 9.885 1.00 0.00 H new ATOM 0 HB3 PRO A 967 -16.450 1.384 10.024 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -18.260 2.455 7.867 1.00 0.00 H new ATOM 0 HG3 PRO A 967 -16.905 3.239 8.654 1.00 0.00 H new ATOM 0 HD2 PRO A 967 -16.698 2.060 6.183 1.00 0.00 H new ATOM 0 HD3 PRO A 967 -15.335 2.201 7.275 1.00 0.00 H new ATOM 1115 N ASP A 968 -18.475 -1.652 7.308 1.00 0.00 N ATOM 1116 CA ASP A 968 -19.698 -2.326 6.856 1.00 0.00 C ATOM 1117 C ASP A 968 -20.920 -1.404 6.891 1.00 0.00 C ATOM 1118 O ASP A 968 -21.505 -1.171 7.949 1.00 0.00 O ATOM 1119 CB ASP A 968 -19.959 -3.565 7.716 1.00 0.00 C ATOM 1120 CG ASP A 968 -21.176 -4.348 7.260 1.00 0.00 C ATOM 1121 OD1 ASP A 968 -22.292 -3.789 7.293 1.00 0.00 O ATOM 1122 OD2 ASP A 968 -21.013 -5.524 6.871 1.00 0.00 O ATOM 0 H ASP A 968 -17.625 -2.015 6.877 1.00 0.00 H new ATOM 0 HA ASP A 968 -19.541 -2.619 5.818 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -19.083 -4.213 7.687 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -20.096 -3.260 8.753 1.00 0.00 H new ATOM 1127 N PRO A 969 -21.334 -0.883 5.721 1.00 0.00 N ATOM 1128 CA PRO A 969 -22.498 0.006 5.615 1.00 0.00 C ATOM 1129 C PRO A 969 -23.743 -0.592 6.257 1.00 0.00 C ATOM 1130 O PRO A 969 -23.965 -1.802 6.197 1.00 0.00 O ATOM 1131 CB PRO A 969 -22.696 0.159 4.106 1.00 0.00 C ATOM 1132 CG PRO A 969 -21.354 -0.101 3.520 1.00 0.00 C ATOM 1133 CD PRO A 969 -20.707 -1.127 4.408 1.00 0.00 C ATOM 0 HA PRO A 969 -22.336 0.951 6.134 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -23.436 -0.548 3.730 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -23.052 1.158 3.853 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -21.439 -0.468 2.497 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -20.761 0.813 3.483 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -20.895 -2.141 4.055 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -19.625 -0.999 4.449 1.00 0.00 H new ATOM 1141 N VAL A 970 -24.550 0.266 6.872 1.00 0.00 N ATOM 1142 CA VAL A 970 -25.769 -0.160 7.530 1.00 0.00 C ATOM 1143 C VAL A 970 -26.653 -0.981 6.593 1.00 0.00 C ATOM 1144 O VAL A 970 -26.879 -0.602 5.444 1.00 0.00 O ATOM 1145 CB VAL A 970 -26.551 1.055 8.041 1.00 0.00 C ATOM 1146 CG1 VAL A 970 -26.816 2.016 6.904 1.00 0.00 C ATOM 1147 CG2 VAL A 970 -27.842 0.620 8.698 1.00 0.00 C ATOM 0 H VAL A 970 -24.375 1.269 6.926 1.00 0.00 H new ATOM 0 HA VAL A 970 -25.485 -0.790 8.372 1.00 0.00 H new ATOM 0 HB VAL A 970 -25.952 1.569 8.793 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -27.372 2.876 7.277 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -25.868 2.351 6.483 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -27.399 1.514 6.132 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -28.383 1.497 9.054 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -28.456 0.084 7.974 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -27.619 -0.035 9.540 1.00 0.00 H new ATOM 1157 N ASN A 971 -27.150 -2.107 7.101 1.00 0.00 N ATOM 1158 CA ASN A 971 -28.013 -2.990 6.321 1.00 0.00 C ATOM 1159 C ASN A 971 -27.372 -3.358 4.984 1.00 0.00 C ATOM 1160 O ASN A 971 -28.018 -3.295 3.939 1.00 0.00 O ATOM 1161 CB ASN A 971 -29.375 -2.333 6.086 1.00 0.00 C ATOM 1162 CG ASN A 971 -30.114 -2.054 7.380 1.00 0.00 C ATOM 1163 OD1 ASN A 971 -30.399 -2.968 8.155 1.00 0.00 O ATOM 1164 ND2 ASN A 971 -30.431 -0.788 7.620 1.00 0.00 N ATOM 0 H ASN A 971 -26.969 -2.429 8.052 1.00 0.00 H new ATOM 0 HA ASN A 971 -28.152 -3.907 6.893 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -29.236 -1.399 5.542 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -29.984 -2.981 5.456 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -30.930 -0.540 8.474 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -30.175 -0.062 6.950 1.00 0.00 H new ATOM 1171 N GLY A 972 -26.101 -3.749 5.027 1.00 0.00 N ATOM 1172 CA GLY A 972 -25.402 -4.128 3.811 1.00 0.00 C ATOM 1173 C GLY A 972 -24.040 -4.735 4.086 1.00 0.00 C ATOM 1174 O GLY A 972 -23.784 -5.221 5.189 1.00 0.00 O ATOM 0 H GLY A 972 -25.544 -3.810 5.879 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -26.009 -4.843 3.255 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -25.283 -3.250 3.176 1.00 0.00 H new ATOM 1178 N MET A 973 -23.165 -4.708 3.080 1.00 0.00 N ATOM 1179 CA MET A 973 -21.818 -5.262 3.211 1.00 0.00 C ATOM 1180 C MET A 973 -21.059 -5.183 1.889 1.00 0.00 C ATOM 1181 O MET A 973 -21.628 -5.414 0.818 1.00 0.00 O ATOM 1182 CB MET A 973 -21.882 -6.716 3.683 1.00 0.00 C ATOM 1183 CG MET A 973 -22.716 -7.610 2.781 1.00 0.00 C ATOM 1184 SD MET A 973 -22.809 -9.307 3.378 1.00 0.00 S ATOM 1185 CE MET A 973 -23.876 -10.036 2.139 1.00 0.00 C ATOM 0 H MET A 973 -23.366 -4.307 2.164 1.00 0.00 H new ATOM 0 HA MET A 973 -21.285 -4.667 3.952 1.00 0.00 H new ATOM 0 HB2 MET A 973 -20.870 -7.116 3.742 1.00 0.00 H new ATOM 0 HB3 MET A 973 -22.295 -6.744 4.691 1.00 0.00 H new ATOM 0 HG2 MET A 973 -23.723 -7.201 2.702 1.00 0.00 H new ATOM 0 HG3 MET A 973 -22.291 -7.605 1.777 1.00 0.00 H new ATOM 0 HE1 MET A 973 -24.032 -11.090 2.368 1.00 0.00 H new ATOM 0 HE2 MET A 973 -24.836 -9.520 2.136 1.00 0.00 H new ATOM 0 HE3 MET A 973 -23.411 -9.942 1.158 1.00 0.00 H new ATOM 1195 N VAL A 974 -19.773 -4.858 1.971 1.00 0.00 N ATOM 1196 CA VAL A 974 -18.930 -4.754 0.784 1.00 0.00 C ATOM 1197 C VAL A 974 -18.087 -6.011 0.594 1.00 0.00 C ATOM 1198 O VAL A 974 -17.394 -6.449 1.513 1.00 0.00 O ATOM 1199 CB VAL A 974 -17.987 -3.535 0.859 1.00 0.00 C ATOM 1200 CG1 VAL A 974 -17.091 -3.618 2.086 1.00 0.00 C ATOM 1201 CG2 VAL A 974 -17.148 -3.434 -0.404 1.00 0.00 C ATOM 0 H VAL A 974 -19.291 -4.662 2.848 1.00 0.00 H new ATOM 0 HA VAL A 974 -19.604 -4.633 -0.064 1.00 0.00 H new ATOM 0 HB VAL A 974 -18.599 -2.637 0.944 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -16.435 -2.748 2.117 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -17.707 -3.641 2.985 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -16.488 -4.525 2.036 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -16.489 -2.569 -0.335 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -16.550 -4.338 -0.517 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -17.803 -3.322 -1.268 1.00 0.00 H new ATOM 1211 N HIS A 975 -18.132 -6.581 -0.605 1.00 0.00 N ATOM 1212 CA HIS A 975 -17.349 -7.771 -0.899 1.00 0.00 C ATOM 1213 C HIS A 975 -15.980 -7.379 -1.430 1.00 0.00 C ATOM 1214 O HIS A 975 -15.875 -6.663 -2.432 1.00 0.00 O ATOM 1215 CB HIS A 975 -18.037 -8.659 -1.939 1.00 0.00 C ATOM 1216 CG HIS A 975 -19.497 -8.395 -2.112 1.00 0.00 C ATOM 1217 ND1 HIS A 975 -20.413 -8.492 -1.087 1.00 0.00 N ATOM 1218 CD2 HIS A 975 -20.198 -8.047 -3.214 1.00 0.00 C ATOM 1219 CE1 HIS A 975 -21.618 -8.215 -1.552 1.00 0.00 C ATOM 1220 NE2 HIS A 975 -21.514 -7.940 -2.840 1.00 0.00 N ATOM 0 H HIS A 975 -18.698 -6.240 -1.382 1.00 0.00 H new ATOM 0 HA HIS A 975 -17.251 -8.330 0.032 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -17.540 -8.523 -2.900 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -17.901 -9.702 -1.654 1.00 0.00 H new ATOM 0 HD1 HIS A 975 -20.195 -8.739 -0.122 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -19.797 -7.884 -4.204 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -22.532 -8.214 -0.977 1.00 0.00 H new ATOM 1229 N VAL A 976 -14.932 -7.866 -0.781 1.00 0.00 N ATOM 1230 CA VAL A 976 -13.580 -7.582 -1.223 1.00 0.00 C ATOM 1231 C VAL A 976 -13.265 -8.439 -2.443 1.00 0.00 C ATOM 1232 O VAL A 976 -13.412 -9.661 -2.405 1.00 0.00 O ATOM 1233 CB VAL A 976 -12.550 -7.843 -0.106 1.00 0.00 C ATOM 1234 CG1 VAL A 976 -11.136 -7.593 -0.608 1.00 0.00 C ATOM 1235 CG2 VAL A 976 -12.855 -6.970 1.106 1.00 0.00 C ATOM 0 H VAL A 976 -14.994 -8.456 0.049 1.00 0.00 H new ATOM 0 HA VAL A 976 -13.515 -6.526 -1.483 1.00 0.00 H new ATOM 0 HB VAL A 976 -12.621 -8.889 0.193 1.00 0.00 H new ATOM 0 HG11 VAL A 976 -10.425 -7.783 0.196 1.00 0.00 H new ATOM 0 HG12 VAL A 976 -10.924 -8.259 -1.445 1.00 0.00 H new ATOM 0 HG13 VAL A 976 -11.044 -6.558 -0.936 1.00 0.00 H new ATOM 0 HG21 VAL A 976 -12.121 -7.164 1.888 1.00 0.00 H new ATOM 0 HG22 VAL A 976 -12.810 -5.920 0.818 1.00 0.00 H new ATOM 0 HG23 VAL A 976 -13.852 -7.202 1.480 1.00 0.00 H new ATOM 1245 N ILE A 977 -12.866 -7.796 -3.533 1.00 0.00 N ATOM 1246 CA ILE A 977 -12.572 -8.513 -4.768 1.00 0.00 C ATOM 1247 C ILE A 977 -11.233 -9.234 -4.679 1.00 0.00 C ATOM 1248 O ILE A 977 -11.102 -10.378 -5.116 1.00 0.00 O ATOM 1249 CB ILE A 977 -12.558 -7.561 -5.982 1.00 0.00 C ATOM 1250 CG1 ILE A 977 -13.574 -6.428 -5.791 1.00 0.00 C ATOM 1251 CG2 ILE A 977 -12.868 -8.335 -7.254 1.00 0.00 C ATOM 1252 CD1 ILE A 977 -15.005 -6.901 -5.654 1.00 0.00 C ATOM 0 H ILE A 977 -12.739 -6.785 -3.588 1.00 0.00 H new ATOM 0 HA ILE A 977 -13.365 -9.248 -4.905 1.00 0.00 H new ATOM 0 HB ILE A 977 -11.564 -7.121 -6.067 1.00 0.00 H new ATOM 0 HG12 ILE A 977 -13.304 -5.858 -4.902 1.00 0.00 H new ATOM 0 HG13 ILE A 977 -13.507 -5.747 -6.639 1.00 0.00 H new ATOM 0 HG21 ILE A 977 -12.856 -7.655 -8.106 1.00 0.00 H new ATOM 0 HG22 ILE A 977 -12.117 -9.112 -7.399 1.00 0.00 H new ATOM 0 HG23 ILE A 977 -13.853 -8.794 -7.170 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -15.661 -6.041 -5.522 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -15.296 -7.445 -6.552 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -15.090 -7.558 -4.788 1.00 0.00 H new ATOM 1264 N THR A 978 -10.244 -8.562 -4.102 1.00 0.00 N ATOM 1265 CA THR A 978 -8.914 -9.137 -3.941 1.00 0.00 C ATOM 1266 C THR A 978 -8.292 -8.671 -2.634 1.00 0.00 C ATOM 1267 O THR A 978 -7.840 -9.478 -1.822 1.00 0.00 O ATOM 1268 CB THR A 978 -7.980 -8.745 -5.102 1.00 0.00 C ATOM 1269 OG1 THR A 978 -7.836 -7.321 -5.155 1.00 0.00 O ATOM 1270 CG2 THR A 978 -8.520 -9.253 -6.428 1.00 0.00 C ATOM 0 H THR A 978 -10.339 -7.614 -3.736 1.00 0.00 H new ATOM 0 HA THR A 978 -9.031 -10.221 -3.936 1.00 0.00 H new ATOM 0 HB THR A 978 -7.007 -9.203 -4.925 1.00 0.00 H new ATOM 0 HG1 THR A 978 -7.240 -7.080 -5.894 1.00 0.00 H new ATOM 0 HG21 THR A 978 -7.843 -8.963 -7.232 1.00 0.00 H new ATOM 0 HG22 THR A 978 -8.601 -10.340 -6.396 1.00 0.00 H new ATOM 0 HG23 THR A 978 -9.504 -8.821 -6.610 1.00 0.00 H new ATOM 1278 N ASP A 979 -8.286 -7.359 -2.439 1.00 0.00 N ATOM 1279 CA ASP A 979 -7.736 -6.756 -1.233 1.00 0.00 C ATOM 1280 C ASP A 979 -8.415 -5.416 -0.966 1.00 0.00 C ATOM 1281 O ASP A 979 -9.526 -5.173 -1.434 1.00 0.00 O ATOM 1282 CB ASP A 979 -6.223 -6.548 -1.373 1.00 0.00 C ATOM 1283 CG ASP A 979 -5.457 -7.841 -1.588 1.00 0.00 C ATOM 1284 OD1 ASP A 979 -5.599 -8.445 -2.670 1.00 0.00 O ATOM 1285 OD2 ASP A 979 -4.713 -8.247 -0.671 1.00 0.00 O ATOM 0 H ASP A 979 -8.660 -6.686 -3.108 1.00 0.00 H new ATOM 0 HA ASP A 979 -7.920 -7.430 -0.396 1.00 0.00 H new ATOM 0 HB2 ASP A 979 -6.031 -5.877 -2.210 1.00 0.00 H new ATOM 0 HB3 ASP A 979 -5.846 -6.055 -0.477 1.00 0.00 H new ATOM 1290 N ILE A 980 -7.735 -4.544 -0.230 1.00 0.00 N ATOM 1291 CA ILE A 980 -8.273 -3.225 0.080 1.00 0.00 C ATOM 1292 C ILE A 980 -7.150 -2.213 0.273 1.00 0.00 C ATOM 1293 O ILE A 980 -7.336 -1.173 0.907 1.00 0.00 O ATOM 1294 CB ILE A 980 -9.157 -3.250 1.343 1.00 0.00 C ATOM 1295 CG1 ILE A 980 -8.409 -3.902 2.508 1.00 0.00 C ATOM 1296 CG2 ILE A 980 -10.463 -3.979 1.066 1.00 0.00 C ATOM 1297 CD1 ILE A 980 -9.227 -3.987 3.779 1.00 0.00 C ATOM 0 H ILE A 980 -6.811 -4.726 0.163 1.00 0.00 H new ATOM 0 HA ILE A 980 -8.889 -2.928 -0.768 1.00 0.00 H new ATOM 0 HB ILE A 980 -9.392 -2.222 1.620 1.00 0.00 H new ATOM 0 HG12 ILE A 980 -8.101 -4.906 2.215 1.00 0.00 H new ATOM 0 HG13 ILE A 980 -7.499 -3.336 2.708 1.00 0.00 H new ATOM 0 HG21 ILE A 980 -11.074 -3.987 1.969 1.00 0.00 H new ATOM 0 HG22 ILE A 980 -11.002 -3.469 0.267 1.00 0.00 H new ATOM 0 HG23 ILE A 980 -10.250 -5.004 0.763 1.00 0.00 H new ATOM 0 HD11 ILE A 980 -8.634 -4.460 4.562 1.00 0.00 H new ATOM 0 HD12 ILE A 980 -9.513 -2.984 4.096 1.00 0.00 H new ATOM 0 HD13 ILE A 980 -10.124 -4.579 3.596 1.00 0.00 H new ATOM 1309 N GLN A 981 -5.987 -2.523 -0.290 1.00 0.00 N ATOM 1310 CA GLN A 981 -4.831 -1.641 -0.197 1.00 0.00 C ATOM 1311 C GLN A 981 -4.942 -0.526 -1.231 1.00 0.00 C ATOM 1312 O GLN A 981 -5.861 -0.530 -2.050 1.00 0.00 O ATOM 1313 CB GLN A 981 -3.540 -2.431 -0.417 1.00 0.00 C ATOM 1314 CG GLN A 981 -3.479 -3.741 0.355 1.00 0.00 C ATOM 1315 CD GLN A 981 -3.681 -3.567 1.849 1.00 0.00 C ATOM 1316 OE1 GLN A 981 -4.733 -3.114 2.298 1.00 0.00 O ATOM 1317 NE2 GLN A 981 -2.672 -3.935 2.629 1.00 0.00 N ATOM 0 H GLN A 981 -5.821 -3.381 -0.817 1.00 0.00 H new ATOM 0 HA GLN A 981 -4.806 -1.201 0.800 1.00 0.00 H new ATOM 0 HB2 GLN A 981 -3.432 -2.642 -1.481 1.00 0.00 H new ATOM 0 HB3 GLN A 981 -2.692 -1.810 -0.127 1.00 0.00 H new ATOM 0 HG2 GLN A 981 -4.241 -4.418 -0.031 1.00 0.00 H new ATOM 0 HG3 GLN A 981 -2.513 -4.214 0.179 1.00 0.00 H new ATOM 0 HE21 GLN A 981 -1.817 -4.306 2.215 1.00 0.00 H new ATOM 