USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=32 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: A1007 SER OG : rot -56:sc= 0.674 USER MOD Set 1.2: A1012 HIS : no HD1:sc= -4.45! C(o=-3.8!,f=-7.3!) USER MOD Set 2.1: A 999 HIS : no HD1:sc= -2.07! C(o=-1.9!,f=-8.9!) USER MOD Set 2.2: A1000 SER OG : rot -20:sc= 0.155 USER MOD Set 3.1: A 975 HIS : no HD1:sc= -2.52 X(o=-3.4,f=-3!) USER MOD Set 3.2: A 987 THR OG1 : rot 180:sc= -0.892 USER MOD Single : A 901 HIS : no HD1:sc= -2.3 K(o=-2.3,f=-3.7!) USER MOD Single : A 903 GLN : amide:sc= -1.38! K(o=-1.4!,f=0) USER MOD Single : A 907 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 912 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 914 LYS NZ :NH3+ -143:sc= 0.992 (180deg=0.0759) USER MOD Single : A 915 THR OG1 : rot -149:sc= 0.936 USER MOD Single : A 916 GLN : amide:sc= -5.78! C(o=-5.8!,f=-1!) USER MOD Single : A 917 THR OG1 : rot 172:sc= 1.97 USER MOD Single : A 918 THR OG1 : rot 180:sc= -0.286 USER MOD Single : A 920 SER OG : rot 180:sc= 0 USER MOD Single : A 926 THR OG1 : rot -110:sc= -2.82! USER MOD Single : A 927 SER OG : rot 33:sc= 0.524 USER MOD Single : A 929 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 930 TYR OH : rot 180:sc= -5.05! USER MOD Single : A 936 TYR OH : rot 180:sc= 0 USER MOD Single : A 937 TYR OH : rot 180:sc= 0 USER MOD Single : A 942 SER OG : rot 180:sc= 0 USER MOD Single : A 944 THR OG1 : rot 180:sc= 0 USER MOD Single : A 948 ASN : amide:sc= -1.07 K(o=-1.1,f=-5.2!) USER MOD Single : A 952 SER OG : rot 180:sc= 0 USER MOD Single : A 953 SER OG : rot 180:sc= 0 USER MOD Single : A 955 LYS NZ :NH3+ -167:sc= -0.0141 (180deg=-0.208) USER MOD Single : A 959 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 961 LYS NZ :NH3+ 137:sc= -1.54! (180deg=-4.57!) USER MOD Single : A 962 SER OG : rot 31:sc= -0.882 USER MOD Single : A 964 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 965 THR OG1 : rot 180:sc= 0 USER MOD Single : A 971 ASN : amide:sc= -1.6! K(o=-1.6!,f=-0.75) USER MOD Single : A 973 MET CE :methyl -159:sc= -0.23 (180deg=-0.865) USER MOD Single : A 978 THR OG1 : rot -72:sc= 0.63 USER MOD Single : A 981 GLN : amide:sc= -2.3! K(o=-2.3!,f=-3) USER MOD Single : A 984 SER OG : rot -158:sc= -0.132 USER MOD Single : A 988 TYR OH : rot 180:sc= -1.27 USER MOD Single : A 989 SER OG : rot 180:sc= 0 USER MOD Single : A 991 THR OG1 : rot 180:sc= 0 USER MOD Single : A 992 THR OG1 : rot 180:sc= 0 USER MOD Single : A 994 HIS : no HD1:sc= -1.53 X(o=-1.5,f=-1.7!) USER MOD Single : A1001 SER OG : rot 180:sc= -1.62! USER MOD Single : A1009 ASN : amide:sc= -0.606 X(o=-0.61,f=-1.1) USER MOD Single : A1010 THR OG1 : rot 180:sc= 0 USER MOD Single : A1014 SER OG : rot -130:sc= -1.1 USER MOD Single : A1015 THR OG1 : rot 160:sc= -1.58! USER MOD Single : A1016 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1021 GLN : amide:sc= -1.92! K(o=-1.9!,f=-0.26) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 897 45.532 -7.536 -3.651 1.00 0.00 N ATOM 2 CA GLU A 897 45.214 -8.635 -2.702 1.00 0.00 C ATOM 3 C GLU A 897 43.730 -8.613 -2.330 1.00 0.00 C ATOM 4 O GLU A 897 42.868 -8.608 -3.210 1.00 0.00 O ATOM 5 CB GLU A 897 46.100 -8.474 -1.462 1.00 0.00 C ATOM 6 CG GLU A 897 46.124 -9.699 -0.560 1.00 0.00 C ATOM 7 CD GLU A 897 46.658 -10.931 -1.264 1.00 0.00 C ATOM 8 OE1 GLU A 897 47.820 -10.897 -1.722 1.00 0.00 O ATOM 9 OE2 GLU A 897 45.915 -11.932 -1.356 1.00 0.00 O ATOM 0 HA GLU A 897 45.414 -9.600 -3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 897 47.118 -8.250 -1.781 1.00 0.00 H new ATOM 0 HB3 GLU A 897 45.750 -7.617 -0.886 1.00 0.00 H new ATOM 0 HG2 GLU A 897 46.740 -9.489 0.315 1.00 0.00 H new ATOM 0 HG3 GLU A 897 45.115 -9.900 -0.199 1.00 0.00 H new ATOM 18 N ALA A 898 43.429 -8.599 -1.033 1.00 0.00 N ATOM 19 CA ALA A 898 42.047 -8.577 -0.570 1.00 0.00 C ATOM 20 C ALA A 898 41.343 -7.296 -1.005 1.00 0.00 C ATOM 21 O ALA A 898 41.882 -6.199 -0.855 1.00 0.00 O ATOM 22 CB ALA A 898 41.995 -8.723 0.943 1.00 0.00 C ATOM 0 H ALA A 898 44.124 -8.603 -0.286 1.00 0.00 H new ATOM 0 HA ALA A 898 41.524 -9.419 -1.023 1.00 0.00 H new ATOM 0 HB1 ALA A 898 40.957 -8.705 1.275 1.00 0.00 H new ATOM 0 HB2 ALA A 898 42.452 -9.669 1.233 1.00 0.00 H new ATOM 0 HB3 ALA A 898 42.539 -7.900 1.407 1.00 0.00 H new ATOM 28 N GLU A 899 40.135 -7.445 -1.543 1.00 0.00 N ATOM 29 CA GLU A 899 39.351 -6.303 -2.003 1.00 0.00 C ATOM 30 C GLU A 899 37.970 -6.750 -2.470 1.00 0.00 C ATOM 31 O GLU A 899 37.839 -7.741 -3.188 1.00 0.00 O ATOM 32 CB GLU A 899 40.075 -5.580 -3.140 1.00 0.00 C ATOM 33 CG GLU A 899 39.318 -4.375 -3.675 1.00 0.00 C ATOM 34 CD GLU A 899 40.051 -3.681 -4.807 1.00 0.00 C ATOM 35 OE1 GLU A 899 41.188 -3.216 -4.580 1.00 0.00 O ATOM 36 OE2 GLU A 899 39.489 -3.603 -5.919 1.00 0.00 O ATOM 0 H GLU A 899 39.677 -8.348 -1.671 1.00 0.00 H new ATOM 0 HA GLU A 899 39.232 -5.616 -1.166 1.00 0.00 H new ATOM 0 HB2 GLU A 899 41.054 -5.256 -2.788 1.00 0.00 H new ATOM 0 HB3 GLU A 899 40.246 -6.283 -3.956 1.00 0.00 H new ATOM 0 HG2 GLU A 899 38.336 -4.693 -4.024 1.00 0.00 H new ATOM 0 HG3 GLU A 899 39.153 -3.665 -2.865 1.00 0.00 H new ATOM 43 N ALA A 900 36.942 -6.014 -2.058 1.00 0.00 N ATOM 44 CA ALA A 900 35.572 -6.336 -2.436 1.00 0.00 C ATOM 45 C ALA A 900 34.627 -5.181 -2.137 1.00 0.00 C ATOM 46 O ALA A 900 34.700 -4.566 -1.072 1.00 0.00 O ATOM 47 CB ALA A 900 35.103 -7.588 -1.715 1.00 0.00 C ATOM 0 H ALA A 900 37.033 -5.191 -1.462 1.00 0.00 H new ATOM 0 HA ALA A 900 35.560 -6.516 -3.511 1.00 0.00 H new ATOM 0 HB1 ALA A 900 34.078 -7.814 -2.009 1.00 0.00 H new ATOM 0 HB2 ALA A 900 35.750 -8.424 -1.980 1.00 0.00 H new ATOM 0 HB3 ALA A 900 35.144 -7.425 -0.638 1.00 0.00 H new ATOM 53 N HIS A 901 33.733 -4.899 -3.079 1.00 0.00 N ATOM 54 CA HIS A 901 32.762 -3.824 -2.917 1.00 0.00 C ATOM 55 C HIS A 901 31.478 -4.151 -3.669 1.00 0.00 C ATOM 56 O HIS A 901 31.506 -4.467 -4.859 1.00 0.00 O ATOM 57 CB HIS A 901 33.333 -2.497 -3.425 1.00 0.00 C ATOM 58 CG HIS A 901 34.614 -2.098 -2.761 1.00 0.00 C ATOM 59 ND1 HIS A 901 35.822 -2.709 -3.023 1.00 0.00 N ATOM 60 CD2 HIS A 901 34.865 -1.154 -1.828 1.00 0.00 C ATOM 61 CE1 HIS A 901 36.763 -2.154 -2.278 1.00 0.00 C ATOM 62 NE2 HIS A 901 36.209 -1.208 -1.545 1.00 0.00 N ATOM 0 H HIS A 901 33.661 -5.401 -3.964 1.00 0.00 H new ATOM 0 HA HIS A 901 32.539 -3.727 -1.854 1.00 0.00 H new ATOM 0 HB2 HIS A 901 33.499 -2.571 -4.500 1.00 0.00 H new ATOM 0 HB3 HIS A 901 32.594 -1.711 -3.270 1.00 0.00 H new ATOM 0 HD2 HIS A 901 34.144 -0.482 -1.387 1.00 0.00 H new ATOM 0 HE1 HIS A 901 37.807 -2.429 -2.271 1.00 0.00 H new ATOM 0 HE2 HIS A 901 36.698 -0.613 -0.877 1.00 0.00 H new ATOM 71 N CYS A 902 30.352 -4.074 -2.967 1.00 0.00 N ATOM 72 CA CYS A 902 29.057 -4.364 -3.571 1.00 0.00 C ATOM 73 C CYS A 902 28.528 -3.156 -4.325 1.00 0.00 C ATOM 74 O CYS A 902 28.218 -2.129 -3.728 1.00 0.00 O ATOM 75 CB CYS A 902 28.054 -4.775 -2.497 1.00 0.00 C ATOM 76 SG CYS A 902 27.979 -3.629 -1.087 1.00 0.00 S ATOM 0 H CYS A 902 30.310 -3.814 -1.982 1.00 0.00 H new ATOM 0 HA CYS A 902 29.190 -5.185 -4.275 1.00 0.00 H new ATOM 0 HB2 CYS A 902 27.064 -4.849 -2.947 1.00 0.00 H new ATOM 0 HB3 CYS A 902 28.313 -5.769 -2.132 1.00 0.00 H new ATOM 81 N GLN A 903 28.417 -3.289 -5.638 1.00 0.00 N ATOM 82 CA GLN A 903 27.914 -2.203 -6.466 1.00 0.00 C ATOM 83 C GLN A 903 26.447 -1.927 -6.175 1.00 0.00 C ATOM 84 O GLN A 903 25.824 -2.605 -5.354 1.00 0.00 O ATOM 85 CB GLN A 903 28.095 -2.518 -7.949 1.00 0.00 C ATOM 86 CG GLN A 903 27.515 -3.860 -8.364 1.00 0.00 C ATOM 87 CD GLN A 903 27.646 -4.125 -9.852 1.00 0.00 C ATOM 88 OE1 GLN A 903 27.261 -5.188 -10.339 1.00 0.00 O ATOM 89 NE2 GLN A 903 28.187 -3.157 -10.588 1.00 0.00 N ATOM 0 H GLN A 903 28.667 -4.134 -6.151 1.00 0.00 H new ATOM 0 HA GLN A 903 28.492 -1.312 -6.222 1.00 0.00 H new ATOM 0 HB2 GLN A 903 27.625 -1.731 -8.538 1.00 0.00 H new ATOM 0 HB3 GLN A 903 29.158 -2.502 -8.187 1.00 0.00 H new ATOM 0 HG2 GLN A 903 28.019 -4.654 -7.813 1.00 0.00 H new ATOM 0 HG3 GLN A 903 26.462 -3.897 -8.085 1.00 0.00 H new ATOM 0 HE21 GLN A 903 28.493 -2.291 -10.145 1.00 0.00 H new ATOM 0 HE22 GLN A 903 28.295 -3.282 -11.595 1.00 0.00 H new ATOM 98 N ALA A 904 25.907 -0.927 -6.861 1.00 0.00 N ATOM 99 CA ALA A 904 24.510 -0.545 -6.698 1.00 0.00 C ATOM 100 C ALA A 904 23.597 -1.768 -6.761 1.00 0.00 C ATOM 101 O ALA A 904 23.718 -2.593 -7.666 1.00 0.00 O ATOM 102 CB ALA A 904 24.119 0.470 -7.761 1.00 0.00 C ATOM 0 H ALA A 904 26.419 -0.363 -7.539 1.00 0.00 H new ATOM 0 HA ALA A 904 24.390 -0.089 -5.715 1.00 0.00 H new ATOM 0 HB1 ALA A 904 23.073 0.749 -7.631 1.00 0.00 H new ATOM 0 HB2 ALA A 904 24.746 1.357 -7.666 1.00 0.00 H new ATOM 0 HB3 ALA A 904 24.257 0.033 -8.750 1.00 0.00 H new ATOM 108 N PRO A 905 22.669 -1.905 -5.796 1.00 0.00 N ATOM 109 CA PRO A 905 21.739 -3.040 -5.750 1.00 0.00 C ATOM 110 C PRO A 905 20.831 -3.094 -6.972 1.00 0.00 C ATOM 111 O PRO A 905 21.092 -2.444 -7.985 1.00 0.00 O ATOM 