0 HE22 GLN A 981 -2.752 -3.847 3.642 1.00 0.00 H new ATOM 1326 N VAL A 982 -4.008 0.422 -1.197 1.00 0.00 N ATOM 1327 CA VAL A 982 -4.022 1.528 -2.151 1.00 0.00 C ATOM 1328 C VAL A 982 -3.946 1.011 -3.586 1.00 0.00 C ATOM 1329 O VAL A 982 -2.864 0.889 -4.159 1.00 0.00 O ATOM 1330 CB VAL A 982 -2.870 2.521 -1.897 1.00 0.00 C ATOM 1331 CG1 VAL A 982 -2.841 3.593 -2.976 1.00 0.00 C ATOM 1332 CG2 VAL A 982 -3.010 3.153 -0.520 1.00 0.00 C ATOM 0 H VAL A 982 -3.240 0.447 -0.527 1.00 0.00 H new ATOM 0 HA VAL A 982 -4.965 2.056 -2.009 1.00 0.00 H new ATOM 0 HB VAL A 982 -1.928 1.974 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A 982 -2.022 4.285 -2.780 1.00 0.00 H new ATOM 0 HG12 VAL A 982 -2.696 3.125 -3.950 1.00 0.00 H new ATOM 0 HG13 VAL A 982 -3.785 4.138 -2.972 1.00 0.00 H new ATOM 0 HG21 VAL A 982 -2.190 3.852 -0.355 1.00 0.00 H new ATOM 0 HG22 VAL A 982 -3.959 3.686 -0.459 1.00 0.00 H new ATOM 0 HG23 VAL A 982 -2.982 2.374 0.242 1.00 0.00 H new ATOM 1342 N GLY A 983 -5.107 0.697 -4.151 1.00 0.00 N ATOM 1343 CA GLY A 983 -5.163 0.186 -5.507 1.00 0.00 C ATOM 1344 C GLY A 983 -6.295 -0.805 -5.696 1.00 0.00 C ATOM 1345 O GLY A 983 -6.898 -0.875 -6.767 1.00 0.00 O ATOM 0 H GLY A 983 -6.013 0.788 -3.691 1.00 0.00 H new ATOM 0 HA2 GLY A 983 -5.289 1.016 -6.202 1.00 0.00 H new ATOM 0 HA3 GLY A 983 -4.216 -0.295 -5.752 1.00 0.00 H new ATOM 1349 N SER A 984 -6.574 -1.578 -4.651 1.00 0.00 N ATOM 1350 CA SER A 984 -7.629 -2.583 -4.694 1.00 0.00 C ATOM 1351 C SER A 984 -9.015 -1.948 -4.610 1.00 0.00 C ATOM 1352 O SER A 984 -9.234 -0.992 -3.860 1.00 0.00 O ATOM 1353 CB SER A 984 -7.450 -3.587 -3.554 1.00 0.00 C ATOM 1354 OG SER A 984 -6.201 -4.249 -3.649 1.00 0.00 O ATOM 0 H SER A 984 -6.081 -1.526 -3.760 1.00 0.00 H new ATOM 0 HA SER A 984 -7.552 -3.100 -5.650 1.00 0.00 H new ATOM 0 HB2 SER A 984 -7.520 -3.071 -2.596 1.00 0.00 H new ATOM 0 HB3 SER A 984 -8.256 -4.320 -3.581 1.00 0.00 H new ATOM 0 HG SER A 984 -5.626 -3.971 -2.905 1.00 0.00 H new ATOM 1360 N ARG A 985 -9.944 -2.492 -5.390 1.00 0.00 N ATOM 1361 CA ARG A 985 -11.318 -2.001 -5.422 1.00 0.00 C ATOM 1362 C ARG A 985 -12.247 -2.941 -4.656 1.00 0.00 C ATOM 1363 O ARG A 985 -12.001 -4.145 -4.577 1.00 0.00 O ATOM 1364 CB ARG A 985 -11.790 -1.860 -6.872 1.00 0.00 C ATOM 1365 CG ARG A 985 -13.210 -1.334 -7.006 1.00 0.00 C ATOM 1366 CD ARG A 985 -13.610 -1.179 -8.464 1.00 0.00 C ATOM 1367 NE ARG A 985 -12.729 -0.259 -9.178 1.00 0.00 N ATOM 1368 CZ ARG A 985 -12.868 0.052 -10.463 1.00 0.00 C ATOM 1369 NH1 ARG A 985 -13.854 -0.481 -11.174 1.00 0.00 N ATOM 1370 NH2 ARG A 985 -12.024 0.896 -11.038 1.00 0.00 N ATOM 0 H ARG A 985 -9.768 -3.280 -6.014 1.00 0.00 H new ATOM 0 HA ARG A 985 -11.347 -1.024 -4.941 1.00 0.00 H new ATOM 0 HB2 ARG A 985 -11.113 -1.190 -7.401 1.00 0.00 H new ATOM 0 HB3 ARG A 985 -11.724 -2.832 -7.362 1.00 0.00 H new ATOM 0 HG2 ARG A 985 -13.900 -2.015 -6.509 1.00 0.00 H new ATOM 0 HG3 ARG A 985 -13.292 -0.372 -6.501 1.00 0.00 H new ATOM 0 HD2 ARG A 985 -13.588 -2.154 -8.952 1.00 0.00 H new ATOM 0 HD3 ARG A 985 -14.636 -0.817 -8.522 1.00 0.00 H new ATOM 0 HE ARG A 985 -11.962 0.170 -8.660 1.00 0.00 H new ATOM 0 HH11 ARG A 985 -14.506 -1.130 -10.735 1.00 0.00 H new ATOM 0 HH12 ARG A 985 -13.959 -0.241 -12.160 1.00 0.00 H new ATOM 0 HH21 ARG A 985 -11.266 1.309 -10.495 1.00 0.00 H new ATOM 0 HH22 ARG A 985 -12.132 1.133 -12.024 1.00 0.00 H new ATOM 1384 N ILE A 986 -13.315 -2.384 -4.092 1.00 0.00 N ATOM 1385 CA ILE A 986 -14.285 -3.170 -3.333 1.00 0.00 C ATOM 1386 C ILE A 986 -15.706 -2.853 -3.785 1.00 0.00 C ATOM 1387 O ILE A 986 -16.059 -1.688 -3.973 1.00 0.00 O ATOM 1388 CB ILE A 986 -14.164 -2.902 -1.821 1.00 0.00 C ATOM 1389 CG1 ILE A 986 -14.437 -1.426 -1.518 1.00 0.00 C ATOM 1390 CG2 ILE A 986 -12.785 -3.308 -1.323 1.00 0.00 C ATOM 1391 CD1 ILE A 986 -14.437 -1.097 -0.041 1.00 0.00 C ATOM 0 H ILE A 986 -13.532 -1.389 -4.146 1.00 0.00 H new ATOM 0 HA ILE A 986 -14.068 -4.221 -3.522 1.00 0.00 H new ATOM 0 HB ILE A 986 -14.909 -3.502 -1.298 1.00 0.00 H new ATOM 0 HG12 ILE A 986 -13.683 -0.817 -2.017 1.00 0.00 H new ATOM 0 HG13 ILE A 986 -15.402 -1.150 -1.943 1.00 0.00 H new ATOM 0 HG21 ILE A 986 -12.713 -3.113 -0.253 1.00 0.00 H new ATOM 0 HG22 ILE A 986 -12.629 -4.370 -1.510 1.00 0.00 H new ATOM 0 HG23 ILE A 986 -12.024 -2.731 -1.849 1.00 0.00 H new ATOM 0 HD11 ILE A 986 -14.637 -0.034 0.095 1.00 0.00 H new ATOM 0 HD12 ILE A 986 -15.210 -1.679 0.461 1.00 0.00 H new ATOM 0 HD13 ILE A 986 -13.464 -1.341 0.386 1.00 0.00 H new ATOM 1403 N THR A 987 -16.520 -3.890 -3.970 1.00 0.00 N ATOM 1404 CA THR A 987 -17.898 -3.694 -4.412 1.00 0.00 C ATOM 1405 C THR A 987 -18.894 -3.858 -3.278 1.00 0.00 C ATOM 1406 O THR A 987 -18.840 -4.821 -2.517 1.00 0.00 O ATOM 1407 CB THR A 987 -18.276 -4.647 -5.553 1.00 0.00 C ATOM 1408 OG1 THR A 987 -17.820 -5.974 -5.268 1.00 0.00 O ATOM 1409 CG2 THR A 987 -17.688 -4.156 -6.863 1.00 0.00 C ATOM 0 H THR A 987 -16.253 -4.863 -3.823 1.00 0.00 H new ATOM 0 HA THR A 987 -17.947 -2.668 -4.775 1.00 0.00 H new ATOM 0 HB THR A 987 -19.362 -4.668 -5.644 1.00 0.00 H new ATOM 0 HG1 THR A 987 -17.637 -6.445 -6.108 1.00 0.00 H new ATOM 0 HG21 THR A 987 -17.963 -4.841 -7.665 1.00 0.00 H new ATOM 0 HG22 THR A 987 -18.076 -3.162 -7.086 1.00 0.00 H new ATOM 0 HG23 THR A 987 -16.602 -4.112 -6.781 1.00 0.00 H new ATOM 1417 N TYR A 988 -19.811 -2.907 -3.188 1.00 0.00 N ATOM 1418 CA TYR A 988 -20.844 -2.928 -2.158 1.00 0.00 C ATOM 1419 C TYR A 988 -22.150 -3.483 -2.715 1.00 0.00 C ATOM 1420 O TYR A 988 -22.480 -3.259 -3.879 1.00 0.00 O ATOM 1421 CB TYR A 988 -21.084 -1.523 -1.599 1.00 0.00 C ATOM 1422 CG TYR A 988 -19.879 -0.911 -0.918 1.00 0.00 C ATOM 1423 CD1 TYR A 988 -18.721 -0.624 -1.629 1.00 0.00 C ATOM 1424 CD2 TYR A 988 -19.910 -0.607 0.437 1.00 0.00 C ATOM 1425 CE1 TYR A 988 -17.625 -0.055 -1.007 1.00 0.00 C ATOM 1426 CE2 TYR A 988 -18.820 -0.036 1.066 1.00 0.00 C ATOM 1427 CZ TYR A 988 -17.680 0.237 0.339 1.00 0.00 C ATOM 1428 OH TYR A 988 -16.593 0.806 0.962 1.00 0.00 O ATOM 0 H TYR A 988 -19.863 -2.106 -3.818 1.00 0.00 H new ATOM 0 HA TYR A 988 -20.496 -3.575 -1.353 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -21.398 -0.869 -2.413 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -21.908 -1.564 -0.887 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -18.676 -0.849 -2.684 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -20.801 -0.820 1.009 