112 CB PRO A 905 20.916 -2.790 -4.477 1.00 0.00 C ATOM 113 CG PRO A 905 21.718 -1.820 -3.678 1.00 0.00 C ATOM 114 CD PRO A 905 22.457 -0.977 -4.675 1.00 0.00 C ATOM 0 HA PRO A 905 22.267 -3.994 -5.745 1.00 0.00 H new ATOM 0 HB2 PRO A 905 19.933 -2.385 -4.717 1.00 0.00 H new ATOM 0 HB3 PRO A 905 20.753 -3.716 -3.925 1.00 0.00 H new ATOM 0 HG2 PRO A 905 21.074 -1.206 -3.049 1.00 0.00 H new ATOM 0 HG3 PRO A 905 22.411 -2.339 -3.015 1.00 0.00 H new ATOM 0 HD2 PRO A 905 21.876 -0.105 -4.976 1.00 0.00 H new ATOM 0 HD3 PRO A 905 23.400 -0.608 -4.272 1.00 0.00 H new ATOM 122 N ASP A 906 19.763 -3.874 -6.869 1.00 0.00 N ATOM 123 CA ASP A 906 18.811 -4.020 -7.961 1.00 0.00 C ATOM 124 C ASP A 906 18.082 -2.713 -8.224 1.00 0.00 C ATOM 125 O ASP A 906 17.442 -2.533 -9.260 1.00 0.00 O ATOM 126 CB ASP A 906 17.826 -5.142 -7.641 1.00 0.00 C ATOM 127 CG ASP A 906 16.760 -5.327 -8.706 1.00 0.00 C ATOM 128 OD1 ASP A 906 15.908 -4.427 -8.860 1.00 0.00 O ATOM 129 OD2 ASP A 906 16.779 -6.374 -9.387 1.00 0.00 O ATOM 0 H ASP A 906 19.534 -4.417 -6.037 1.00 0.00 H new ATOM 0 HA ASP A 906 19.355 -4.280 -8.869 1.00 0.00 H new ATOM 0 HB2 ASP A 906 18.376 -6.076 -7.521 1.00 0.00 H new ATOM 0 HB3 ASP A 906 17.344 -4.931 -6.687 1.00 0.00 H new ATOM 134 N HIS A 907 18.202 -1.809 -7.271 1.00 0.00 N ATOM 135 CA HIS A 907 17.574 -0.494 -7.350 1.00 0.00 C ATOM 136 C HIS A 907 16.057 -0.621 -7.407 1.00 0.00 C ATOM 137 O HIS A 907 15.506 -1.142 -8.376 1.00 0.00 O ATOM 138 CB HIS A 907 18.068 0.268 -8.583 1.00 0.00 C ATOM 139 CG HIS A 907 17.615 1.695 -8.625 1.00 0.00 C ATOM 140 ND1 HIS A 907 17.921 2.611 -7.641 1.00 0.00 N ATOM 141 CD2 HIS A 907 16.876 2.363 -9.542 1.00 0.00 C ATOM 142 CE1 HIS A 907 17.389 3.780 -7.950 1.00 0.00 C ATOM 143 NE2 HIS A 907 16.750 3.656 -9.098 1.00 0.00 N ATOM 0 H HIS A 907 18.738 -1.961 -6.416 1.00 0.00 H new ATOM 0 HA HIS A 907 17.850 0.060 -6.453 1.00 0.00 H new ATOM 0 HB2 HIS A 907 19.157 0.240 -8.605 1.00 0.00 H new ATOM 0 HB3 HIS A 907 17.718 -0.243 -9.480 1.00 0.00 H new ATOM 0 HD2 HIS A 907 16.463 1.955 -10.453 1.00 0.00 H new ATOM 0 HE1 HIS A 907 17.464 4.683 -7.363 1.00 0.00 H new ATOM 0 HE2 HIS A 907 16.244 4.401 -9.578 1.00 0.00 H new ATOM 152 N PHE A 908 15.385 -0.137 -6.370 1.00 0.00 N ATOM 153 CA PHE A 908 13.932 -0.199 -6.325 1.00 0.00 C ATOM 154 C PHE A 908 13.308 1.040 -6.945 1.00 0.00 C ATOM 155 O PHE A 908 13.718 2.167 -6.670 1.00 0.00 O ATOM 156 CB PHE A 908 13.438 -0.391 -4.893 1.00 0.00 C ATOM 157 CG PHE A 908 13.757 -1.749 -4.346 1.00 0.00 C ATOM 158 CD1 PHE A 908 15.045 -2.065 -3.944 1.00 0.00 C ATOM 159 CD2 PHE A 908 12.772 -2.715 -4.249 1.00 0.00 C ATOM 160 CE1 PHE A 908 15.343 -3.321 -3.452 1.00 0.00 C ATOM 161 CE2 PHE A 908 13.061 -3.973 -3.757 1.00 0.00 C ATOM 162 CZ PHE A 908 14.349 -4.276 -3.358 1.00 0.00 C ATOM 0 H PHE A 908 15.819 0.299 -5.556 1.00 0.00 H new ATOM 0 HA PHE A 908 13.620 -1.062 -6.913 1.00 0.00 H new ATOM 0 HB2 PHE A 908 13.888 0.368 -4.253 1.00 0.00 H new ATOM 0 HB3 PHE A 908 12.360 -0.236 -4.862 1.00 0.00 H new ATOM 0 HD1 PHE A 908 15.825 -1.321 -4.016 1.00 0.00 H new ATOM 0 HD2 PHE A 908 11.765 -2.483 -4.562 1.00 0.00 H new ATOM 0 HE1 PHE A 908 16.350 -3.556 -3.142 1.00 0.00 H new ATOM 0 HE2 PHE A 908 12.282 -4.718 -3.684 1.00 0.00 H new ATOM 0 HZ PHE A 908 14.578 -5.259 -2.973 1.00 0.00 H new ATOM 172 N LEU A 909 12.317 0.809 -7.791 1.00 0.00 N ATOM 173 CA LEU A 909 11.617 1.883 -8.479 1.00 0.00 C ATOM 174 C LEU A 909 10.754 2.680 -7.515 1.00 0.00 C ATOM 175 O LEU A 909 10.760 3.909 -7.533 1.00 0.00 O ATOM 176 CB LEU A 909 10.753 1.303 -9.597 1.00 0.00 C ATOM 177 CG LEU A 909 11.520 0.677 -10.767 1.00 0.00 C ATOM 178 CD1 LEU A 909 12.501 -0.383 -10.287 1.00 0.00 C ATOM 179 CD2 LEU A 909 10.543 0.069 -11.751 1.00 0.00 C ATOM 0 H LEU A 909 11.976 -0.125 -8.020 1.00 0.00 H new ATOM 0 HA LEU A 909 12.359 2.558 -8.906 1.00 0.00 H new ATOM 0 HB2 LEU A 909 10.096 0.545 -9.169 1.00 0.00 H new ATOM 0 HB3 LEU A 909 10.114 2.095 -9.987 1.00 0.00 H new ATOM 0 HG LEU A 909 12.092 1.465 -11.257 1.00 0.00 H new ATOM 0 HD11 LEU A 909 13.027 -0.806 -11.143 1.00 0.00 H new ATOM 0 HD12 LEU A 909 13.221 0.070 -9.605 1.00 0.00 H new ATOM 0 HD13 LEU A 909 11.958 -1.173 -9.769 1.00 0.00 H new ATOM 0 HD21 LEU A 909 11.092 -0.375 -12.581 1.00 0.00 H new ATOM 0 HD22 LEU A 909 9.955 -0.701 -11.251 1.00 0.00 H new ATOM 0 HD23 LEU A 909 9.878 0.845 -12.130 1.00 0.00 H new ATOM 191 N PHE A 910 10.011 1.974 -6.669 1.00 0.00 N ATOM 192 CA PHE A 910 9.142 2.620 -5.696 1.00 0.00 C ATOM 193 C PHE A 910 9.928 3.031 -4.456 1.00 0.00 C ATOM 194 O PHE A 910 9.399 3.048 -3.346 1.00 0.00 O ATOM 195 CB PHE A 910 7.987 1.687 -5.320 1.00 0.00 C ATOM 196 CG PHE A 910 8.420 0.284 -4.992 1.00 0.00 C ATOM 197 CD1 PHE A 910 9.245 0.027 -3.908 1.00 0.00 C ATOM 198 CD2 PHE A 910 8.004 -0.779 -5.779 1.00 0.00 C ATOM 199 CE1 PHE A 910 9.645 -1.263 -3.615 1.00 0.00 C ATOM 200 CE2 PHE A 910 8.401 -2.070 -5.489 1.00 0.00 C ATOM 201 CZ PHE A 910 9.222 -2.312 -4.407 1.00 0.00 C ATOM 0 H PHE A 910 9.994 0.955 -6.639 1.00 0.00 H new ATOM 0 HA PHE A 910 8.729 3.523 -6.146 1.00 0.00 H new ATOM 0 HB2 PHE A 910 7.460 2.104 -4.462 1.00 0.00 H new ATOM 0 HB3 PHE A 910 7.276 1.654 -6.145 1.00 0.00 H new ATOM 0 HD1 PHE A 910 9.579 0.844 -3.286 1.00 0.00 H new ATOM 0 HD2 PHE A 910 7.362 -0.596 -6.628 1.00 0.00 H new ATOM 0 HE1 PHE A 910 10.288 -1.450 -2.768 1.00 0.00 H new ATOM 0 HE2 PHE A 910 8.069 -2.890 -6.109 1.00 0.00 H new ATOM 0 HZ PHE A 910 9.534 -3.321 -4.180 1.00 0.00 H new ATOM 211 N ALA A 911 11.197 3.369 -4.663 1.00 0.00 N ATOM 212 CA ALA A 911 12.067 3.792 -3.575 1.00 0.00 C ATOM 213 C ALA A 911 13.212 4.653 -4.098 1.00 0.00 C ATOM 214 O ALA A 911 13.993 4.214 -4.943 1.00 0.00 O ATOM 215 CB ALA A 911 12.608 2.579 -2.834 1.00 0.00 C ATOM 0 H ALA A 911 11.646 3.357 -5.579 1.00 0.00 H new ATOM 0 HA ALA A 911 11.481 4.395 -2.881 1.00 0.00 H new ATOM 0 HB1 ALA A 911 13.257 2.908 -2.023 1.00 0.00 H new ATOM 0 HB2 ALA A 911 11.778 2.003 -2.424 1.00 0.00 H new ATOM 0 HB3 ALA A 911 13.177 1.955 -3.524 1.00 0.00 H new ATOM 221 N LYS A 912 13.307 5.878 -3.594 1.00 0.00 N ATOM 222 CA LYS A 912 14.360 6.796 -4.013 1.00 0.00 C ATOM 223 C LYS A 912 15.532 6.764 -3.039 1.00 0.00 C ATOM 224 O LYS A 912 15.347 6.892 -1.830 1.00 0.00 O ATOM 225 CB LYS A 912 13.813 8.220 -4.121 1.00 0.00 C ATOM 226 CG LYS A 912 12.705 8.372 -5.150 1.00 0.00 C ATOM 227 CD LYS A 912 12.208 9.807 -5.223 1.00 0.00 C ATOM 228 CE LYS A 912 11.116 9.967 -6.269 1.00 0.00 C ATOM 229 NZ LYS A 912 10.632 11.373 -6.355 1.00 0.00 N ATOM 0 H LYS A 912 12.668 6.258 -2.895 1.00 0.00 H new ATOM 0 HA LYS A 912 14.716 6.475 -4.992 1.00 0.00 H new ATOM 0 HB2 LYS A 912 13.437 8.530 -3.146 1.00 0.00 H new ATOM 0 HB3 LYS A 912 14.630 8.895 -4.377 1.00 0.00 H new ATOM 0 HG2 LYS A 912 13.071 8.062 -6.129 1.00 0.00 H new ATOM 0 HG3 LYS A 912 11.877 7.711 -4.895 1.00 0.00 H new ATOM 0 HD2 LYS A 912 11.827 10.111 -4.248 1.00 0.00 H new ATOM 0 HD3 LYS A 912 13.040 10.470 -5.460 1.00 0.00 H new ATOM 0 HE2 LYS A 912 11.496 9.654 -7.241 1.00 0.00 H new ATOM 0 HE3 LYS A 912 10.281 9.310 -6.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 912 9.888 11.441 -7.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 912 10.246 11.664 -5.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 912 11.423 11.997 -6.612 1.00 0.00 H new ATOM 243 N LEU A 913 16.738 6.602 -3.577 1.00 0.00 N ATOM 244 CA LEU A 913 17.949 6.563 -2.763 1.00 0.00 C ATOM 245 C LEU A 913 17.928 7.678 -1.719 1.00 0.00 C ATOM 246 O LEU A 913 17.420 8.768 -1.979 1.00 0.00 O ATOM 247 CB LEU A 913 19.185 6.685 -3.665 1.00 0.00 C ATOM 248 CG LEU A 913 20.546 6.565 -2.966 1.00 0.00 C ATOM 249 CD1 LEU A 913 20.893 7.845 -2.223 1.00 0.00 C ATOM 250 CD2 LEU A 913 20.565 5.366 -2.028 1.00 0.00 C ATOM 0 H LEU A 913 16.903 6.495 -4.578 1.00 0.00 H new ATOM 0 HA LEU A 913 17.993 5.610 -2.236 1.00 0.00 H new ATOM 0 HB2 LEU A 913 19.125 5.915 -4.434 1.00 0.00 H new ATOM 0 HB3 LEU A 913 19.145 7.648 -4.174 1.00 0.00 H new ATOM 0 HG LEU A 913 21.307 6.409 -3.731 1.00 0.00 H new ATOM 0 HD11 LEU A 913 21.862 7.732 -1.737 1.00 0.00 H new ATOM 0 HD12 LEU A 913 20.935 8.675 -2.928 1.00 0.00 H new ATOM 0 HD13 LEU A 913 20.131 8.047 -1.470 1.00 0.00 H new ATOM 0 HD21 LEU A 913 21.539 5.299 -1.543 1.00 0.00 H new ATOM 0 HD22 LEU A 913 19.790 5.484 -1.271 1.00 0.00 H new ATOM 0 HD23 LEU A 913 20.380 4.455 -2.598 1.00 0.00 H new ATOM 262 N LYS A 914 18.473 7.399 -0.535 1.00 0.00 N ATOM 263 CA LYS A 914 18.495 8.391 0.535 1.00 0.00 C ATOM 264 C LYS A 914 19.861 8.449 1.215 1.00 0.00 C ATOM 265 O LYS A 914 20.343 9.526 1.562 1.00 0.00 O ATOM 266 CB LYS A 914 17.415 8.078 1.568 1.00 0.00 C ATOM 267 CG LYS A 914 17.207 9.196 2.573 1.00 0.00 C ATOM 268 CD LYS A 914 16.650 10.443 1.905 1.00 0.00 C ATOM 269 CE LYS A 914 16.480 11.580 2.898 1.00 0.00 C ATOM 270 NZ LYS A 914 15.539 11.226 3.996 1.00 0.00 N ATOM 0 H LYS A 914 18.900 6.504 -0.296 1.00 0.00 H new ATOM 0 HA LYS A 914 18.297 9.365 0.088 1.00 0.00 H new ATOM 0 HB2 LYS A 914 16.475 7.882 1.053 1.00 0.00 H new ATOM 0 HB3 LYS A 914 17.684 7.165 2.100 1.00 0.00 H new ATOM 0 HG2 LYS A 914 16.523 8.863 3.354 1.00 0.00 H new ATOM 0 HG3 LYS A 914 18.154 9.433 3.058 1.00 0.00 H new ATOM 0 HD2 LYS A 914 17.318 10.756 1.103 1.00 0.00 H new ATOM 0 HD3 LYS A 914 15.688 10.212 1.447 1.00 0.00 H new ATOM 0 HE2 LYS A 914 17.450 11.839 3.322 1.00 0.00 H new ATOM 0 HE3 LYS A 914 16.113 12.464 2.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 914 14.975 12.061 4.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 914 14.906 10.465 3.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 914 16.078 10.904 4.825 1.00 0.00 H new ATOM 284 N THR A 915 20.485 7.289 1.402 1.00 0.00 N ATOM 285 CA THR A 915 21.795 7.227 2.040 1.00 0.00 C ATOM 286 C THR A 915 22.848 7.932 1.190 1.00 0.00 C ATOM 287 O THR A 915 22.881 7.772 -0.030 1.00 0.00 O ATOM 288 CB THR A 915 22.235 5.771 2.286 1.00 0.00 C ATOM 289 OG1 THR A 915 21.312 5.128 3.171 1.00 0.00 O ATOM 290 CG2 THR A 915 23.634 5.717 2.882 1.00 0.00 C ATOM 0 H THR A 915 20.106 6.384 1.122 1.00 0.00 H new ATOM 0 HA THR A 915 21.706 7.734 3.001 1.00 0.00 H new ATOM 0 HB THR A 915 22.247 5.252 1.327 1.00 0.00 H new ATOM 0 HG1 THR A 915 21.784 4.454 3.703 1.00 0.00 H new ATOM 0 HG21 THR A 915 23.920 4.678 3.046 1.00 0.00 H new ATOM 0 HG22 THR A 915 24.340 6.184 2.195 1.00 0.00 H new ATOM 0 HG23 THR A 915 23.645 6.250 3.832 1.00 0.00 H new ATOM 298 N GLN A 916 23.701 8.719 1.841 1.00 0.00 N ATOM 299 CA GLN A 916 24.750 9.456 1.144 1.00 0.00 C ATOM 300 C GLN A 916 25.551 8.529 0.235 1.00 0.00 C ATOM 301 O GLN A 916 26.080 7.511 0.681 1.00 0.00 O ATOM 302 CB GLN A 916 25.693 10.138 2.142 1.00 0.00 C ATOM 303 CG GLN A 916 24.988 11.045 3.140 1.00 0.00 C ATOM 304 CD GLN A 916 24.356 10.290 4.298 1.00 0.00 C ATOM 305 OE1 GLN A 916 23.632 10.870 5.107 1.00 0.00 O ATOM 306 NE2 GLN A 916 24.641 8.994 4.398 1.00 0.00 N ATOM 0 H GLN A 916 23.686 8.862 2.851 1.00 0.00 H new ATOM 0 HA GLN A 916 24.268 10.220 0.534 1.00 0.00 H new ATOM 0 HB2 GLN A 916 26.243 9.372 2.689 1.00 0.00 H new ATOM 0 HB3 GLN A 916 26.427 10.724 1.590 1.00 0.00 H new ATOM 0 HG2 GLN A 916 25.704 11.766 3.534 1.00 0.00 H new ATOM 0 HG3 GLN A 916 24.216 11.613 2.621 1.00 0.00 H new ATOM 0 HE21 GLN A 916 25.245 8.550 3.707 1.00 0.00 H new ATOM 0 HE22 GLN A 916 24.255 8.445 5.166 1.00 0.00 H new ATOM 315 N THR A 917 25.632 8.888 -1.043 1.00 0.00 N ATOM 316 CA THR A 917 26.365 8.087 -2.014 1.00 0.00 C ATOM 317 C THR A 917 26.746 8.906 -3.242 1.00 0.00 C ATOM 318 O THR A 917 26.026 9.823 -3.640 1.00 0.00 O ATOM 319 CB THR A 917 25.553 6.860 -2.465 1.00 0.00 C ATOM 320 OG1 THR A 917 26.290 6.118 -3.444 1.00 0.00 O ATOM 321 CG2 THR A 917 24.211 7.280 -3.047 1.00 0.00 C ATOM 0 H THR A 917 25.199 9.727 -1.428 1.00 0.00 H new ATOM 0 HA THR A 917 27.272 7.750 -1.512 1.00 0.00 H new ATOM 0 HB THR A 917 25.372 6.233 -1.592 1.00 0.00 H new ATOM 0 HG1 THR A 917 25.827 5.275 -3.632 1.00 0.00 H new ATOM 0 HG21 THR A 917 23.656 6.395 -3.358 1.00 0.00 H new ATOM 0 HG22 THR A 917 23.640 7.819 -2.292 1.00 0.00 H new ATOM 0 HG23 THR A 917 24.375 7.927 -3.909 1.00 0.00 H new ATOM 329 N THR A 918 27.881 8.561 -3.841 1.00 0.00 N ATOM 330 CA THR A 918 28.367 9.251 -5.030 1.00 0.00 C ATOM 331 C THR A 918 29.313 8.342 -5.813 1.00 0.00 C ATOM 332 O THR A 918 30.405 8.745 -6.212 1.00 0.00 O ATOM 333 CB THR A 918 29.093 10.563 -4.666 1.00 0.00 C ATOM 334 OG1 THR A 918 28.283 11.339 -3.774 1.00 0.00 O ATOM 335 CG2 THR A 918 29.394 11.384 -5.912 1.00 0.00 C ATOM 0 H THR A 918 28.484 7.804 -3.520 1.00 0.00 H new ATOM 0 HA THR A 918 27.503 9.500 -5.646 1.00 0.00 H new ATOM 0 HB THR A 918 30.034 10.304 -4.181 1.00 0.00 H new ATOM 0 HG1 THR A 918 28.751 12.169 -3.546 1.00 0.00 H new ATOM 0 HG21 THR A 918 29.906 12.303 -5.627 1.00 0.00 H new ATOM 0 HG22 THR A 918 30.031 10.807 -6.583 1.00 0.00 H new ATOM 0 HG23 THR A 918 28.461 11.630 -6.420 1.00 0.00 H new ATOM 343 N ALA A 919 28.879 7.101 -6.014 1.00 0.00 N ATOM 344 CA ALA A 919 29.668 6.109 -6.732 1.00 0.00 C ATOM 345 C ALA A 919 28.832 4.872 -7.035 1.00 0.00 C ATOM 346 O ALA A 919 27.767 4.674 -6.448 1.00 0.00 O ATOM 347 CB ALA A 919 30.896 5.732 -5.920 1.00 0.00 C ATOM 0 H ALA A 919 27.976 6.758 -5.686 1.00 0.00 H new ATOM 0 HA ALA A 919 29.991 6.542 -7.679 1.00 0.00 H new ATOM 0 HB1 ALA A 919 31.479 4.990 -6.465 1.00 0.00 H new ATOM 0 HB2 ALA A 919 31.506 6.619 -5.750 1.00 0.00 H new ATOM 0 HB3 ALA A 919 30.585 5.316 -4.962 1.00 0.00 H new ATOM 353 N SER A 920 29.313 4.041 -7.954 1.00 0.00 N ATOM 354 CA SER A 920 28.598 2.825 -8.329 1.00 0.00 C ATOM 355 C SER A 920 28.925 1.686 -7.370 1.00 0.00 C ATOM 356 O SER A 920 28.048 0.909 -6.999 1.00 0.00 O ATOM 357 CB SER A 920 28.944 2.420 -9.756 1.00 0.00 C ATOM 358 OG SER A 920 28.218 1.269 -10.151 1.00 0.00 O ATOM 0 H SER A 920 30.192 4.186 -8.452 1.00 0.00 H new ATOM 0 HA SER A 920 27.529 3.031 -8.271 1.00 0.00 H new ATOM 0 HB2 SER A 920 28.723 3.244 -10.435 1.00 0.00 H new ATOM 0 HB3 SER A 920 30.013 2.223 -9.832 1.00 0.00 H new ATOM 0 HG SER A 920 28.457 1.031 -11.071 1.00 0.00 H new ATOM 364 N ASP A 921 30.189 1.597 -6.966 1.00 0.00 N ATOM 365 CA ASP A 921 30.617 0.555 -6.041 1.00 0.00 C ATOM 366 C ASP A 921 30.368 0.982 -4.597 1.00 0.00 C ATOM 367 O ASP A 921 30.913 1.982 -4.129 1.00 0.00 O ATOM 368 CB ASP A 921 32.100 0.225 -6.251 1.00 0.00 C ATOM 369 CG ASP A 921 32.996 1.448 -6.173 1.00 0.00 C ATOM 370 OD1 ASP A 921 32.468 2.569 -6.017 1.00 0.00 O ATOM 371 OD2 ASP A 921 34.230 1.284 -6.276 1.00 0.00 O ATOM 0 H ASP A 921 30.931 2.231 -7.263 1.00 0.00 H new ATOM 0 HA ASP A 921 30.030 -0.341 -6.242 1.00 0.00 H new ATOM 0 HB2 ASP A 921 32.416 -0.498 -5.499 1.00 0.00 H new ATOM 0 HB3 ASP A 921 32.227 -0.250 -7.224 1.00 0.00 H new ATOM 376 N PHE A 922 29.534 0.220 -3.896 1.00 0.00 N ATOM 377 CA PHE A 922 29.207 0.525 -2.508 1.00 0.00 C ATOM 378 C PHE A 922 29.985 -0.357 -1.536 1.00 0.00 C ATOM 379 O PHE A 922 30.152 -1.558 -1.764 1.00 0.00 O ATOM 380 CB PHE A 922 27.706 0.368 -2.257 1.00 0.00 C ATOM 381 CG PHE A 922 26.864 1.376 -2.984 1.00 0.00 C ATOM 382 CD1 PHE A 922 26.758 1.351 -4.365 1.00 0.00 C ATOM 383 CD2 PHE A 922 26.186 2.357 -2.281 1.00 0.00 C ATOM 384 CE1 PHE A 922 25.987 2.286 -5.030 1.00 0.00 C ATOM 385 CE2 PHE A 922 25.416 3.293 -2.939 1.00 0.00 C ATOM 386 CZ PHE A 922 25.316 3.258 -4.316 1.00 0.00 C ATOM 0 H PHE A 922 29.073 -0.612 -4.266 1.00 0.00 H new ATOM 0 HA PHE A 922 29.495 1.562 -2.332 1.00 0.00 H new ATOM 0 HB2 PHE A 922 27.399 -0.634 -2.558 1.00 0.00 H new ATOM 0 HB3 PHE A 922 27.515 0.452 -1.187 1.00 0.00 H new ATOM 0 HD1 PHE A 922 27.283 0.593 -4.928 1.00 0.00 H new ATOM 0 HD2 PHE A 922 26.261 2.390 -1.204 1.00 0.00 H new ATOM 0 HE1 PHE A 922 25.910 2.256 -6.107 1.00 0.00 H new ATOM 0 HE2 PHE A 922 24.892 4.053 -2.378 1.00 0.00 H new ATOM 0 HZ PHE A 922 24.714 3.990 -4.833 1.00 0.00 H new ATOM 396 N PRO A 923 30.464 0.236 -0.429 1.00 0.00 N ATOM 397 CA PRO A 923 31.221 -0.491 0.596 1.00 0.00 C ATOM 398 C PRO A 923 30.362 -1.523 1.320 1.00 0.00 C ATOM 399 O PRO A 923 29.201 -1.265 1.635 1.00 0.00 O ATOM 400 CB PRO A 923 31.667 0.610 1.563 1.00 0.00 C ATOM 401 CG PRO A 923 30.690 1.717 1.361 1.00 0.00 C ATOM 402 CD PRO A 923 30.296 1.661 -0.087 1.00 0.00 C ATOM 0 HA PRO A 923 32.049 -1.056 0.168 1.00 0.00 H new ATOM 0 HB2 PRO A 923 31.657 0.258 2.594 1.00 0.00 H new ATOM 0 HB3 PRO A 923 32.684 0.937 1.348 1.00 0.00 H new ATOM 0 HG2 PRO A 923 29.821 1.593 2.007 1.00 0.00 H new ATOM 0 HG3 PRO A 923 31.136 2.681 1.607 1.00 0.00 H new ATOM 0 HD2 PRO A 923 29.269 1.992 -0.238 1.00 0.00 H new ATOM 0 HD3 PRO A 923 30.930 2.300 -0.702 1.00 0.00 H new ATOM 410 N ILE A 924 30.938 -2.691 1.577 1.00 0.00 N ATOM 411 CA ILE A 924 30.226 -3.767 2.261 1.00 0.00 C ATOM 412 C ILE A 924 29.794 -3.348 3.663 1.00 0.00 C ATOM 413 O ILE A 924 30.426 -2.500 4.293 1.00 0.00 O ATOM 414 CB ILE A 924 31.084 -5.039 2.357 1.00 0.00 C ATOM 415 CG1 ILE A 924 31.543 -5.478 0.964 1.00 0.00 C ATOM 416 CG2 ILE A 924 30.288 -6.144 3.034 1.00 0.00 C ATOM 417 CD1 ILE A 924 32.445 -6.694 0.974 1.00 0.00 C ATOM 0 H ILE A 924 31.899 -2.919 1.322 1.00 0.00 H new ATOM 0 HA ILE A 924 29.339 -3.981 1.664 1.00 0.00 H new ATOM 0 HB ILE A 924 31.971 -4.828 2.955 1.00 0.00 H new ATOM 0 HG12 ILE A 924 30.666 -5.693 0.353 1.00 0.00 H new ATOM 0 HG13 ILE A 924 32.069 -4.651 0.487 1.00 0.00 H new ATOM 0 HG21 ILE A 924 30.899 -7.044 3.100 1.00 0.00 H new ATOM 0 HG22 ILE A 924 30.002 -5.825 4.036 1.00 0.00 H new ATOM 0 HG23 ILE A 924 29.392 -6.356 2.451 1.00 0.00 H new ATOM 0 HD11 ILE A 924 32.729 -6.945 -0.048 1.00 0.00 H new ATOM 0 HD12 ILE A 924 33.340 -6.478 1.557 1.00 0.00 H new ATOM 0 HD13 ILE A 924 31.916 -7.536 1.421 1.00 0.00 H new ATOM 429 N GLY A 925 28.706 -3.947 4.140 1.00 0.00 N ATOM 430 CA GLY A 925 28.193 -3.628 5.459 1.00 0.00 C ATOM 431 C GLY A 925 