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -16.730 0.160 -1.573 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -18.860 0.195 2.120 1.00 0.00 H new ATOM 0 HH TYR A 988 -16.577 1.768 0.777 1.00 0.00 H new ATOM 1438 N SER A 989 -22.893 -4.198 -1.878 1.00 0.00 N ATOM 1439 CA SER A 989 -24.167 -4.767 -2.298 1.00 0.00 C ATOM 1440 C SER A 989 -25.111 -4.925 -1.113 1.00 0.00 C ATOM 1441 O SER A 989 -24.817 -5.646 -0.159 1.00 0.00 O ATOM 1442 CB SER A 989 -23.952 -6.120 -2.977 1.00 0.00 C ATOM 1443 OG SER A 989 -25.182 -6.682 -3.399 1.00 0.00 O ATOM 0 H SER A 989 -22.637 -4.396 -0.911 1.00 0.00 H new ATOM 0 HA SER A 989 -24.621 -4.080 -3.012 1.00 0.00 H new ATOM 0 HB2 SER A 989 -23.291 -5.998 -3.835 1.00 0.00 H new ATOM 0 HB3 SER A 989 -23.455 -6.802 -2.286 1.00 0.00 H new ATOM 0 HG SER A 989 -25.016 -7.546 -3.831 1.00 0.00 H new ATOM 1449 N CYS A 990 -26.248 -4.244 -1.188 1.00 0.00 N ATOM 1450 CA CYS A 990 -27.249 -4.298 -0.132 1.00 0.00 C ATOM 1451 C CYS A 990 -28.104 -5.552 -0.259 1.00 0.00 C ATOM 1452 O CYS A 990 -28.401 -5.999 -1.367 1.00 0.00 O ATOM 1453 CB CYS A 990 -28.136 -3.053 -0.184 1.00 0.00 C ATOM 1454 SG CYS A 990 -27.219 -1.484 -0.063 1.00 0.00 S ATOM 0 H CYS A 990 -26.500 -3.645 -1.974 1.00 0.00 H new ATOM 0 HA CYS A 990 -26.732 -4.330 0.827 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -28.701 -3.061 -1.116 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -28.861 -3.102 0.629 1.00 0.00 H new ATOM 1459 N THR A 991 -28.503 -6.112 0.876 1.00 0.00 N ATOM 1460 CA THR A 991 -29.330 -7.311 0.880 1.00 0.00 C ATOM 1461 C THR A 991 -30.693 -7.018 0.266 1.00 0.00 C ATOM 1462 O THR A 991 -31.121 -5.864 0.207 1.00 0.00 O ATOM 1463 CB THR A 991 -29.528 -7.865 2.303 1.00 0.00 C ATOM 1464 OG1 THR A 991 -30.202 -9.128 2.245 1.00 0.00 O ATOM 1465 CG2 THR A 991 -30.339 -6.899 3.150 1.00 0.00 C ATOM 0 H THR A 991 -28.268 -5.756 1.803 1.00 0.00 H new ATOM 0 HA THR A 991 -28.808 -8.062 0.286 1.00 0.00 H new ATOM 0 HB THR A 991 -28.546 -7.993 2.759 1.00 0.00 H new ATOM 0 HG1 THR A 991 -30.323 -9.476 3.153 1.00 0.00 H new ATOM 0 HG21 THR A 991 -30.466 -7.311 4.151 1.00 0.00 H new ATOM 0 HG22 THR A 991 -29.817 -5.945 3.214 1.00 0.00 H new ATOM 0 HG23 THR A 991 -31.317 -6.747 2.693 1.00 0.00 H new ATOM 1473 N THR A 992 -31.364 -8.065 -0.197 1.00 0.00 N ATOM 1474 CA THR A 992 -32.675 -7.925 -0.819 1.00 0.00 C ATOM 1475 C THR A 992 -33.594 -7.023 0.002 1.00 0.00 C ATOM 1476 O THR A 992 -33.684 -7.152 1.222 1.00 0.00 O ATOM 1477 CB THR A 992 -33.349 -9.296 -1.001 1.00 0.00 C ATOM 1478 OG1 THR A 992 -34.624 -9.139 -1.635 1.00 0.00 O ATOM 1479 CG2 THR A 992 -33.525 -9.999 0.338 1.00 0.00 C ATOM 0 H THR A 992 -31.020 -9.024 -0.153 1.00 0.00 H new ATOM 0 HA THR A 992 -32.513 -7.468 -1.795 1.00 0.00 H new ATOM 0 HB THR A 992 -32.704 -9.908 -1.632 1.00 0.00 H new ATOM 0 HG1 THR A 992 -35.044 -10.017 -1.748 1.00 0.00 H new ATOM 0 HG21 THR A 992 -34.004 -10.966 0.181 1.00 0.00 H new ATOM 0 HG22 THR A 992 -32.550 -10.148 0.802 1.00 0.00 H new ATOM 0 HG23 THR A 992 -34.148 -9.387 0.991 1.00 0.00 H new ATOM 1487 N GLY A 993 -34.278 -6.110 -0.684 1.00 0.00 N ATOM 1488 CA GLY A 993 -35.187 -5.199 -0.010 1.00 0.00 C ATOM 1489 C GLY A 993 -34.730 -3.753 -0.071 1.00 0.00 C ATOM 1490 O GLY A 993 -35.503 -2.870 -0.442 1.00 0.00 O ATOM 0 H GLY A 993 -34.219 -5.985 -1.695 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -36.176 -5.281 -0.461 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -35.287 -5.499 1.033 1.00 0.00 H new ATOM 1494 N HIS A 994 -33.478 -3.507 0.303 1.00 0.00 N ATOM 1495 CA HIS A 994 -32.928 -2.158 0.297 1.00 0.00 C ATOM 1496 C HIS A 994 -32.036 -1.930 -0.920 1.00 0.00 C ATOM 1497 O HIS A 994 -31.282 -2.815 -1.326 1.00 0.00 O ATOM 1498 CB HIS A 994 -32.123 -1.915 1.575 1.00 0.00 C ATOM 1499 CG HIS A 994 -32.883 -2.211 2.831 1.00 0.00 C ATOM 1500 ND1 HIS A 994 -33.437 -3.445 3.103 1.00 0.00 N ATOM 1501 CD2 HIS A 994 -33.174 -1.429 3.897 1.00 0.00 C ATOM 1502 CE1 HIS A 994 -34.035 -3.409 4.279 1.00 0.00 C ATOM 1503 NE2 HIS A 994 -33.890 -2.197 4.783 1.00 0.00 N ATOM 0 H HIS A 994 -32.825 -4.226 0.614 1.00 0.00 H new ATOM 0 HA HIS A 994 -33.761 -1.456 0.249 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -31.225 -2.532 1.551 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -31.796 -0.876 1.595 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -32.895 -0.394 4.027 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -34.555 -4.231 4.749 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -34.251 -1.882 5.684 1.00 0.00 H new ATOM 1512 N ARG A 995 -32.121 -0.732 -1.488 1.00 0.00 N ATOM 1513 CA ARG A 995 -31.318 -0.370 -2.650 1.00 0.00 C ATOM 1514 C ARG A 995 -30.030 0.319 -2.211 1.00 0.00 C ATOM 1515 O ARG A 995 -30.012 1.029 -1.208 1.00 0.00 O ATOM 1516 CB ARG A 995 -32.107 0.554 -3.578 1.00 0.00 C ATOM 1517 CG ARG A 995 -32.629 1.802 -2.884 1.00 0.00 C ATOM 1518 CD ARG A 995 -33.234 2.800 -3.865 1.00 0.00 C ATOM 1519 NE ARG A 995 -34.328 2.229 -4.653 1.00 0.00 N ATOM 1520 CZ ARG A 995 -34.151 1.516 -5.765 1.00 0.00 C ATOM 1521 NH1 ARG A 995 -32.934 1.332 -6.256 1.00 0.00 N ATOM 1522 NH2 ARG A 995 -35.199 1.004 -6.397 1.00 0.00 N ATOM 0 H ARG A 995 -32.741 0.008 -1.160 1.00 0.00 H new ATOM 0 HA ARG A 995 -31.067 -1.283 -3.190 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -31.470 0.850 -4.412 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -32.948 0.003 -3.999 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -33.381 1.518 -2.148 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -31.815 2.280 -2.339 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -33.602 3.666 -3.315 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -32.455 3.158 -4.539 1.00 0.00 H new ATOM 0 HE ARG A 995 -35.283 2.386 -4.332 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -32.126 1.737 -5.783 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -32.805 0.785 -7.107 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -36.139 1.156 -6.032 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -35.065 0.458 -7.248 1.00 0.00 H new ATOM 1536 N LEU A 996 -28.957 0.099 -2.962 1.00 0.00 N ATOM 1537 CA LEU A 996 -27.665 0.699 -2.646 1.00 0.00 C ATOM 1538 C LEU A 996 -27.695 2.210 -2.886 1.00 0.00 C ATOM 1539 O LEU A 996 -28.115 2.670 -3.947 1.00 0.00 O ATOM 1540 CB LEU A 996 -26.569 0.034 -3.485 1.00 0.00 C ATOM 1541 CG LEU A 996 -25.140 0.477 -3.184 1.00 0.00 C ATOM 1542 CD1 LEU A 996 -24.166 -0.670 -3.408 1.00 0.00 C ATOM 1543 CD2 LEU A 996 -24.774 1.665 -4.045 1.00 0.00 C ATOM 0 H LEU A 996 -28.956 -0.491 -3.794 1.00 0.00 H new ATOM 0 HA LEU A 996 -27.448 0.536 -1.590 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -26.632 -1.045 -3.342 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -26.775 0.228 -4.537 1.00 0.00 H new ATOM 0 HG LEU A 996 -25.078 0.773 -2.137 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -23.152 -0.335 -3.188 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -24.424 -1.500 -2.751 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -24.223 -0.998 -4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -23.753 1.974 -3.823 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -24.849 1.389 -5.097 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -25.456 2.489 -3.836 1.00 0.00 H new ATOM 1555 N ILE A 997 -27.250 2.975 -1.889 1.00 0.00 N ATOM 1556 CA ILE A 997 -27.229 4.434 -1.988 1.00 0.00 C ATOM 1557 C ILE A 997 -25.844 4.950 -2.373 1.00 0.00 C ATOM 1558 O ILE A 997 -24.826 4.425 -1.922 1.00 0.00 O ATOM 1559 CB ILE A 997 -27.671 5.106 -0.664 1.00 0.00 C ATOM 1560 CG1 ILE A 997 -29.185 5.031 -0.492 1.00 0.00 C ATOM 1561 CG2 ILE A 997 -27.222 6.552 -0.606 1.00 0.00 C ATOM 1562 CD1 ILE A 997 -29.685 3.651 -0.173 1.00 0.00 C ATOM 0 H ILE A 997 -26.899 2.609 -1.004 1.00 0.00 H new ATOM 0 HA ILE A 997 -27.939 4.698 -2.772 1.00 0.00 H new ATOM 0 HB ILE A 997 -27.195 4.560 0.151 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -29.486 5.711 0.305 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -29.664 5.380 -1.407 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -27.547 6.996 0.335 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -26.135 6.598 -0.673 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -27.661 7.103 -1.438 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -30.769 3.673 -0.064 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -29.415 2.970 -0.980 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -29.234 3.307 0.758 1.00 0.00 H new ATOM 1574 N GLY A 998 -25.822 5.991 -3.204 1.00 0.00 N ATOM 1575 CA GLY A 998 -24.566 6.578 -3.636 1.00 0.00 C ATOM 1576 C GLY A 998 -24.007 5.925 -4.885 1.00 0.00 C ATOM 1577 O GLY A 998 -24.729 5.710 -5.859 1.00 0.00 O ATOM 0 H GLY A 998 -26.655 6.438 -3.586 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -24.714 7.642 -3.823 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -23.836 6.494 -2.831 1.00 0.00 H new ATOM 1581 N HIS A 999 -22.715 5.618 -4.857 1.00 0.00 N ATOM 1582 CA HIS A 999 -22.047 4.994 -5.992 1.00 0.00 C ATOM 1583 C HIS A 999 -22.356 3.500 -6.040 1.00 0.00 C ATOM 1584 O HIS A 999 -23.520 3.114 -6.115 1.00 0.00 O ATOM 1585 CB HIS A 999 -20.541 5.233 -5.900 1.00 0.00 C ATOM 1586 CG HIS A 999 -20.178 6.682 -5.849 1.00 0.00 C ATOM 1587 ND1 HIS A 999 -20.360 7.545 -6.910 1.00 0.00 N ATOM 1588 CD2 HIS A 999 -19.657 7.427 -4.847 1.00 0.00 C ATOM 1589 CE1 HIS A 999 -19.964 8.757 -6.562 1.00 0.00 C ATOM 1590 NE2 HIS A 999 -19.535 8.712 -5.315 1.00 0.00 N ATOM 0 H HIS A 999 -22.107 5.792 -4.057 1.00 0.00 H new ATOM 0 HA HIS A 999 -22.418 5.444 -6.913 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -20.154 4.736 -5.010 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -20.053 4.773 -6.759 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -19.387 7.076 -3.862 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -19.988 9.635 -7.191 1.00 0.00 H new ATOM 0 HE2 HIS A 999 -19.172 9.504 -4.785 1.00 0.00 H new ATOM 1599 N SER A1000 -21.319 2.664 -5.996 1.00 0.00 N ATOM 1600 CA SER A1000 -21.508 1.216 -6.034 1.00 0.00 C ATOM 1601 C SER A1000 -20.242 0.483 -5.598 1.00 0.00 C ATOM 1602 O SER A1000 -20.314 -0.543 -4.922 1.00 0.00 O ATOM 1603 CB SER A1000 -21.912 0.758 -7.437 1.00 0.00 C ATOM 1604 OG SER A1000 -23.052 1.457 -7.903 1.00 0.00 O ATOM 0 H SER A1000 -20.346 2.963 -5.934 1.00 0.00 H new ATOM 0 HA SER A1000 -22.309 0.972 -5.336 1.00 0.00 H new ATOM 0 HB2 SER A1000 -21.081 0.915 -8.125 1.00 0.00 H new ATOM 0 HB3 SER A1000 -22.119 -0.312 -7.426 1.00 0.00 H new ATOM 0 HG SER A1000 -23.624 1.693 -7.143 1.00 0.00 H new ATOM 1610 N SER A1001 -19.082 1.009 -5.989 1.00 0.00 N ATOM 1611 CA SER A1001 -17.808 0.391 -5.633 1.00 0.00 C ATOM 1612 C SER A1001 -16.676 1.415 -5.635 1.00 0.00 C ATOM 1613 O SER A1001 -16.361 2.009 -6.666 1.00 0.00 O ATOM 1614 CB SER A1001 -17.481 -0.740 -6.610 1.00 0.00 C ATOM 1615 OG SER A1001 -17.386 -0.256 -7.938 1.00 0.00 O ATOM 0 H SER A1001 -18.999 1.857 -6.549 1.00 0.00 H new ATOM 0 HA SER A1001 -17.902 -0.014 -4.625 1.00 0.00 H new ATOM 0 HB2 SER A1001 -16.541 -1.212 -6.324 1.00 0.00 H new ATOM 0 HB3 SER A1001 -18.253 -1.508 -6.554 1.00 0.00 H new ATOM 0 HG SER A1001 -16.972 0.632 -7.934 1.00 0.00 H new ATOM 1621 N ALA A1002 -16.068 1.611 -4.468 1.00 0.00 N ATOM 1622 CA ALA A1002 -14.966 2.557 -4.321 1.00 0.00 C ATOM 1623 C ALA A1002 -13.616 1.882 -4.548 1.00 0.00 C ATOM 1624 O ALA A1002 -13.545 0.679 -4.795 1.00 0.00 O ATOM 1625 CB ALA A1002 -15.008 3.206 -2.947 1.00 0.00 C ATOM 0 H ALA A1002 -16.321 1.125 -3.608 1.00 0.00 H new ATOM 0 HA ALA A1002 -15.085 3.328 -5.082 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -14.181 3.909 -2.851 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -15.952 3.737 -2.824 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -14.922 2.437 -2.179 1.00 0.00 H new ATOM 1631 N GLU A1003 -12.546 2.666 -4.447 1.00 0.00 N ATOM 1632 CA GLU A1003 -11.191 2.151 -4.627 1.00 0.00 C ATOM 1633 C GLU A1003 -10.222 2.877 -3.704 1.00 0.00 C ATOM 1634 O GLU A1003 -10.224 4.105 -3.638 1.00 0.00 O ATOM 1635 CB GLU A1003 -10.738 2.325 -6.078 1.00 0.00 C ATOM 1636 CG GLU A1003 -9.419 1.635 -6.389 1.00 0.00 C ATOM 1637 CD GLU A1003 -8.988 1.822 -7.832 1.00 0.00 C ATOM 1638 OE1 GLU A1003 -9.720 2.491 -8.590 1.00 0.00 O ATOM 1639 OE2 GLU A1003 -7.917 1.297 -8.203 1.00 0.00 O ATOM 0 H GLU A1003 -12.591 3.664 -4.241 1.00 0.00 H new ATOM 0 HA GLU A1003 -11.197 1.089 -4.381 1.00 0.00 H new ATOM 0 HB2 GLU A1003 -11.509 1.932 -6.741 1.00 0.00 H new ATOM 0 HB3 GLU A1003 -10.642 3.389 -6.295 1.00 0.00 H new ATOM 0 HG2 GLU A1003 -8.645 2.026 -5.729 1.00 0.00 H new ATOM 0 HG3 GLU A1003 -9.512 0.570 -6.177 1.00 0.00 H new ATOM 1646 N CYS A1004 -9.386 2.122 -2.998 1.00 0.00 N ATOM 1647 CA CYS A1004 -8.415 2.727 -2.094 1.00 0.00 C ATOM 1648 C CYS A1004 -7.319 3.420 -2.893 1.00 0.00 C ATOM 1649 O CYS A1004 -6.652 2.795 -3.717 1.00 0.00 O ATOM 1650 CB CYS A1004 -7.808 1.667 -1.173 1.00 0.00 C ATOM 1651 SG CYS A1004 -6.505 2.293 -0.060 1.00 0.00 S ATOM 0 H CYS A1004 -9.361 1.103 -3.033 1.00 0.00 H new ATOM 0 HA CYS A1004 -8.926 3.468 -1.479 1.00 0.00 H new ATOM 0 HB2 CYS A1004 -8.603 1.228 -0.571 1.00 0.00 H new ATOM 0 HB3 CYS A1004 -7.393 0.866 -1.785 1.00 0.00 H new ATOM 1656 N ILE A1005 -7.145 4.714 -2.656 1.00 0.00 N ATOM 1657 CA ILE A1005 -6.135 5.483 -3.370 1.00 0.00 C ATOM 1658 C ILE A1005 -5.397 6.440 -2.451 1.00 0.00 C ATOM 1659 O ILE A1005 -5.958 6.954 -1.482 1.00 0.00 O ATOM 1660 CB ILE A1005 -6.745 6.286 -4.529 1.00 0.00 C ATOM 1661 CG1 ILE A1005 -7.897 7.154 -4.022 1.00 0.00 C ATOM 1662 CG2 ILE A1005 -7.205 5.346 -5.630 1.00 0.00 C ATOM 1663 CD1 ILE A1005 -8.473 8.076 -5.074 1.00 0.00 C ATOM 0 H ILE A1005 -7.687 5.250 -1.979 1.00 0.00 H new ATOM 0 HA ILE A1005 -5.430 4.754 -3.768 1.00 0.00 H new ATOM 0 HB ILE A1005 -5.985 6.947 -4.945 1.00 0.00 H new ATOM 0 HG12 ILE A1005 -8.689 6.507 -3.646 1.00 0.00 H new ATOM 0 HG13 ILE A1005 -7.547 7.752 -3.180 1.00 0.00 H new ATOM 0 HG21 ILE A1005 -7.636 5.925 -6.447 1.00 0.00 H new ATOM 0 HG22 ILE A1005 -6.354 4.775 -6.000 1.00 0.00 H new ATOM 0 HG23 ILE A1005 -7.956 4.662 -5.234 1.00 0.00 H new ATOM 0 HD11 ILE A1005 -9.285 8.660 -4.641 1.00 0.00 H new ATOM 0 HD12 ILE A1005 -7.695 8.749 -5.434 1.00 0.00 H new ATOM 0 HD13 ILE A1005 -8.855 7.485 -5.906 1.00 0.00 H new ATOM 1675 N LEU A1006 -4.133 6.671 -2.768 1.00 0.00 N ATOM 1676 CA LEU A1006 -3.297 7.568 -1.982 1.00 0.00 C ATOM 1677 C LEU A1006 -3.426 9.003 -2.491 1.00 0.00 C ATOM 1678 O LEU A1006 -3.300 9.259 -3.688 1.00 0.00 O ATOM 1679 CB LEU A1006 -1.838 7.115 -2.050 1.00 0.00 C ATOM 1680 CG LEU A1006 -1.000 7.403 -0.800 1.00 0.00 C ATOM 1681 CD1 LEU A1006 0.436 6.954 -1.012 1.00 0.00 C ATOM 1682 CD2 LEU A1006 -1.052 8.877 -0.432 1.00 0.00 C ATOM 0 H LEU A1006 -3.661 6.248 -3.567 1.00 0.00 H new ATOM 0 HA LEU A1006 -3.631 7.537 -0.945 1.00 0.00 H new ATOM 0 HB2 LEU A1006 -1.817 6.042 -2.241 1.00 0.00 H new ATOM 0 HB3 LEU A1006 -1.364 7.600 -2.904 1.00 0.00 H new ATOM 0 HG LEU A1006 -1.423 6.837 0.030 1.00 0.00 H new ATOM 0 HD11 LEU A1006 1.019 7.165 -0.116 1.00 0.00 H new ATOM 0 HD12 LEU A1006 0.456 5.883 -1.214 1.00 0.00 H new ATOM 0 HD13 LEU A1006 0.864 7.491 -1.858 1.00 0.00 H new ATOM 0 HD21 LEU A1006 -0.448 9.051 0.459 1.00 0.00 H new ATOM 0 HD22 LEU A1006 -0.661 9.472 -1.257 1.00 0.00 H new ATOM 0 HD23 LEU A1006 -2.084 9.166 -0.233 1.00 0.00 H new ATOM 1694 N SER A1007 -3.679 9.935 -1.576 1.00 0.00 N ATOM 1695 CA SER A1007 -3.823 11.343 -1.936 1.00 0.00 C ATOM 1696 C SER A1007 -2.480 12.065 -1.881 1.00 0.00 C ATOM 1697 O SER A1007 -2.139 12.834 -2.780 1.00 0.00 O ATOM 1698 CB SER A1007 -4.821 12.029 -1.002 1.00 0.00 C ATOM 1699 OG SER A1007 -4.974 13.398 -1.335 1.00 0.00 O ATOM 0 H SER A1007 -3.788 9.741 -0.581 1.00 0.00 H new ATOM 0 HA SER A1007 -4.197 11.391 -2.959 1.00 0.00 H new ATOM 0 HB2 SER A1007 -5.786 11.526 -1.064 1.00 0.00 H new ATOM 0 HB3 SER A1007 -4.480 11.938 0.029 1.00 0.00 H new ATOM 0 HG SER A1007 -5.618 13.813 -0.724 1.00 0.00 H new ATOM 1705 N GLY A1008 -1.728 11.814 -0.816 1.00 0.00 N ATOM 1706 CA GLY A1008 -0.431 12.446 -0.648 1.00 0.00 C ATOM 1707 C GLY A1008 0.316 11.898 0.550 1.00 0.00 C ATOM 1708 O GLY A1008 1.545 11.821 0.547 1.00 0.00 O ATOM 0 H GLY A1008 -1.994 11.181 -0.062 1.00 0.00 H new ATOM 0 HA2 GLY A1008 0.165 12.294 -1.548 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -0.564 13.522 -0.531 1.00 0.00 H new ATOM 1712 N ASN A1009 -0.435 11.513 1.576 1.00 0.00 N ATOM 1713 CA ASN A1009 0.145 10.962 2.795 1.00 0.00 C ATOM 1714 C ASN A1009 -0.828 9.991 3.440 1.00 0.00 C ATOM 1715 O ASN A1009 -0.468 8.869 3.796 1.00 0.00 O ATOM 1716 CB ASN A1009 0.462 12.079 3.787 1.00 0.00 C ATOM 1717 CG ASN A1009 1.245 11.586 4.988 1.00 0.00 C ATOM 1718 OD1 ASN A1009 0.780 10.731 5.739 1.00 0.00 O ATOM 1719 ND2 ASN A1009 2.445 12.125 5.173 1.00 0.00 N ATOM 0 H ASN A1009 -1.453 11.573 1.587 1.00 0.00 H new ATOM 0 HA ASN A1009 1.066 10.442 2.531 1.00 0.00 H new ATOM 0 HB2 ASN A1009 1.032 12.858 3.281 1.00 0.00 H new ATOM 0 HB3 ASN A1009 -0.469 12.534 4.126 1.00 0.00 H new ATOM 0 HD21 ASN A1009 3.019 11.832 5.963 1.00 0.00 H new ATOM 0 HD22 ASN A1009 2.792 12.832 4.525 1.00 0.00 H new ATOM 1726 N THR A1010 -2.065 10.443 3.587 1.00 0.00 N ATOM 1727 CA THR A1010 -3.108 9.636 4.190 1.00 0.00 C ATOM 1728 C THR A1010 -3.910 8.902 3.122 1.00 0.00 C ATOM 1729 O THR A1010 -4.317 9.493 2.121 1.00 0.00 O ATOM 1730 CB THR A1010 -4.056 10.505 5.031 1.00 0.00 C ATOM 1731 OG1 THR A1010 -3.301 11.306 5.949 1.00 0.00 O ATOM 1732 CG2 THR A1010 -5.029 9.639 5.801 1.00 0.00 C ATOM 0 H THR A1010 -2.369 11.371 3.294 1.00 0.00 H new ATOM 0 HA THR A1010 -2.625 8.906 4.839 1.00 0.00 H new ATOM 0 HB THR A1010 -4.616 11.153 4.357 1.00 0.00 H new ATOM 0 HG1 THR A1010 -3.912 11.858 6.480 1.00 0.00 H new ATOM 0 HG21 THR A1010 -5.692 10.272 6.391 1.00 0.00 H new ATOM 0 HG22 THR A1010 -5.620 9.046 5.103 1.00 0.00 H new ATOM 0 HG23 THR A1010 -4.477 8.974 6.465 1.00 0.00 H new ATOM 1740 N ALA A1011 -4.132 7.610 3.338 1.00 0.00 N ATOM 1741 CA ALA A1011 -4.885 6.796 2.391 1.00 0.00 C ATOM 1742 C ALA A1011 -6.386 6.963 2.591 1.00 0.00 C ATOM 1743 O ALA A1011 -6.869 7.023 3.723 1.00 0.00 O ATOM 1744 CB ALA A1011 -4.494 5.332 2.529 1.00 0.00 C ATOM 0 H ALA A1011 -3.802 7.104 4.160 1.00 0.00 H new ATOM 0 HA ALA A1011 -4.640 7.136 1.385 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -5.063 4.735 1.817 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -3.429 5.219 2.328 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -4.710 4.992 3.542 1.00 0.00 H new ATOM 1750 N HIS A1012 -7.121 7.038 1.487 1.00 0.00 N ATOM 1751 CA HIS A1012 -8.570 7.196 1.541 1.00 0.00 C ATOM 1752 C HIS A1012 -9.214 6.715 0.245 1.00 0.00 C ATOM 1753 O HIS A1012 -8.647 6.870 -0.837 1.00 0.00 O ATOM 1754 CB HIS A1012 -8.941 8.659 1.805 1.00 0.00 C ATOM 1755 CG HIS A1012 -8.578 9.590 0.688 1.00 0.00 C ATOM 1756 ND1 HIS A1012 -9.119 9.495 -0.578 1.00 0.00 N ATOM 1757 CD2 HIS A1012 -7.727 10.643 0.652 1.00 0.00 C ATOM 1758 CE1 HIS A1012 -8.617 10.448 -1.342 1.00 0.00 C ATOM 1759 NE2 HIS A1012 -7.771 11.158 -0.620 1.00 0.00 N ATOM 0 H HIS A1012 -6.737 6.992 0.543 1.00 0.00 H new ATOM 0 HA HIS A1012 -8.948 6.586 2.362 1.00 0.00 H new ATOM 0 HB2 HIS A1012 -10.014 8.724 1.985 1.00 0.00 H new ATOM 0 HB3 HIS A1012 -8.444 8.990 2.717 1.00 0.00 H new ATOM 0 HD1 HIS A1012 -9.800 8.797 -0.877 1.00 0.00 H new ATOM 0 HD2 HIS A1012 -7.126 11.009 1.471 1.00 0.00 H new ATOM 0 HE1 HIS A1012 -8.858 10.617 -2.381 1.00 0.00 H new ATOM 1768 N TRP A1013 -10.399 6.123 0.361 1.00 0.00 N ATOM 1769 CA TRP A1013 -11.113 5.618 -0.801 1.00 0.00 C ATOM 1770 C TRP A1013 -11.589 6.768 -1.679 1.00 0.00 C ATOM 1771 O TRP A1013 -12.058 7.793 -1.183 1.00 0.00 O ATOM 1772 CB TRP A1013 -12.295 4.747 -0.373 1.00 0.00 C ATOM 1773 CG TRP A1013 -11.892 3.598 0.500 1.00 0.00 C ATOM 1774 CD1 TRP A1013 -11.633 3.638 1.839 1.00 0.00 C ATOM 1775 CD2 TRP A1013 -11.672 2.243 0.089 1.00 0.00 C ATOM 1776 NE1 TRP A1013 -11.282 2.389 2.289 1.00 0.00 N ATOM 1777 CE2 TRP A1013 -11.295 1.516 1.234 1.00 0.00 C ATOM 1778 CE3 TRP A1013 -11.762 1.573 -1.134 1.00 0.00 C ATOM 1779 CZ2 TRP A1013 -11.009 0.154 1.192 1.00 0.00 C ATOM 1780 CZ3 TRP A1013 -11.475 0.222 -1.176 1.00 0.00 C ATOM 1781 CH2 TRP A1013 -11.103 -0.475 -0.020 1.00 0.00 C ATOM 0 H TRP A1013 -10.882 5.983 1.248 1.00 0.00 H new ATOM 0 HA TRP A1013 -10.426 5.002 -1.382 1.00 0.00 H new ATOM 0 HB2 TRP A1013 -13.019 5.364 0.159 1.00 0.00 H new ATOM 0 HB3 TRP A1013 -12.796 4.362 -1.261 1.00 0.00 H new ATOM 0 HD1 TRP A1013 -11.695 4.523 2.455 1.00 0.00 H new ATOM 0 HE1 TRP A1013 -11.049 2.150 3.253 1.00 0.00 H new ATOM 0 HE3 TRP A1013 -12.051 2.102 -2.030 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 -10.724 -0.386 2.083 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 -11.539 -0.305 -2.116 1.00 0.00 H new ATOM 0 HH2 TRP A1013 -10.886 -1.531 -0.086 1.00 0.00 H new ATOM 1792 N SER A1014 -11.450 6.588 -2.985 1.00 0.00 N ATOM 1793 CA SER A1014 -11.847 7.599 -3.954 1.00 0.00 C ATOM 1794 C SER A1014 -13.288 8.049 -3.740 1.00 0.00 C ATOM 1795 O SER A1014 -13.647 9.179 -4.070 1.00 0.00 O ATOM 1796 CB SER A1014 -11.679 7.054 -5.370 1.00 0.00 C ATOM 1797 OG SER A1014 -12.526 5.940 -5.593 1.00 0.00 O ATOM 0 H SER A1014 -11.061 5.742 -3.401 1.00 0.00 H new ATOM 0 HA SER A1014 -11.202 8.467 -3.815 1.00 0.00 H new ATOM 0 HB2 SER A1014 -11.905 7.837 -6.093 1.00 0.00 H new ATOM 0 HB3 SER A1014 -10.641 6.763 -5.530 1.00 0.00 H new ATOM 0 HG SER A1014 -12.400 5.611 -6.508 1.00 0.00 H new ATOM 1803 N THR A1015 -14.115 7.160 -3.200 1.00 0.00 N ATOM 1804 CA THR A1015 -15.519 7.479 -2.963 1.00 0.00 C ATOM 1805 C THR A1015 -16.016 6.886 -1.651 1.00 0.00 C ATOM 1806 O THR A1015 -15.645 5.772 -1.280 1.00 0.00 O ATOM 1807 CB THR A1015 -16.411 6.963 -4.105 1.00 0.00 C ATOM 1808 OG1 THR A1015 -16.388 5.532 -4.138 1.00 0.00 O ATOM 1809 CG2 THR A1015 -15.949 7.505 -5.447 1.00 0.00 C ATOM 0 H THR A1015 -13.840 6.219 -2.920 1.00 0.00 H new ATOM 0 HA THR A1015 -15.584 8.566 -2.913 1.00 0.00 H new ATOM 0 HB THR A1015 -17.428 7.310 -3.920 1.00 0.00 H new ATOM 0 HG1 THR A1015 -16.960 5.212 -4.867 1.00 0.00 H new ATOM 0 HG21 THR A1015 -16.597 7.124 -6.236 1.00 0.00 H new ATOM 0 HG22 THR A1015 -15.994 8.594 -5.435 1.00 0.00 H new ATOM 0 HG23 THR A1015 -14.924 7.186 -5.635 1.00 0.00 H new ATOM 1817 N LYS A1016 -16.867 7.638 -0.959 1.00 0.00 N ATOM 1818 CA LYS A1016 -17.432 7.191 0.308 1.00 0.00 C ATOM 1819 C LYS A1016 -18.152 5.857 0.138 1.00 0.00 C ATOM 1820 O LYS A1016 -18.614 5.528 -0.954 1.00 0.00 O ATOM 1821 CB LYS A1016 -18.394 8.240 0.863 1.00 0.00 C ATOM 1822 CG LYS A1016 -17.727 9.567 1.181 1.00 0.00 C ATOM 1823 CD LYS A1016 -18.704 10.545 1.808 1.00 0.00 C ATOM 1824 CE LYS A1016 -19.815 10.923 0.841 1.00 0.00 C ATOM 1825 NZ LYS A1016 -19.283 11.579 -0.386 1.00 0.00 N ATOM 0 H LYS A1016 -17.180 8.562 -1.256 1.00 0.00 H new ATOM 0 HA LYS A1016 -16.614 7.055 1.015 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -19.192 8.408 0.140 1.00 0.00 H new ATOM 0 HB3 LYS A1016 -18.860 7.851 1.768 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -16.890 9.401 1.860 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -17.316 9.997 0.268 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -19.137 10.103 2.706 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -18.171 11.443 2.120 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -20.373 10.029 0.562 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -20.516 11.595 1.337 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -20.063 12.031 -0.904 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -18.582 12.300 -0.118 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -18.831 10.866 -0.993 1.00 0.00 H new ATOM 1839 N PRO A1017 -18.252 5.066 1.219 1.00 0.00 N ATOM 1840 CA PRO A1017 -18.915 3.760 1.175 1.00 0.00 C ATOM 1841 C PRO A1017 -20.426 3.875 0.983 1.00 0.00 C ATOM 1842 O PRO A1017 -21.116 4.506 1.785 1.00 0.00 O ATOM 1843 CB PRO A1017 -18.592 3.148 2.540 1.00 0.00 C ATOM 1844 CG PRO A1017 -18.331 4.312 3.432 1.00 0.00 C ATOM 1845 CD PRO A1017 -17.730 5.381 2.562 1.00 0.00 C ATOM 0 HA PRO A1017 -18.570 3.160 0.332 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -19.422 2.546 2.909 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -17.723 2.492 2.483 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -19.253 4.661 3.896 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -17.651 4.039 4.239 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -18.030 6.378 2.886 1.00 0.00 H new ATOM 0 HD3 PRO A1017 -16.641 5.353 2.586 1.00 0.00 H new ATOM 1853 N PRO A1018 -20.961 3.257 -0.087 1.00 0.00 N ATOM 1854 CA PRO A1018 -22.400 3.282 -0.383 1.00 0.00 C ATOM 1855 C PRO A1018 -23.239 2.796 0.793 1.00 0.00 C ATOM 1856 O PRO A1018 -22.797 1.954 1.574 1.00 0.00 O ATOM 1857 CB PRO A1018 -22.539 2.324 -1.569 1.00 0.00 C ATOM 1858 CG PRO A1018 -21.195 2.312 -2.208 1.00 0.00 C ATOM 1859 CD PRO A1018 -20.207 2.485 -1.090 1.00 0.00 C ATOM 0 HA PRO A1018 -22.755 4.291 -0.591 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -22.829 1.326 -1.240 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -23.305 2.665 -2.265 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -21.023 1.376 -2.740 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -21.103 3.115 -2.939 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -19.876 1.525 -0.693 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -19.315 3.018 -1.420 1.00 0.00 H new ATOM 1867 N ILE A1019 -24.447 3.336 0.921 1.00 0.00 N ATOM 1868 CA ILE A1019 -25.337 2.955 2.013 1.00 0.00 C ATOM 1869 C ILE A1019 -26.351 1.908 1.555 