27.320 -2.392 5.441 1.00 0.00 C ATOM 432 O GLY A 925 26.380 -2.270 6.226 1.00 0.00 O ATOM 0 H GLY A 925 28.169 -4.651 3.633 1.00 0.00 H new ATOM 0 HA2 GLY A 925 27.619 -4.473 5.839 1.00 0.00 H new ATOM 0 HA3 GLY A 925 29.026 -3.474 6.145 1.00 0.00 H new ATOM 436 N THR A 926 27.639 -1.477 4.537 1.00 0.00 N ATOM 437 CA THR A 926 26.896 -0.235 4.395 1.00 0.00 C ATOM 438 C THR A 926 25.409 -0.483 4.154 1.00 0.00 C ATOM 439 O THR A 926 25.029 -1.266 3.282 1.00 0.00 O ATOM 440 CB THR A 926 27.460 0.607 3.235 1.00 0.00 C ATOM 441 OG1 THR A 926 28.735 1.147 3.598 1.00 0.00 O ATOM 442 CG2 THR A 926 26.510 1.731 2.857 1.00 0.00 C ATOM 0 H THR A 926 28.417 -1.575 3.884 1.00 0.00 H new ATOM 0 HA THR A 926 27.008 0.307 5.334 1.00 0.00 H new ATOM 0 HB THR A 926 27.575 -0.045 2.369 1.00 0.00 H new ATOM 0 HG1 THR A 926 28.657 2.116 3.719 1.00 0.00 H new ATOM 0 HG21 THR A 926 26.936 2.307 2.036 1.00 0.00 H new ATOM 0 HG22 THR A 926 25.554 1.310 2.547 1.00 0.00 H new ATOM 0 HG23 THR A 926 26.358 2.383 3.717 1.00 0.00 H new ATOM 450 N SER A 927 24.576 0.214 4.922 1.00 0.00 N ATOM 451 CA SER A 927 23.130 0.105 4.788 1.00 0.00 C ATOM 452 C SER A 927 22.627 1.148 3.801 1.00 0.00 C ATOM 453 O SER A 927 22.753 2.349 4.040 1.00 0.00 O ATOM 454 CB SER A 927 22.454 0.305 6.145 1.00 0.00 C ATOM 455 OG SER A 927 22.786 1.565 6.701 1.00 0.00 O ATOM 0 H SER A 927 24.882 0.863 5.647 1.00 0.00 H new ATOM 0 HA SER A 927 22.884 -0.891 4.419 1.00 0.00 H new ATOM 0 HB2 SER A 927 21.373 0.228 6.031 1.00 0.00 H new ATOM 0 HB3 SER A 927 22.759 -0.488 6.827 1.00 0.00 H new ATOM 0 HG SER A 927 22.897 2.221 5.982 1.00 0.00 H new ATOM 461 N LEU A 928 22.058 0.691 2.693 1.00 0.00 N ATOM 462 CA LEU A 928 21.543 1.604 1.681 1.00 0.00 C ATOM 463 C LEU A 928 20.046 1.812 1.882 1.00 0.00 C ATOM 464 O LEU A 928 19.233 0.985 1.471 1.00 0.00 O ATOM 465 CB LEU A 928 21.827 1.053 0.285 1.00 0.00 C ATOM 466 CG LEU A 928 21.947 2.106 -0.816 1.00 0.00 C ATOM 467 CD1 LEU A 928 23.032 3.116 -0.468 1.00 0.00 C ATOM 468 CD2 LEU A 928 22.244 1.441 -2.150 1.00 0.00 C ATOM 0 H LEU A 928 21.942 -0.298 2.473 1.00 0.00 H new ATOM 0 HA LEU A 928 22.044 2.567 1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 928 22.753 0.479 0.319 1.00 0.00 H new ATOM 0 HB3 LEU A 928 21.031 0.358 0.017 1.00 0.00 H new ATOM 0 HG LEU A 928 20.998 2.636 -0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 928 23.105 3.859 -1.262 1.00 0.00 H new ATOM 0 HD12 LEU A 928 22.781 3.611 0.470 1.00 0.00 H new ATOM 0 HD13 LEU A 928 23.987 2.602 -0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 928 22.327 2.202 -2.926 1.00 0.00 H new ATOM 0 HD22 LEU A 928 23.182 0.890 -2.081 1.00 0.00 H new ATOM 0 HD23 LEU A 928 21.437 0.753 -2.402 1.00 0.00 H new ATOM 480 N LYS A 929 19.692 2.906 2.542 1.00 0.00 N ATOM 481 CA LYS A 929 18.297 3.208 2.833 1.00 0.00 C ATOM 482 C LYS A 929 17.593 3.870 1.652 1.00 0.00 C ATOM 483 O LYS A 929 18.089 4.840 1.071 1.00 0.00 O ATOM 484 CB LYS A 929 18.207 4.103 4.069 1.00 0.00 C ATOM 485 CG LYS A 929 16.787 4.497 4.444 1.00 0.00 C ATOM 486 CD LYS A 929 16.751 5.293 5.739 1.00 0.00 C ATOM 487 CE LYS A 929 17.607 6.547 5.652 1.00 0.00 C ATOM 488 NZ LYS A 929 17.565 7.339 6.912 1.00 0.00 N ATOM 0 H LYS A 929 20.354 3.601 2.887 1.00 0.00 H new ATOM 0 HA LYS A 929 17.788 2.263 3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 929 18.665 3.587 4.913 1.00 0.00 H new ATOM 0 HB3 LYS A 929 18.790 5.007 3.894 1.00 0.00 H new ATOM 0 HG2 LYS A 929 16.349 5.088 3.640 1.00 0.00 H new ATOM 0 HG3 LYS A 929 16.176 3.601 4.550 1.00 0.00 H new ATOM 0 HD2 LYS A 929 15.722 5.570 5.967 1.00 0.00 H new ATOM 0 HD3 LYS A 929 17.103 4.668 6.560 1.00 0.00 H new ATOM 0 HE2 LYS A 929 18.638 6.268 5.433 1.00 0.00 H new ATOM 0 HE3 LYS A 929 17.261 7.165 4.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 929 18.161 8.185 6.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 929 16.585 7.628 7.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 929 17.919 6.758 7.699 1.00 0.00 H new ATOM 502 N TYR A 930 16.420 3.337 1.318 1.00 0.00 N ATOM 503 CA TYR A 930 15.613 3.862 0.223 1.00 0.00 C ATOM 504 C TYR A 930 14.314 4.459 0.756 1.00 0.00 C ATOM 505 O TYR A 930 13.685 3.892 1.648 1.00 0.00 O ATOM 506 CB TYR A 930 15.284 2.763 -0.789 1.00 0.00 C ATOM 507 CG TYR A 930 16.489 2.145 -1.460 1.00 0.00 C ATOM 508 CD1 TYR A 930 17.367 1.334 -0.755 1.00 0.00 C ATOM 509 CD2 TYR A 930 16.742 2.372 -2.807 1.00 0.00 C ATOM 510 CE1 TYR A 930 18.462 0.764 -1.374 1.00 0.00 C ATOM 511 CE2 TYR A 930 17.835 1.807 -3.432 1.00 0.00 C ATOM 512 CZ TYR A 930 18.692 1.003 -2.712 1.00 0.00 C ATOM 513 OH TYR A 930 19.778 0.436 -3.334 1.00 0.00 O ATOM 0 H TYR A 930 16.006 2.536 1.795 1.00 0.00 H new ATOM 0 HA TYR A 930 16.193 4.640 -0.274 1.00 0.00 H new ATOM 0 HB2 TYR A 930 14.723 1.977 -0.283 1.00 0.00 H new ATOM 0 HB3 TYR A 930 14.630 3.178 -1.556 1.00 0.00 H new ATOM 0 HD1 TYR A 930 17.191 1.146 0.294 1.00 0.00 H new ATOM 0 HD2 TYR A 930 16.072 3.001 -3.374 1.00 0.00 H new ATOM 0 HE1 TYR A 930 19.135 0.134 -0.812 1.00 0.00 H new ATOM 0 HE2 TYR A 930 18.018 1.994 -4.480 1.00 0.00 H new ATOM 0 HH TYR A 930 19.793 0.705 -4.276 1.00 0.00 H new ATOM 523 N GLU A 931 13.911 5.595 0.201 1.00 0.00 N ATOM 524 CA GLU A 931 12.681 6.256 0.622 1.00 0.00 C ATOM 525 C GLU A 931 11.500 5.789 -0.224 1.00 0.00 C ATOM 526 O GLU A 931 11.480 5.977 -1.439 1.00 0.00 O ATOM 527 CB GLU A 931 12.831 7.776 0.516 1.00 0.00 C ATOM 528 CG GLU A 931 13.950 8.345 1.375 1.00 0.00 C ATOM 529 CD GLU A 931 13.713 8.149 2.860 1.00 0.00 C ATOM 530 OE1 GLU A 931 13.639 6.984 3.304 1.00 0.00 O ATOM 531 OE2 GLU A 931 13.601 9.163 3.581 1.00 0.00 O ATOM 0 H GLU A 931 14.417 6.078 -0.541 1.00 0.00 H new ATOM 0 HA GLU A 931 12.490 5.990 1.662 1.00 0.00 H new ATOM 0 HB2 GLU A 931 13.014 8.042 -0.525 1.00 0.00 H new ATOM 0 HB3 GLU A 931 11.890 8.245 0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 931 14.891 7.871 1.097 1.00 0.00 H new ATOM 0 HG3 GLU A 931 14.055 9.410 1.167 1.00 0.00 H new ATOM 538 N CYS A 932 10.520 5.176 0.431 1.00 0.00 N ATOM 539 CA CYS A 932 9.333 4.672 -0.252 1.00 0.00 C ATOM 540 C CYS A 932 8.605 5.782 -1.007 1.00 0.00 C ATOM 541 O CYS A 932 8.517 6.915 -0.535 1.00 0.00 O ATOM 542 CB CYS A 932 8.377 4.025 0.751 1.00 0.00 C ATOM 543 SG CYS A 932 9.051 2.555 1.590 1.00 0.00 S ATOM 0 H CYS A 932 10.524 5.015 1.438 1.00 0.00 H new ATOM 0 HA CYS A 932 9.664 3.927 -0.975 1.00 0.00 H new ATOM 0 HB2 CYS A 932 8.104 4.765 1.503 1.00 0.00 H new ATOM 0 HB3 CYS A 932 7.460 3.744 0.232 1.00 0.00 H new ATOM 548 N ARG A 933 8.064 5.436 -2.172 1.00 0.00 N ATOM 549 CA ARG A 933 7.320 6.390 -2.987 1.00 0.00 C ATOM 550 C ARG A 933 5.870 6.455 -2.524 1.00 0.00 C ATOM 551 O ARG A 933 5.391 5.547 -1.845 1.00 0.00 O ATOM 552 CB ARG A 933 7.382 6.008 -4.471 1.00 0.00 C ATOM 553 CG ARG A 933 8.749 6.218 -5.103 1.00 0.00 C ATOM 554 CD ARG A 933 8.700 6.030 -6.613 1.00 0.00 C ATOM 555 NE ARG A 933 9.951 6.425 -7.255 1.00 0.00 N ATOM 556 CZ ARG A 933 10.134 6.433 -8.573 1.00 0.00 C ATOM 557 NH1 ARG A 933 9.146 6.079 -9.386 1.00 0.00 N ATOM 558 NH2 ARG A 933 11.305 6.796 -9.079 1.00 0.00 N ATOM 0 H ARG A 933 8.128 4.500 -2.573 1.00 0.00 H new ATOM 0 HA ARG A 933 7.778 7.372 -2.867 1.00 0.00 H new ATOM 0 HB2 ARG A 933 7.099 4.961 -4.579 1.00 0.00 H new ATOM 0 HB3 ARG A 933 6.645 6.595 -5.019 1.00 0.00 H new ATOM 0 HG2 ARG A 933 9.108 7.221 -4.872 1.00 0.00 H new ATOM 0 HG3 ARG A 933 9.463 5.516 -4.671 1.00 0.00 H new ATOM 0 HD2 ARG A 933 8.490 4.985 -6.841 1.00 0.00 H new ATOM 0 HD3 ARG A 933 7.880 6.618 -7.025 1.00 0.00 H new ATOM 0 HE ARG A 933 10.728 6.711 -6.659 1.00 0.00 H new ATOM 0 HH11 ARG A 933 8.244 5.800 -9.001 1.00 0.00 H new ATOM 0 HH12 ARG A 933 9.289 6.086 -10.396 1.00 0.00 H new ATOM 0 HH21 ARG A 933 12.066 7.069 -8.458 1.00 0.00 H new ATOM 0 HH22 ARG A 933 11.444 6.802 -10.089 1.00 0.00 H new ATOM 572 N PRO A 934 5.145 7.534 -2.876 1.00 0.00 N ATOM 573 CA PRO A 934 3.747 7.704 -2.485 1.00 0.00 C ATOM 574 C PRO A 934 2.923 6.451 -2.746 1.00 0.00 C ATOM 575 O PRO A 934 3.094 5.787 -3.769 1.00 0.00 O ATOM 576 CB PRO A 934 3.251 8.871 -3.355 1.00 0.00 C ATOM 577 CG PRO A 934 4.351 9.145 -4.331 1.00 0.00 C ATOM 578 CD PRO A 934 5.617 8.668 -3.679 1.00 0.00 C ATOM 0 HA PRO A 934 3.648 7.896 -1.417 1.00 0.00 H new ATOM 0 HB2 PRO A 934 2.327 8.610 -3.870 1.00 0.00 H new ATOM 0 HB3 PRO A 934 3.039 9.750 -2.747 1.00 0.00 H new ATOM 0 HG2 PRO A 934 4.176 8.622 -5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 934 4.409 10.208 -4.564 1.00 0.00 H new ATOM 0 HD2 PRO A 934 6.363 8.364 -4.413 1.00 0.00 H new ATOM 0 HD3 PRO A 934 6.073 9.442 -3.062 1.00 0.00 H new ATOM 586 N GLU A 935 2.043 6.136 -1.796 1.00 0.00 N ATOM 587 CA GLU A 935 1.172 4.962 -1.868 1.00 0.00 C ATOM 588 C GLU A 935 1.902 3.716 -1.372 1.00 0.00 C ATOM 589 O GLU A 935 1.570 2.594 -1.754 1.00 0.00 O ATOM 590 CB GLU A 935 0.655 4.739 -3.294 1.00 0.00 C ATOM 591 CG GLU A 935 -0.102 