1.00 0.00 C ATOM 1870 O ILE A1019 -26.151 1.225 0.552 1.00 0.00 O ATOM 1871 CB ILE A1019 -26.116 4.174 2.556 1.00 0.00 C ATOM 1872 CG1 ILE A1019 -25.331 5.469 2.343 1.00 0.00 C ATOM 1873 CG2 ILE A1019 -26.420 3.990 4.037 1.00 0.00 C ATOM 1874 CD1 ILE A1019 -26.120 6.707 2.710 1.00 0.00 C ATOM 0 H ILE A1019 -24.831 4.035 0.286 1.00 0.00 H new ATOM 0 HA ILE A1019 -24.706 2.543 2.801 1.00 0.00 H new ATOM 0 HB ILE A1019 -27.053 4.246 2.004 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -24.419 5.436 2.939 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -25.027 5.535 1.298 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -26.969 4.856 4.406 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -27.022 3.092 4.176 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -25.486 3.890 4.590 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -25.509 7.593 2.537 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -27.019 6.761 2.096 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -26.401 6.661 3.762 1.00 0.00 H new ATOM 1886 N CYS A1020 -27.445 1.813 2.300 1.00 0.00 N ATOM 1887 CA CYS A1020 -28.525 0.881 2.006 1.00 0.00 C ATOM 1888 C CYS A1020 -29.826 1.436 2.569 1.00 0.00 C ATOM 1889 O CYS A1020 -29.860 1.923 3.698 1.00 0.00 O ATOM 1890 CB CYS A1020 -28.237 -0.495 2.613 1.00 0.00 C ATOM 1891 SG CYS A1020 -26.778 -1.331 1.912 1.00 0.00 S ATOM 0 H CYS A1020 -27.608 2.384 3.130 1.00 0.00 H new ATOM 0 HA CYS A1020 -28.609 0.763 0.926 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -28.096 -0.383 3.688 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -29.110 -1.132 2.471 1.00 0.00 H new ATOM 1896 N GLN A1021 -30.891 1.384 1.779 1.00 0.00 N ATOM 1897 CA GLN A1021 -32.174 1.913 2.221 1.00 0.00 C ATOM 1898 C GLN A1021 -33.330 1.188 1.550 1.00 0.00 C ATOM 1899 O GLN A1021 -33.296 0.929 0.349 1.00 0.00 O ATOM 1900 CB GLN A1021 -32.251 3.407 1.905 1.00 0.00 C ATOM 1901 CG GLN A1021 -32.822 4.245 3.033 1.00 0.00 C ATOM 1902 CD GLN A1021 -32.873 5.728 2.707 1.00 0.00 C ATOM 1903 OE1 GLN A1021 -33.360 6.531 3.502 1.00 0.00 O ATOM 1904 NE2 GLN A1021 -32.362 6.104 1.537 1.00 0.00 N ATOM 0 H GLN A1021 -30.893 0.986 0.840 1.00 0.00 H new ATOM 0 HA GLN A1021 -32.254 1.758 3.297 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -31.251 3.770 1.666 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -32.863 3.549 1.014 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -33.828 3.895 3.264 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -32.219 4.097 3.929 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -31.967 5.407 0.905 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -32.365 7.089 1.272 1.00 0.00 H new ATOM 1913 N ARG A1022 -34.354 0.867 2.333 1.00 0.00 N ATOM 1914 CA ARG A1022 -35.526 0.176 1.813 1.00 0.00 C ATOM 1915 C ARG A1022 -36.027 0.835 0.546 1.00 0.00 C ATOM 1916 O ARG A1022 -36.151 2.058 0.465 1.00 0.00 O ATOM 1917 CB ARG A1022 -36.640 0.143 2.859 1.00 0.00 C ATOM 1918 CG ARG A1022 -37.950 -0.414 2.326 1.00 0.00 C ATOM 1919 CD ARG A1022 -38.997 -0.522 3.420 1.00 0.00 C ATOM 1920 NE ARG A1022 -38.560 -1.387 4.512 1.00 0.00 N ATOM 1921 CZ ARG A1022 -39.290 -1.633 5.596 1.00 0.00 C ATOM 1922 NH1 ARG A1022 -40.488 -1.081 5.733 1.00 0.00 N ATOM 1923 NH2 ARG A1022 -38.821 -2.432 6.545 1.00 0.00 N ATOM 0 H ARG A1022 -34.395 1.075 3.331 1.00 0.00 H new ATOM 0 HA ARG A1022 -35.232 -0.847 1.578 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -36.315 -0.460 3.707 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -36.808 1.153 3.232 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -38.322 0.229 1.528 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -37.777 -1.397 1.889 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -39.217 0.472 3.810 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -39.924 -0.911 2.998 1.00 0.00 H new ATOM 0 HE ARG A1022 -37.643 -1.828 4.439 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -40.852 -0.466 5.006 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -41.045 -1.272 6.566 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -37.900 -2.858 6.444 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -39.381 -2.620 7.376 1.00 0.00 H new ATOM 1937 N ILE A1023 -36.306 0.006 -0.445 1.00 0.00 N ATOM 1938 CA ILE A1023 -36.787 0.482 -1.723 1.00 0.00 C ATOM 1939 C ILE A1023 -38.248 0.912 -1.631 1.00 0.00 C ATOM 1940 O ILE A1023 -39.094 0.169 -1.133 1.00 0.00 O ATOM 1941 CB ILE A1023 -36.638 -0.602 -2.799 1.00 0.00 C ATOM 1942 CG1 ILE A1023 -35.175 -1.036 -2.915 1.00 0.00 C ATOM 1943 CG2 ILE A1023 -37.151 -0.086 -4.126 1.00 0.00 C ATOM 1944 CD1 ILE A1023 -34.940 -2.110 -3.953 1.00 0.00 C ATOM 0 H ILE A1023 -36.205 -1.007 -0.384 1.00 0.00 H new ATOM 0 HA ILE A1023 -36.182 1.345 -2.001 1.00 0.00 H new ATOM 0 HB ILE A1023 -37.230 -1.471 -2.513 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -34.566 -0.166 -3.161 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -34.835 -1.400 -1.945 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -37.042 -0.861 -4.885 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -38.203 0.182 -4.030 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -36.578 0.793 -4.421 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -33.881 -2.366 -3.978 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -35.522 -2.996 -3.698 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -35.248 -1.743 -4.932 1.00 0.00 H new ATOM 1956 N PRO A1024 -38.563 2.127 -2.112 1.00 0.00 N ATOM 1957 CA PRO A1024 -39.927 2.663 -2.083 1.00 0.00 C ATOM 1958 C PRO A1024 -40.844 1.980 -3.092 1.00 0.00 C ATOM 1959 O PRO A1024 -41.989 2.449 -3.263 1.00 0.00 O ATOM 1960 CB PRO A1024 -39.720 4.132 -2.448 1.00 0.00 C ATOM 1961 CG PRO A1024 -38.516 4.121 -3.318 1.00 0.00 C ATOM 1962 CD PRO A1024 -37.614 3.080 -2.722 1.00 0.00 C ATOM 1963 OXT PRO A1024 -40.409 0.982 -3.705 1.00 0.00 O ATOM 0 HA PRO A1024 -40.413 2.508 -1.120 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -40.586 4.539 -2.970 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -39.565 4.746 -1.561 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -38.776 3.875 -4.348 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -38.033 5.098 -3.336 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -36.993 2.602 -3.480 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -36.939 3.508 -1.981 1.00 0.00 H new TER 1971 PRO A1024