5.930 -3.860 1.00 0.00 C ATOM 592 CD GLU A 935 -0.594 5.693 -5.276 1.00 0.00 C ATOM 593 OE1 GLU A 935 -0.341 4.596 -5.816 1.00 0.00 O ATOM 594 OE2 GLU A 935 -1.231 6.604 -5.843 1.00 0.00 O ATOM 0 H GLU A 935 1.913 6.691 -0.950 1.00 0.00 H new ATOM 0 HA GLU A 935 0.315 5.148 -1.220 1.00 0.00 H new ATOM 0 HB2 GLU A 935 1.498 4.512 -3.946 1.00 0.00 H new ATOM 0 HB3 GLU A 935 0.002 3.866 -3.302 1.00 0.00 H new ATOM 0 HG2 GLU A 935 -0.953 6.153 -3.217 1.00 0.00 H new ATOM 0 HG3 GLU A 935 0.546 6.806 -3.847 1.00 0.00 H new ATOM 601 N TYR A 936 2.889 3.929 -0.504 1.00 0.00 N ATOM 602 CA TYR A 936 3.672 2.838 0.074 1.00 0.00 C ATOM 603 C TYR A 936 4.068 3.173 1.509 1.00 0.00 C ATOM 604 O TYR A 936 4.273 4.340 1.844 1.00 0.00 O ATOM 605 CB TYR A 936 4.932 2.562 -0.754 1.00 0.00 C ATOM 606 CG TYR A 936 4.656 2.097 -2.166 1.00 0.00 C ATOM 607 CD1 TYR A 936 4.285 2.997 -3.156 1.00 0.00 C ATOM 608 CD2 TYR A 936 4.760 0.755 -2.507 1.00 0.00 C ATOM 609 CE1 TYR A 936 4.026 2.574 -4.444 1.00 0.00 C ATOM 610 CE2 TYR A 936 4.505 0.324 -3.793 1.00 0.00 C ATOM 611 CZ TYR A 936 4.138 1.237 -4.759 1.00 0.00 C ATOM 612 OH TYR A 936 3.882 0.812 -6.042 1.00 0.00 O ATOM 0 H TYR A 936 3.167 4.856 -0.183 1.00 0.00 H new ATOM 0 HA TYR A 936 3.050 1.943 0.068 1.00 0.00 H new ATOM 0 HB2 TYR A 936 5.533 3.470 -0.794 1.00 0.00 H new ATOM 0 HB3 TYR A 936 5.530 1.806 -0.245 1.00 0.00 H new ATOM 0 HD1 TYR A 936 4.198 4.046 -2.914 1.00 0.00 H new ATOM 0 HD2 TYR A 936 5.045 0.036 -1.753 1.00 0.00 H new ATOM 0 HE1 TYR A 936 3.737 3.287 -5.202 1.00 0.00 H new ATOM 0 HE2 TYR A 936 4.592 -0.723 -4.042 1.00 0.00 H new ATOM 0 HH TYR A 936 4.007 -0.158 -6.096 1.00 0.00 H new ATOM 622 N TYR A 937 4.177 2.152 2.356 1.00 0.00 N ATOM 623 CA TYR A 937 4.555 2.368 3.753 1.00 0.00 C ATOM 624 C TYR A 937 5.560 1.328 4.236 1.00 0.00 C ATOM 625 O TYR A 937 6.290 0.735 3.443 1.00 0.00 O ATOM 626 CB TYR A 937 3.312 2.368 4.658 1.00 0.00 C ATOM 627 CG TYR A 937 2.413 1.149 4.526 1.00 0.00 C ATOM 628 CD1 TYR A 937 2.934 -0.123 4.305 1.00 0.00 C ATOM 629 CD2 TYR A 937 1.035 1.277 4.638 1.00 0.00 C ATOM 630 CE1 TYR A 937 2.108 -1.225 4.198 1.00 0.00 C ATOM 631 CE2 TYR A 937 0.202 0.177 4.531 1.00 0.00 C ATOM 632 CZ TYR A 937 0.744 -1.070 4.311 1.00 0.00 C ATOM 633 OH TYR A 937 -0.081 -2.166 4.205 1.00 0.00 O ATOM 0 H TYR A 937 4.011 1.177 2.105 1.00 0.00 H new ATOM 0 HA TYR A 937 5.035 3.345 3.811 1.00 0.00 H new ATOM 0 HB2 TYR A 937 3.638 2.448 5.695 1.00 0.00 H new ATOM 0 HB3 TYR A 937 2.723 3.259 4.439 1.00 0.00 H new ATOM 0 HD1 TYR A 937 4.003 -0.250 4.216 1.00 0.00 H new ATOM 0 HD2 TYR A 937 0.605 2.253 4.812 1.00 0.00 H new ATOM 0 HE1 TYR A 937 2.530 -2.204 4.026 1.00 0.00 H new ATOM 0 HE2 TYR A 937 -0.868 0.296 4.620 1.00 0.00 H new ATOM 0 HH TYR A 937 -1.014 -1.885 4.309 1.00 0.00 H new ATOM 643 N GLY A 938 5.588 1.117 5.546 1.00 0.00 N ATOM 644 CA GLY A 938 6.501 0.154 6.133 1.00 0.00 C ATOM 645 C GLY A 938 7.915 0.685 6.260 1.00 0.00 C ATOM 646 O GLY A 938 8.875 -0.074 6.163 1.00 0.00 O ATOM 0 H GLY A 938 4.990 1.599 6.217 1.00 0.00 H new ATOM 0 HA2 GLY A 938 6.135 -0.132 7.119 1.00 0.00 H new ATOM 0 HA3 GLY A 938 6.511 -0.749 5.523 1.00 0.00 H new ATOM 650 N ARG A 939 8.023 1.991 6.501 1.00 0.00 N ATOM 651 CA ARG A 939 9.308 2.681 6.672 1.00 0.00 C ATOM 652 C ARG A 939 10.334 2.317 5.585 1.00 0.00 C ATOM 653 O ARG A 939 10.165 1.348 4.845 1.00 0.00 O ATOM 654 CB ARG A 939 9.878 2.409 8.068 1.00 0.00 C ATOM 655 CG ARG A 939 10.270 0.965 8.312 1.00 0.00 C ATOM 656 CD ARG A 939 10.814 0.773 9.715 1.00 0.00 C ATOM 657 NE ARG A 939 9.828 1.108 10.739 1.00 0.00 N ATOM 658 CZ ARG A 939 8.675 0.462 10.897 1.00 0.00 C ATOM 659 NH1 ARG A 939 8.371 -0.565 10.114 1.00 0.00 N ATOM 660 NH2 ARG A 939 7.827 0.841 11.843 1.00 0.00 N ATOM 0 H ARG A 939 7.215 2.609 6.584 1.00 0.00 H new ATOM 0 HA ARG A 939 9.110 3.748 6.566 1.00 0.00 H new ATOM 0 HB2 ARG A 939 10.753 3.041 8.220 1.00 0.00 H new ATOM 0 HB3 ARG A 939 9.139 2.703 8.813 1.00 0.00 H new ATOM 0 HG2 ARG A 939 9.404 0.320 8.164 1.00 0.00 H new ATOM 0 HG3 ARG A 939 11.022 0.661 7.583 1.00 0.00 H new ATOM 0 HD2 ARG A 939 11.130 -0.262 9.842 1.00 0.00 H new ATOM 0 HD3 ARG A 939 11.699 1.395 9.848 1.00 0.00 H new ATOM 0 HE ARG A 939 10.035 1.882 11.370 1.00 0.00 H new ATOM 0 HH11 ARG A 939 9.022 -0.863 9.387 1.00 0.00 H new ATOM 0 HH12 ARG A 939 7.486 -1.057 10.239 1.00 0.00 H new ATOM 0 HH21 ARG A 939 8.058 1.628 12.450 1.00 0.00 H new ATOM 0 HH22 ARG A 939 6.943 0.346 11.964 1.00 0.00 H new ATOM 674 N PRO A 940 11.417 3.114 5.466 1.00 0.00 N ATOM 675 CA PRO A 940 12.469 2.888 4.465 1.00 0.00 C ATOM 676 C PRO A 940 13.371 1.706 4.811 1.00 0.00 C ATOM 677 O PRO A 940 13.750 1.525 5.969 1.00 0.00 O ATOM 678 CB PRO A 940 13.265 4.190 4.496 1.00 0.00 C ATOM 679 CG PRO A 940 13.086 4.703 5.879 1.00 0.00 C ATOM 680 CD PRO A 940 11.697 4.303 6.295 1.00 0.00 C ATOM 0 HA PRO A 940 12.052 2.643 3.488 1.00 0.00 H new ATOM 0 HB2 PRO A 940 14.317 4.017 4.270 1.00 0.00 H new ATOM 0 HB3 PRO A 940 12.893 4.900 3.758 1.00 0.00 H new ATOM 0 HG2 PRO A 940 13.832 4.279 6.552 1.00 0.00 H new ATOM 0 HG3 PRO A 940 13.206 5.786 5.912 1.00 0.00 H new ATOM 0 HD2 PRO A 940 11.648 4.071 7.359 1.00 0.00 H new ATOM 0 HD3 PRO A 940 10.977 5.100 6.109 1.00 0.00 H new ATOM 688 N PHE A 941 13.715 0.905 3.803 1.00 0.00 N ATOM 689 CA PHE A 941 14.577 -0.255 4.016 1.00 0.00 C ATOM 690 C PHE A 941 16.040 0.074 3.719 1.00 0.00 C ATOM 691 O PHE A 941 16.393 0.484 2.613 1.00 0.00 O ATOM 692 CB PHE A 941 14.101 -1.440 3.172 1.00 0.00 C ATOM 693 CG PHE A 941 13.981 -1.148 1.704 1.00 0.00 C ATOM 694 CD1 PHE A 941 15.056 -1.340 0.852 1.00 0.00 C ATOM 695 CD2 PHE A 941 12.786 -0.685 1.176 1.00 0.00 C ATOM 696 CE1 PHE A 941 14.941 -1.078 -0.498 1.00 0.00 C ATOM 697 CE2 PHE A 941 12.667 -0.420 -0.173 1.00 0.00 C ATOM 698 CZ PHE A 941 13.746 -0.618 -1.012 1.00 0.00 C ATOM 0 H PHE A 941 13.412 1.037 2.838 1.00 0.00 H new ATOM 0 HA PHE A 941 14.511 -0.533 5.068 1.00 0.00 H new ATOM 0 HB2 PHE A 941 14.794 -2.270 3.309 1.00 0.00 H new ATOM 0 HB3 PHE A 941 13.131 -1.770 3.545 1.00 0.00 H new ATOM 0 HD1 PHE A 941 15.994 -1.699 1.248 1.00 0.00 H new ATOM 0 HD2 PHE A 941 11.939 -0.530 1.828 1.00 0.00 H new ATOM 0 HE1 PHE A 941 15.786 -1.233 -1.152 1.00 0.00 H new ATOM 0 HE2 PHE A 941 11.731 -0.058 -0.572 1.00 0.00 H new ATOM 0 HZ PHE A 941 13.655 -0.413 -2.068 1.00 0.00 H new ATOM 708 N SER A 942 16.879 -0.099 4.735 1.00 0.00 N ATOM 709 CA SER A 942 18.310 0.178 4.627 1.00 0.00 C ATOM 710 C SER A 942 19.061 -0.894 3.845 1.00 0.00 C ATOM 711 O SER A 942 20.010 -0.599 3.130 1.00 0.00 O ATOM 712 CB SER A 942 18.919 0.322 6.020 1.00 0.00 C ATOM 713 OG SER A 942 18.729 -0.857 6.784 1.00 0.00 O ATOM 0 H SER A 942 16.589 -0.434 5.654 1.00 0.00 H new ATOM 0 HA SER A 942 18.413 1.111 4.074 1.00 0.00 H new ATOM 0 HB2 SER A 942 19.984 0.536 5.934 1.00 0.00 H new ATOM 0 HB3 SER A 942 18.464 1.169 6.533 1.00 0.00 H new ATOM 0 HG SER A 942 19.129 -0.740 7.671 1.00 0.00 H new ATOM 719 N ILE A 943 18.654 -2.138 4.032 1.00 0.00 N ATOM 720 CA ILE A 943 19.289 -3.296 3.392 1.00 0.00 C ATOM 721 C ILE A 943 20.806 -3.266 3.563 1.00 0.00 C ATOM 722 O ILE A 943 21.512 -2.502 2.901 1.00 0.00 O ATOM 723 CB ILE A 943 18.935 -3.457 1.890 1.00 0.00 C ATOM 724 CG1 ILE A 943 19.327 -2.227 1.064 1.00 0.00 C ATOM 725 CG2 ILE A 943 17.454 -3.754 1.729 1.00 0.00 C ATOM 726 CD1 ILE A 943 19.139 -2.414 -0.429 1.00 0.00 C ATOM 0 H ILE A 943 17.869 -2.383 4.635 1.00 0.00 H new ATOM 0 HA ILE A 943 18.879 -4.164 3.909 1.00 0.00 H new ATOM 0 HB ILE A 943 19.515 -4.297 1.508 1.00 0.00 H new ATOM 0 HG12 ILE A 943 18.733 -1.374 1.393 1.00 0.00 H new ATOM 0 HG13 ILE A 943 20.371 -1.984 1.263 1.00 0.00 H new ATOM 0 HG21 ILE A 943 17.218 -3.865 0.671 1.00 0.00 H new ATOM 0 HG22 ILE A 943 17.209 -4.677 2.254 1.00 0.00 H new ATOM 0 HG23 ILE A 943 16.871 -2.933 2.147 1.00 0.00 H new ATOM 0 HD11 ILE A 943 19.436 -1.504 -0.950 1.00 0.00 H new ATOM 0 HD12 ILE A 943 19.754 -3.246 -0.772 1.00 0.00 H new ATOM 0 HD13 ILE A 943 18.091 -2.627 -0.640 1.00 0.00 H new ATOM 738 N THR A 944 21.301 -4.108 4.464 1.00 0.00 N ATOM 739 CA THR A 944 22.730 -4.194 4.733 1.00 0.00 C ATOM 740 C THR A 944 23.451 -5.004 3.664 1.00 0.00 C ATOM 741 O THR A 944 23.110 -6.158 3.420 1.00 0.00 O ATOM 742 CB THR A 944 23.003 -4.841 6.104 1.00 0.00 C ATOM 743 OG1 THR A 944 22.489 -4.012 7.153 1.00 0.00 O ATOM 744 CG2 THR A 944 24.493 -5.069 6.310 1.00 0.00 C ATOM 0 H THR A 944 20.730 -4.743 5.022 1.00 0.00 H new ATOM 0 HA THR A 944 23.108 -3.172 4.729 1.00 0.00 H new ATOM 0 HB THR A 944 22.499 -5.807 6.129 1.00 0.00 H new ATOM 0 HG1 THR A 944 22.666 -4.434 8.020 1.00 0.00 H new ATOM 0 HG21 THR A 944 24.660 -5.527 7.285 1.00 0.00 H new ATOM 0 HG22 THR A 944 24.871 -5.729 5.530 1.00 0.00 H new ATOM 0 HG23 THR A 944 25.017 -4.114 6.263 1.00 0.00 H new ATOM 752 N CYS A 945 24.470 -4.408 3.052 1.00 0.00 N ATOM 753 CA CYS A 945 25.253 -5.105 2.040 1.00 0.00 C ATOM 754 C CYS A 945 26.152 -6.131 2.695 1.00 0.00 C ATOM 755 O CYS A 945 26.834 -5.843 3.677 1.00 0.00 O ATOM 756 CB CYS A 945 26.080 -4.120 1.221 1.00 0.00 C ATOM 757 SG CYS A 945 27.576 -4.845 0.484 1.00 0.00 S ATOM 0 H CYS A 945 24.770 -3.451 3.238 1.00 0.00 H new ATOM 0 HA CYS A 945 24.567 -5.616 1.364 1.00 0.00 H new ATOM 0 HB2 CYS A 945 25.457 -3.711 0.426 1.00 0.00 H new ATOM 0 HB3 CYS A 945 26.370 -3.285 1.860 1.00 0.00 H new ATOM 762 N LEU A 946 26.118 -7.341 2.169 1.00 0.00 N ATOM 763 CA LEU A 946 26.902 -8.425 2.726 1.00 0.00 C ATOM 764 C LEU A 946 28.279 -8.550 2.102 1.00 0.00 C ATOM 765 O LEU A 946 28.590 -7.957 1.070 1.00 0.00 O ATOM 766 CB LEU A 946 26.145 -9.741 2.627 1.00 0.00 C ATOM 767 CG LEU A 946 24.765 -9.717 3.271 1.00 0.00 C ATOM 768 CD1 LEU A 946 24.852 -9.213 4.704 1.00 0.00 C ATOM 769 CD2 LEU A 946 23.843 -8.859 2.451 1.00 0.00 C ATOM 0 H LEU A 946 25.556 -7.597 1.357 1.00 0.00 H new ATOM 0 HA LEU A 946 27.062 -8.182 3.776 1.00 0.00 H new ATOM 0 HB2 LEU A 946 26.038 -10.008 1.576 1.00 0.00 H new ATOM 0 HB3 LEU A 946 26.739 -10.525 3.096 1.00 0.00 H new ATOM 0 HG LEU A 946 24.365 -10.731 3.301 1.00 0.00 H new ATOM 0 HD11 LEU A 946 23.856 -9.203 5.147 1.00 0.00 H new ATOM 0 HD12 LEU A 946 25.500 -9.871 5.283 1.00 0.00 H new ATOM 0 HD13 LEU A 946 25.262 -8.203 4.710 1.00 0.00 H new ATOM 0 HD21 LEU A 946 22.856 -8.842 2.912 1.00 0.00 H new ATOM 0 HD22 LEU A 946 24.238 -7.844 2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 946 23.766 -9.268 1.443 1.00 0.00 H new ATOM 781 N ASP A 947 29.086 -9.341 2.778 1.00 0.00 N ATOM 782 CA ASP A 947 30.457 -9.625 2.399 1.00 0.00 C ATOM 783 C ASP A 947 30.605 -10.053 0.939 1.00 0.00 C ATOM 784 O ASP A 947 31.550 -9.649 0.263 1.00 0.00 O ATOM 785 CB ASP A 947 30.961 -10.733 3.308 1.00 0.00 C ATOM 786 CG ASP A 947 32.436 -11.031 3.121 1.00 0.00 C ATOM 787 OD1 ASP A 947 32.828 -11.428 2.003 1.00 0.00 O ATOM 788 OD2 ASP A 947 33.202 -10.867 4.093 1.00 0.00 O ATOM 0 H ASP A 947 28.799 -9.819 3.632 1.00 0.00 H new ATOM 0 HA ASP A 947 31.038 -8.709 2.506 1.00 0.00 H new ATOM 0 HB2 ASP A 947 30.782 -10.453 4.346 1.00 0.00 H new ATOM 0 HB3 ASP A 947 30.386 -11.640 3.119 1.00 0.00 H new ATOM 793 N ASN A 948 29.697 -10.902 0.470 1.00 0.00 N ATOM 794 CA ASN A 948 29.772 -11.415 -0.895 1.00 0.00 C ATOM 795 C ASN A 948 29.161 -10.455 -1.913 1.00 0.00 C ATOM 796 O ASN A 948 28.450 -10.877 -2.826 1.00 0.00 O ATOM 797 CB ASN A 948 29.092 -12.784 -0.983 1.00 0.00 C ATOM 798 CG ASN A 948 27.646 -12.751 -0.530 1.00 0.00 C ATOM 799 OD1 ASN A 948 27.343 -12.345 0.592 1.00 0.00 O ATOM 800 ND2 ASN A 948 26.745 -13.191 -1.400 1.00 0.00 N ATOM 0 H ASN A 948 28.904 -11.249 1.010 1.00 0.00 H new ATOM 0 HA ASN A 948 30.828 -11.516 -1.143 1.00 0.00 H new ATOM 0 HB2 ASN A 948 29.138 -13.142 -2.011 1.00 0.00 H new ATOM 0 HB3 ASN A 948 29.643 -13.499 -0.372 1.00 0.00 H new ATOM 0 HD21 ASN A 948 25.756 -13.202 -1.149 1.00 0.00 H new ATOM 0 HD22 ASN A 948 27.041 -13.518 -2.319 1.00 0.00 H new ATOM 807 N LEU A 949 29.473 -9.168 -1.770 1.00 0.00 N ATOM 808 CA LEU A 949 28.983 -8.149 -2.698 1.00 0.00 C ATOM 809 C LEU A 949 27.504 -8.326 -3.014 1.00 0.00 C ATOM 810 O LEU A 949 27.112 -8.389 -4.179 1.00 0.00 O ATOM 811 CB LEU A 949 29.806 -8.180 -3.989 1.00 0.00 C ATOM 812 CG LEU A 949 31.108 -7.376 -3.950 1.00 0.00 C ATOM 813 CD1 LEU A 949 31.896 -7.678 -2.687 1.00 0.00 C ATOM 814 CD2 LEU A 949 31.953 -7.668 -5.180 1.00 0.00 C ATOM 0 H LEU A 949 30.063 -8.806 -1.021 1.00 0.00 H new ATOM 0 HA LEU A 949 29.098 -7.179 -2.214 1.00 0.00 H new ATOM 0 HB2 LEU A 949 30.045 -9.217 -4.224 1.00 0.00 H new ATOM 0 HB3 LEU A 949 29.189 -7.802 -4.804 1.00 0.00 H new ATOM 0 HG LEU A 949 30.849 -6.317 -3.947 1.00 0.00 H new ATOM 0 HD11 LEU A 949 32.816 -7.094 -2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 949 31.298 -7.417 -1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 949 32.140 -8.740 -2.656 1.00 0.00 H new ATOM 0 HD21 LEU A 949 32.874 -7.087 -5.135 1.00 0.00 H new ATOM 0 HD22 LEU A 949 32.195 -8.730 -5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 949 31.396 -7.396 -6.077 1.00 0.00 H new ATOM 826 N VAL A 950 26.686 -8.395 -1.974 1.00 0.00 N ATOM 827 CA VAL A 950 25.252 -8.554 -2.152 1.00 0.00 C ATOM 828 C VAL A 950 24.483 -7.597 -1.266 1.00 0.00 C ATOM 829 O VAL A 950 25.043 -6.646 -0.716 1.00 0.00 O ATOM 830 CB VAL A 950 24.790 -9.981 -1.822 1.00 0.00 C ATOM 831 CG1 VAL A 950 25.355 -10.971 -2.813 1.00 0.00 C ATOM 832 CG2 VAL A 950 25.187 -10.349 -0.406 1.00 0.00 C ATOM 0 H VAL A 950 26.990 -8.344 -1.002 1.00 0.00 H new ATOM 0 HA VAL A 950 25.050 -8.340 -3.202 1.00 0.00 H new ATOM 0 HB VAL A 950 23.703 -10.017 -1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 950 25.014 -11.975 -2.559 1.00 0.00 H new ATOM 0 HG12 VAL A 950 25.015 -10.715 -3.817 1.00 0.00 H new ATOM 0 HG13 VAL A 950 26.444 -10.938 -2.779 1.00 0.00 H new ATOM 0 HG21 VAL A 950 24.853 -11.363 -0.186 1.00 0.00 H new ATOM 0 HG22 VAL A 950 26.271 -10.294 -0.306 1.00 0.00 H new ATOM 0 HG23 VAL A 950 24.723 -9.654 0.294 1.00 0.00 H new ATOM 842 N TRP A 951 23.196 -7.868 -1.123 1.00 0.00 N ATOM 843 CA TRP A 951 22.328 -7.048 -0.302 1.00 0.00 C ATOM 844 C TRP A 951 21.193 -7.882 0.266 1.00 0.00 C ATOM 845 O TRP A 951 20.467 -8.550 -0.471 1.00 0.00 O ATOM 846 CB TRP A 951 21.753 -5.884 -1.117 1.00 0.00 C ATOM 847 CG TRP A 951 22.789 -4.911 -1.593 1.00 0.00 C ATOM 848 CD1 TRP A 951 23.553 -4.999 -2.724 1.00 0.00 C ATOM 849 CD2 TRP A 951 23.187 -3.710 -0.934 1.00 0.00 C ATOM 850 NE1 TRP A 951 24.397 -3.916 -2.808 1.00 0.00 N ATOM 851 CE2 TRP A 951 24.192 -3.112 -1.716 1.00 0.00 C ATOM 852 CE3 TRP A 951 22.786 -3.081 0.245 1.00 0.00 C ATOM 853 CZ2 TRP A 951 24.802 -1.914 -1.354 1.00 0.00 C ATOM 854 CZ3 TRP A 951 23.388 -1.895 0.605 1.00 0.00 C ATOM 855 CH2 TRP A 951 24.388 -1.319 -0.191 1.00 0.00 C ATOM 0 H TRP A 951 22.729 -8.657 -1.570 1.00 0.00 H new ATOM 0 HA TRP A 951 22.921 -6.645 0.519 1.00 0.00 H new ATOM 0 HB2 TRP A 951 21.220 -6.284 -1.979 1.00 0.00 H new ATOM 0 HB3 TRP A 951 21.021 -5.353 -0.509 1.00 0.00 H new ATOM 0 HD1 TRP A 951 23.501 -5.801 -3.445 1.00 0.00 H new ATOM 0 HE1 TRP A 951 25.065 -3.740 -3.558 1.00 0.00 H new ATOM 0 HE3 TRP A 951 22.017 -3.516 0.865 1.00 0.00 H new ATOM 0 HZ2 TRP A 951 25.573 -1.470 -1.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 951 23.084 -1.401 1.516 1.00 0.00 H new ATOM 0 HH2 TRP A 951 24.841 -0.389 0.118 1.00 0.00 H new ATOM 866 N SER A 952 21.057 -7.836 1.587 1.00 0.00 N ATOM 867 CA SER A 952 20.017 -8.578 2.290 1.00 0.00 C ATOM 868 C SER A 952 18.694 -8.502 1.536 1.00 0.00 C ATOM 869 O SER A 952 18.439 -7.544 0.805 1.00 0.00 O ATOM 870 CB SER A 952 19.844 -8.036 3.710 1.00 0.00 C ATOM 871 OG SER A 952 18.832 -8.743 4.406 1.00 0.00 O ATOM 0 H SER A 952 21.661 -7.286 2.198 1.00 0.00 H new ATOM 0 HA SER A 952 20.323 -9.623 2.345 1.00 0.00 H new ATOM 0 HB2 SER A 952 20.787 -8.118 4.251 1.00 0.00 H new ATOM 0 HB3 SER A 952 19.590 -6.977 3.670 1.00 0.00 H new ATOM 0 HG SER A 952 18.742 -8.379 5.311 1.00 0.00 H new ATOM 877 N SER A 953 17.863 -9.522 1.703 1.00 0.00 N ATOM 878 CA SER A 953 16.581 -9.571 1.019 1.00 0.00 C ATOM 879 C SER A 953 15.563 -8.653 1.690 1.00 0.00 C ATOM 880 O SER A 953 15.228 -8.828 2.862 1.00 0.00 O ATOM 881 CB SER A 953 16.061 -11.005 0.999 1.00 0.00 C ATOM 882 OG SER A 953 14.800 -11.084 0.357 1.00 0.00 O ATOM 0 H SER A 953 18.054 -10.323 2.304 1.00 0.00 H new ATOM 0 HA SER A 953 16.725 -9.223 -0.004 1.00 0.00 H new ATOM 0 HB2 SER A 953 16.775 -11.647 0.483 1.00 0.00 H new ATOM 0 HB3 SER A 953 15.976 -11.378 2.020 1.00 0.00 H new ATOM 0 HG SER A 953 14.491 -12.014 0.357 1.00 0.00 H new ATOM 888 N PRO A 954 15.069 -7.651 0.944 1.00 0.00 N ATOM 889 CA PRO A 954 14.099 -6.678 1.442 1.00 0.00 C ATOM 890 C PRO A 954 12.670 -7.217 1.458 1.00 0.00 C ATOM 891 O PRO A 954 11.779 -6.643 0.833 1.00 0.00 O ATOM 892 CB PRO A 954 14.212 -5.506 0.450 1.00 0.00 C ATOM 893 CG PRO A 954 15.305 -5.874 -0.504 1.00 0.00 C ATOM 894 CD PRO A 954 15.429 -7.366 -0.446 1.00 0.00 C ATOM 0 HA PRO A 954 14.310 -6.405 2.476 1.00 0.00 H new ATOM 0 HB2 PRO A 954 13.271 -5.349 -0.077 1.00 0.00 H new ATOM 0 HB3 PRO A 954 14.445 -4.577 0.970 1.00 0.00 H new ATOM 0 HG2 PRO A 954 15.067 -5.543 -1.515 1.00 0.00 H new ATOM 0 HG3 PRO A 954 16.243 -5.395 -0.224 1.00 0.00 H new ATOM 0 HD2 PRO A 954 14.758 -7.858 -1.150 1.00 0.00 H new ATOM 0 HD3 PRO A 954 16.439 -7.700 -0.682 1.00 0.00 H new ATOM 902 N LYS A 955 12.450 -8.314 2.174 1.00 0.00 N ATOM 903 CA LYS A 955 11.118 -8.899 2.258 1.00 0.00 C ATOM 904 C LYS A 955 10.264 -8.147 3.275 1.00 0.00 C ATOM 905 O LYS A 955 10.678 -7.939 4.416 1.00 0.00 O ATOM 906 CB LYS A 955 11.195 -10.383 2.632 1.00 0.00 C ATOM 907 CG LYS A 955 11.796 -10.641 4.004 1.00 0.00 C ATOM 908 CD LYS A 955 11.760 -12.121 4.353 1.00 0.00 C ATOM 909 CE LYS A 955 12.379 -12.391 5.714 1.00 0.00 C ATOM 910 NZ LYS A 955 13.819 -12.014 5.754 1.00 0.00 N ATOM 0 H LYS A 955 13.169 -8.812 2.699 1.00 0.00 H new ATOM 0 HA LYS A 955 10.652 -8.814 1.276 1.00 0.00 H new ATOM 0 HB2 LYS A 955 10.192 -10.808 2.599 1.00 0.00 H new ATOM 0 HB3 LYS A 955 11.788 -10.907 1.882 1.00 0.00 H new ATOM 0 HG2 LYS A 955 12.826 -10.285 4.025 1.00 0.00 H new ATOM 0 HG3 LYS A 955 11.247 -10.074 4.756 1.00 0.00 H new ATOM 0 HD2 LYS A 955 10.728 -12.472 4.346 1.00 0.00 H new ATOM 0 HD3 LYS A 955 12.294 -12.688 3.591 1.00 0.00 H new ATOM 0 HE2 LYS A 955 11.836 -11.833 6.477 1.00 0.00 H new ATOM 0 HE3 LYS A 955 12.274 -13.448 5.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 14.258 -12.410 6.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 14.300 -12.391 4.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 13.906 -10.978 5.768 1.00 0.00 H new ATOM 924 N ASP A 956 9.070 -7.741 2.850 1.00 0.00 N ATOM 925 CA ASP A 956 8.153 -7.010 3.719 1.00 0.00 C ATOM 926 C ASP A 956 8.814 -5.759 4.289 1.00 0.00 C ATOM 927 O ASP A 956 8.603 -5.404 5.449 1.00 0.00 O ATOM 928 CB ASP A 956 7.669 -7.910 4.858 1.00 0.00 C ATOM 929 CG ASP A 956 6.909 -9.122 4.354 1.00 0.00 C ATOM 930 OD1 ASP A 956 7.499 -9.922 3.598 1.00 0.00 O ATOM 931 OD2 ASP A 956 5.723 -9.272 4.719 1.00 0.00 O ATOM 0 H ASP A 956 8.715 -7.906 1.908 1.00 0.00 H new ATOM 0 HA ASP A 956 7.297 -6.701 3.119 1.00 0.00 H new ATOM 0 HB2 ASP A 956 8.526 -8.240 5.446 1.00 0.00 H new ATOM 0 HB3 ASP A 956 7.028 -7.334 5.525 1.00 0.00 H new ATOM 936 N VAL A 957 9.614 -5.094 3.464 1.00 0.00 N ATOM 937 CA VAL A 957 10.308 -3.881 3.885 1.00 0.00 C ATOM 938 C VAL A 957 9.476 -2.633 3.629 1.00 0.00 C ATOM 939 O VAL A 957 9.533 -1.674 4.397 1.00 0.00 O ATOM 940 CB VAL A 957 11.667 -3.719 3.183 1.00 0.00 C ATOM 941 CG1 VAL A 957 12.651 -4.770 3.663 1.00 0.00 C ATOM 942 CG2 VAL A 957 11.504 -3.772 1.674 1.00 0.00 C ATOM 0 H VAL A 957 9.799 -5.373 2.500 1.00 0.00 H new ATOM 0 HA VAL A 957 10.471 -3.992 4.957 1.00 0.00 H new ATOM 0 HB VAL A 957 12.070 -2.740 3.443 1.00 0.00 H new ATOM 0 HG11 VAL A 957 13.605 -4.636 3.153 1.00 0.00 H new ATOM 0 HG12 VAL A 957 12.797 -4.667 4.738 1.00 0.00 H new ATOM 0 HG13 VAL A 957 12.259 -5.763 3.443 1.00 0.00 H new ATOM 0 HG21 VAL A 957 12.478 -3.655 1.199 1.00 0.00 H new ATOM 0 HG22 VAL A 957 11.073 -4.732 1.388 1.00 0.00 H new ATOM 0 HG23 VAL A 957 10.844 -2.967 1.351 1.00 0.00 H new ATOM 952 N CYS A 958 8.724 -2.641 2.540 1.00 0.00 N ATOM 953 CA CYS A 958 7.902 -1.489 2.182 1.00 0.00 C ATOM 954 C CYS A 958 6.683 -1.895 1.357 1.00 0.00 C ATOM 955 O CYS A 958 6.515 -1.450 0.221 1.00 0.00 O ATOM 956 CB CYS A 958 8.738 -0.464 1.410 1.00 0.00 C ATOM 957 SG CYS A 958 7.829 1.055 0.973 1.00 0.00 S ATOM 0 H CYS A 958 8.664 -3.425 1.891 1.00 0.00 H new ATOM 0 HA CYS A 958 7.542 -1.042 3.108 1.00 0.00 H new ATOM 0 HB2 CYS A 958 9.608 -0.195 2.009 1.00 0.00 H new ATOM 0 HB3 CYS A 958 9.111 -0.928 0.497 1.00 0.00 H new ATOM 962 N LYS A 959 5.827 -2.730 1.938 1.00 0.00 N ATOM 963 CA LYS A 959 4.615 -3.174 1.258 1.00 0.00 C ATOM 964 C LYS A 959 3.775 -1.972 0.838 1.00 0.00 C ATOM 965 O LYS A 959 3.790 -0.934 1.503 1.00 0.00 O ATOM 966 CB LYS A 959 3.797 -4.099 2.162 1.00 0.00 C ATOM 967 CG LYS A 959 4.497 -5.409 2.488 1.00 0.00 C ATOM 968 CD LYS A 959 4.747 -6.236 1.236 1.00 0.00 C ATOM 969 CE LYS A 959 5.423 -7.556 1.564 1.00 0.00 C ATOM 970 NZ LYS A 959 5.669 -8.374 0.343 1.00 0.00 N ATOM 0 H LYS A 959 5.950 -3.112 2.876 1.00 0.00 H new ATOM 0 HA LYS A 959 4.905 -3.730 0.367 1.00 0.00 H new ATOM 0 HB2 LYS A 959 3.570 -3.577 3.092 1.00 0.00 H new ATOM 0 HB3 LYS A 959 2.845 -4.316 1.678 1.00 0.00 H new ATOM 0 HG2 LYS A 959 5.445 -5.202 2.984 1.00 0.00 H new ATOM 0 HG3 LYS A 959 3.890 -5.982 3.188 1.00 0.00 H new ATOM 0 HD2 LYS A 959 3.800 -6.427 0.730 1.00 0.00 H new ATOM 0 HD3 LYS A 959 5.370 -5.670 0.543 1.00 0.00 H new ATOM 0 HE2 LYS A 959 6.370 -7.363 2.068 1.00 0.00 H new ATOM 0 HE3 LYS A 959 4.801 -8.120 2.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 959 6.132 -9.266 0.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 959 4.763 -8.580 -0.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 959 6.284 -7.847 -0.310 1.00 0.00 H new ATOM 984 N ARG A 960 3.057 -2.105 -0.273 1.00 0.00 N ATOM 985 CA ARG A 960 2.230 -1.014 -0.776 1.00 0.00 C ATOM 986 C ARG A 960 1.241 -0.531 0.275 1.00 0.00 C ATOM 987 O ARG A 960 0.607 -1.332 0.963 1.00 0.00 O ATOM 988 CB ARG A 960 1.450 -1.433 -2.022 1.00 0.00 C ATOM 989 CG ARG A 960 0.693 -0.274 -2.651 1.00 0.00 C ATOM 990 CD ARG A 960 -0.235 -0.714 -3.773 1.00 0.00 C ATOM 991 NE ARG A 960 0.483 -1.294 -4.908 1.00 0.00 N ATOM 992 CZ ARG A 960 0.906 -2.556 -4.960 1.00 0.00 C ATOM 993 NH1 ARG A 960 0.625 -3.399 -3.975 1.00 0.00 N ATOM 994 NH2 ARG A 960 1.592 -2.982 -6.012 1.00 0.00 N ATOM 0 H ARG A 960 3.031 -2.953 -0.839 1.00 0.00 H new ATOM 0 HA ARG A 960 2.913 -0.203 -1.030 1.00 0.00 H new ATOM 0 HB2 ARG A 960 2.139 -1.853 -2.754 1.00 0.00 H new ATOM 0 HB3 ARG A 960 0.746 -2.222 -1.758 1.00 0.00 H new ATOM 0 HG2 ARG A 960 0.110 0.233 -1.882 1.00 0.00 H new ATOM 0 HG3 ARG A 960 1.407 0.452 -3.040 1.00 0.00 H new ATOM 0 HD2 ARG A 960 -0.945 -1.445 -3.386 1.00 0.00 H new ATOM 0 HD3 ARG A 960 -0.815 0.143 -4.115 1.00 0.00 H new ATOM 0 HE ARG A 960 0.672 -0.694 -5.711 1.00 0.00 H new ATOM 0 HH11 ARG A 960 0.082 -3.082 -3.172 1.00 0.00 H new ATOM 0 HH12 ARG A 960 0.952 -4.364 -4.021 1.00 0.00 H new ATOM 0 HH21 ARG A 960 1.796 -2.343 -6.781 1.00 0.00 H new ATOM 0 HH22 ARG A 960 1.916 -3.948 -6.052 1.00 0.00 H new ATOM 1008 N LYS A 961 1.103 0.785 0.372 1.00 0.00 N ATOM 1009 CA LYS A 961 0.179 1.392 1.310 1.00 0.00 C ATOM 1010 C LYS A 961 -1.228 0.853 1.065 1.00 0.00 C ATOM 1011 O LYS A 961 -1.607 0.598 -0.078 1.00 0.00 O ATOM 1012 CB LYS A 961 0.203 2.914 1.138 1.00 0.00 C ATOM 1013 CG LYS A 961 -0.137 3.690 2.400 1.00 0.00 C ATOM 1014 CD LYS A 961 -1.574 3.477 2.832 1.00 0.00 C ATOM 1015 CE LYS A 961 -1.809 4.021 4.227 1.00 0.00 C ATOM 1016 NZ LYS A 961 -3.200 3.771 4.697 1.00 0.00 N ATOM 0 H LYS A 961 1.626 1.454 -0.194 1.00 0.00 H new ATOM 0 HA LYS A 961 0.477 1.146 2.329 1.00 0.00 H new ATOM 0 HB2 LYS A 961 1.194 3.214 0.796 1.00 0.00 H new ATOM 0 HB3 LYS A 961 -0.502 3.191 0.354 1.00 0.00 H new ATOM 0 HG2 LYS A 961 0.532 3.384 3.204 1.00 0.00 H new ATOM 0 HG3 LYS A 961 0.036 4.753 2.229 1.00 0.00 H new ATOM 0 HD2 LYS A 961 -2.246 3.969 2.128 1.00 0.00 H new ATOM 0 HD3 LYS A 961 -1.811 2.413 2.808 1.00 0.00 H new ATOM 0 HE2 LYS A 961 -1.104 3.560 4.919 1.00 0.00 H new ATOM 0 HE3 LYS A 961 -1.610 5.093 4.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 -3.180 3.454 5.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 -3.754 4.648 4.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 -3.639 3.035 4.107 1.00 0.00 H new ATOM 1030 N SER A 962 -1.997 0.676 2.131 1.00 0.00 N ATOM 1031 CA SER A 962 -3.353 0.163 2.004 1.00 0.00 C ATOM 1032 C SER A 962 -4.309 0.907 2.926 1.00 0.00 C ATOM 1033 O SER A 962 -3.994 1.178 4.085 1.00 0.00 O ATOM 1034 CB SER A 962 -3.394 -1.334 2.315 1.00 0.00 C ATOM 1035 OG SER A 962 -4.710 -1.845 2.194 1.00 0.00 O ATOM 0 H SER A 962 -1.707 0.879 3.088 1.00 0.00 H new ATOM 0 HA SER A 962 -3.671 0.321 0.974 1.00 0.00 H new ATOM 0 HB2 SER A 962 -2.730 -1.868 1.636 1.00 0.00 H new ATOM 0 HB3 SER A 962 -3.024 -1.509 3.325 1.00 0.00 H new ATOM 0 HG SER A 962 -5.194 -1.344 1.505 1.00 0.00 H new ATOM 1041 N CYS A 963 -5.481 1.228 2.394 1.00 0.00 N ATOM 1042 CA CYS A 963 -6.506 1.937 3.145 1.00 0.00 C ATOM 1043 C CYS A 963 -7.255 0.980 4.067 1.00 0.00 C ATOM 1044 O CYS A 963 -7.401 -0.203 3.761 1.00 0.00 O ATOM 1045 CB CYS A 963 -7.468 2.624 2.176 1.00 0.00 C ATOM 1046 SG CYS A 963 -7.874 1.614 0.714 1.00 0.00 S ATOM 0 H CYS A 963 -5.746 1.005 1.435 1.00 0.00 H new ATOM 0 HA CYS A 963 -6.032 2.696 3.767 1.00 0.00 H new ATOM 0 HB2 CYS A 963 -8.389 2.870 2.705 1.00 0.00 H new ATOM 0 HB3 CYS A 963 -7.028 3.565 1.846 1.00 0.00 H new ATOM 1051 N LYS A 964 -7.708 1.496 5.205 1.00 0.00 N ATOM 1052 CA LYS A 964 -8.419 0.679 6.183 1.00 0.00 C ATOM 1053 C LYS A 964 -9.749 0.185 5.629 1.00 0.00 C ATOM 1054 O LYS A 964 -10.473 0.922 4.960 1.00 0.00 O ATOM 1055 CB LYS A 964 -8.663 1.476 7.467 1.00 0.00 C ATOM 1056 CG LYS A 964 -9.281 0.656 8.591 1.00 0.00 C ATOM 1057 CD LYS A 964 -8.371 -0.482 9.022 1.00 0.00 C ATOM 1058 CE LYS A 964 -8.980 -1.278 10.165 1.00 0.00 C ATOM 1059 NZ LYS A 964 -8.095 -2.394 10.600 1.00 0.00 N ATOM 0 H LYS A 964 -7.596 2.474 5.473 1.00 0.00 H new ATOM 0 HA LYS A 964 -7.795 -0.186 6.406 1.00 0.00 H new ATOM 0 HB2 LYS A 964 -7.716 1.891 7.811 1.00 0.00 H new ATOM 0 HB3 LYS A 964 -9.317 2.318 7.242 1.00 0.00 H new ATOM 0 HG2 LYS A 964 -9.484 1.303 9.444 1.00 0.00 H new ATOM 0 HG3 LYS A 964 -10.239 0.252 8.263 1.00 0.00 H new ATOM 0 HD2 LYS A 964 -8.186 -1.143 8.175 1.00 0.00 H new ATOM 0 HD3 LYS A 964 -7.405 -0.081 9.330 1.00 0.00 H new ATOM 0 HE2 LYS A 964 -9.169 -0.615 11.009 1.00 0.00 H new ATOM 0 HE3 LYS A 964 -9.944 -1.680 9.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 -8.547 -2.911 11.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 -7.935 -3.042 9.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 -7.184 -2.009 10.921 1.00 0.00 H new ATOM 1073 N THR A 965 -10.058 -1.073 5.921 1.00 0.00 N ATOM 1074 CA THR A 965 -11.295 -1.690 5.467 1.00 0.00 C ATOM 1075 C THR A 965 -12.513 -0.916 5.965 1.00 0.00 C ATOM 1076 O THR A 965 -12.573 -0.525 7.131 1.00 0.00 O ATOM 1077 CB THR A 965 -11.395 -3.143 5.964 1.00 0.00 C ATOM 1078 OG1 THR A 965 -10.246 -3.887 5.539 1.00 0.00 O ATOM 1079 CG2 THR A 965 -12.656 -3.817 5.445 1.00 0.00 C ATOM 0 H THR A 965 -9.462 -1.689 6.475 1.00 0.00 H new ATOM 0 HA THR A 965 -11.281 -1.675 4.377 1.00 0.00 H new ATOM 0 HB THR A 965 -11.438 -3.123 7.053 1.00 0.00 H new ATOM 0 HG1 THR A 965 -10.317 -4.810 5.861 1.00 0.00 H new ATOM 0 HG21 THR A 965 -12.698 -4.842 5.813 1.00 0.00 H new ATOM 0 HG22 THR A 965 -13.531 -3.270 5.794 1.00 0.00 H new ATOM 0 HG23 THR A 965 -12.643 -3.823 4.355 1.00 0.00 H new ATOM 1087 N PRO A 966 -13.507 -0.692 5.087 1.00 0.00 N ATOM 1088 CA PRO A 966 -14.729 0.031 5.451 1.00 0.00 C ATOM 1089 C PRO A 966 -15.400 -0.568 6.683 1.00 0.00 C ATOM 1090 O PRO A 966 -15.332 -1.777 6.905 1.00 0.00 O ATOM 1091 CB PRO A 966 -15.627 -0.137 4.223 1.00 0.00 C ATOM 1092 CG PRO A 966 -14.688 -0.388 3.095 1.00 0.00 C ATOM 1093 CD PRO A 966 -13.521 -1.129 3.680 1.00 0.00 C ATOM 0 HA PRO A 966 -14.527 1.072 5.705 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -16.321 -0.967 4.352 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -16.227 0.756 4.047 1.00 0.00 H new ATOM 0 HG2 PRO A 966 -15.168 -0.974 2.311 1.00 0.00 H new ATOM 0 HG3 PRO A 966 -14.366 0.549 2.640 1.00 0.00 H new ATOM 0 HD2 PRO A 966 -13.648 -2.208 3.596 1.00 0.00 H new ATOM 0 HD3 PRO A 966 -12.590 -0.877 3.172 1.00 0.00 H new ATOM 1101 N PRO A 967 -16.043 0.275 7.513 1.00 0.00 N ATOM 1102 CA PRO A 967 -16.722 -0.170 8.737 1.00 0.00 C ATOM 1103 C PRO A 967 -18.012 -0.935 8.450 1.00 0.00 C ATOM 1104 O PRO A 967 -19.039 -0.680 9.077 1.00 0.00 O ATOM 1105 CB PRO A 967 -17.032 1.138 9.482 1.00 0.00 C ATOM 1106 CG PRO A 967 -16.283 2.207 8.754 1.00 0.00 C ATOM 1107 CD PRO A 967 -16.153 1.727 7.339 1.00 0.00 C ATOM 0 HA PRO A 967 -16.102 -0.863 9.306 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -18.103 1.343 9.484 1.00 0.00 H new ATOM 0 HB3 PRO A 967 -16.716 1.079 10.524 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -16.817 3.156 8.797 1.00 0.00 H new ATOM 0 HG3 PRO A 967 -15.303 2.372 9.202 1.00 0.00 H new ATOM 0 HD2 PRO A 967 -17.018 2.000 6.735 1.00 0.00 H new ATOM 0 HD3 PRO A 967 -15.276 2.146 6.846 1.00 0.00 H new ATOM 1115 N ASP A 968 -17.933 -1.873 7.502 1.00 0.00 N ATOM 1116 CA ASP A 968 -19.068 -2.708 7.096 1.00 0.00 C ATOM 1117 C ASP A 968 -20.415 -2.072 7.442 1.00 0.00 C ATOM 1118 O ASP A 968 -20.897 -2.194 8.570 1.00 0.00 O ATOM 1119 CB ASP A 968 -18.961 -4.087 7.752 1.00 0.00 C ATOM 1120 CG ASP A 968 -20.063 -5.032 7.309 1.00 0.00 C ATOM 1121 OD1 ASP A 968 -21.247 -4.731 7.567 1.00 0.00 O ATOM 1122 OD2 ASP A 968 -19.740 -6.076 6.703 1.00 0.00 O ATOM 0 H ASP A 968 -17.074 -2.076 6.991 1.00 0.00 H new ATOM 0 HA ASP A 968 -19.025 -2.806 6.011 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -17.993 -4.526 7.511 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -18.999 -3.974 8.835 1.00 0.00 H new ATOM 1127 N PRO A 969 -21.054 -1.404 6.467 1.00 0.00 N ATOM 1128 CA PRO A 969 -22.359 -0.767 6.673 1.00 0.00 C ATOM 1129 C PRO A 969 -23.422 -1.781 7.071 1.00 0.00 C ATOM 1130 O PRO A 969 -23.398 -2.926 6.619 1.00 0.00 O ATOM 1131 CB PRO A 969 -22.687 -0.148 5.309 1.00 0.00 C ATOM 1132 CG PRO A 969 -21.821 -0.870 4.336 1.00 0.00 C ATOM 1133 CD PRO A 969 -20.571 -1.231 5.086 1.00 0.00 C ATOM 0 HA PRO A 969 -22.335 -0.035 7.480 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -23.742 -0.271 5.064 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -22.480 0.922 5.302 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -22.320 -1.762 3.956 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -21.592 -0.241 3.475 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -20.117 -2.144 4.699 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -19.818 -0.446 5.017 1.00 0.00 H new ATOM 1141 N VAL A 970 -24.346 -1.358 7.925 1.00 0.00 N ATOM 1142 CA VAL A 970 -25.410 -2.226 8.391 1.00 0.00 C ATOM 1143 C VAL A 970 -26.060 -2.969 7.230 1.00 0.00 C ATOM 1144 O VAL A 970 -26.556 -2.350 6.287 1.00 0.00 O ATOM 1145 CB VAL A 970 -26.476 -1.409 9.136 1.00 0.00 C ATOM 1146 CG1 VAL A 970 -27.495 -2.328 9.770 1.00 0.00 C ATOM 1147 CG2 VAL A 970 -25.827 -0.513 10.179 1.00 0.00 C ATOM 0 H VAL A 970 -24.376 -0.413 8.308 1.00 0.00 H new ATOM 0 HA VAL A 970 -24.971 -2.956 9.070 1.00 0.00 H new ATOM 0 HB VAL A 970 -26.993 -0.772 8.418 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -28.244 -1.734 10.294 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -27.980 -2.923 8.996 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -26.997 -2.991 10.478 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -26.597 0.059 10.697 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -25.284 -1.126 10.898 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -25.134 0.172 9.690 1.00 0.00 H new ATOM 1157 N ASN A 971 -26.044 -4.302 7.310 1.00 0.00 N ATOM 1158 CA ASN A 971 -26.619 -5.160 6.273 1.00 0.00 C ATOM 1159 C ASN A 971 -25.713 -5.217 5.042 1.00 0.00 C ATOM 1160 O ASN A 971 -25.499 -6.285 4.467 1.00 0.00 O ATOM 1161 CB ASN A 971 -28.018 -4.675 5.877 1.00 0.00 C ATOM 1162 CG ASN A 971 -28.971 -4.629 7.055 1.00 0.00 C ATOM 1163 OD1 ASN A 971 -29.236 -5.647 7.695 1.00 0.00 O ATOM 1164 ND2 ASN A 971 -29.491 -3.443 7.349 1.00 0.00 N ATOM 0 H ASN A 971 -25.634 -4.814 8.091 1.00 0.00 H new ATOM 0 HA ASN A 971 -26.703 -6.166 6.685 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -27.943 -3.681 5.435 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -28.424 -5.335 5.110 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -30.138 -3.350 8.132 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -29.244 -2.625 6.792 1.00 0.00 H new ATOM 1171 N GLY A 972 -25.188 -4.062 4.643 1.00 0.00 N ATOM 1172 CA GLY A 972 -24.313 -3.995 3.486 1.00 0.00 C ATOM 1173 C GLY A 972 -22.937 -4.582 3.745 1.00 0.00 C ATOM 1174 O GLY A 972 -22.447 -4.559 4.873 1.00 0.00 O ATOM 0 H GLY A 972 -25.354 -3.167 5.103 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -24.778 -4.526 2.655 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -24.206 -2.955 3.179 1.00 0.00 H new ATOM 1178 N MET A 973 -22.312 -5.100 2.692 1.00 0.00 N ATOM 1179 CA MET A 973 -20.981 -5.690 2.797 1.00 0.00 C ATOM 1180 C MET A 973 -20.189 -5.457 1.516 1.00 0.00 C ATOM 1181 O MET A 973 -20.695 -5.674 0.414 1.00 0.00 O ATOM 1182 CB MET A 973 -21.079 -7.189 3.086 1.00 0.00 C ATOM 1183 CG MET A 973 -21.654 -7.508 4.455 1.00 0.00 C ATOM 1184 SD MET A 973 -21.791 -9.280 4.757 1.00 0.00 S ATOM 1185 CE MET A 973 -22.903 -9.764 3.439 1.00 0.00 C ATOM 0 H MET A 973 -22.708 -5.123 1.752 1.00 0.00 H new ATOM 0 HA MET A 973 -20.460 -5.207 3.624 1.00 0.00 H new ATOM 0 HB2 MET A 973 -21.699 -7.658 2.322 1.00 0.00 H new ATOM 0 HB3 MET A 973 -20.086 -7.632 3.006 1.00 0.00 H new ATOM 0 HG2 MET A 973 -21.023 -7.061 5.223 1.00 0.00 H new ATOM 0 HG3 MET A 973 -22.639 -7.051 4.546 1.00 0.00 H new ATOM 0 HE1 MET A 973 -23.376 -10.713 3.692 1.00 0.00 H new ATOM 0 HE2 MET A 973 -23.669 -8.999 3.310 1.00 0.00 H new ATOM 0 HE3 MET A 973 -22.341 -9.875 2.512 1.00 0.00 H new ATOM 1195 N VAL A 974 -18.949 -5.001 1.667 1.00 0.00 N ATOM 1196 CA VAL A 974 -18.097 -4.726 0.519 1.00 0.00 C ATOM 1197 C VAL A 974 -17.129 -5.871 0.241 1.00 0.00 C ATOM 1198 O VAL A 974 -16.410 -6.324 1.131 1.00 0.00 O ATOM 1199 CB VAL A 974 -17.281 -3.431 0.712 1.00 0.00 C ATOM 1200 CG1 VAL A 974 -16.313 -3.563 1.880 1.00 0.00 C ATOM 1201 CG2 VAL A 974 -16.526 -3.086 -0.560 1.00 0.00 C ATOM 0 H VAL A 974 -18.515 -4.815 2.571 1.00 0.00 H new ATOM 0 HA VAL A 974 -18.769 -4.609 -0.331 1.00 0.00 H new ATOM 0 HB VAL A 974 -17.978 -2.624 0.938 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -15.751 -2.636 1.993 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -16.871 -3.763 2.795 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -15.623 -4.385 1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -15.955 -2.170 -0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -15.846 -3.900 -0.811 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -17.234 -2.940 -1.375 1.00 0.00 H new ATOM 1211 N HIS A 975 -17.091 -6.308 -1.011 1.00 0.00 N ATOM 1212 CA HIS A 975 -16.180 -7.365 -1.416 1.00 0.00 C ATOM 1213 C HIS A 975 -14.913 -6.753 -2.003 1.00 0.00 C ATOM 1214 O HIS A 975 -14.968 -5.970 -2.958 1.00 0.00 O ATOM 1215 CB HIS A 975 -16.843 -8.321 -2.411 1.00 0.00 C ATOM 1216 CG HIS A 975 -17.939 -7.699 -3.217 1.00 0.00 C ATOM 1217 ND1 HIS A 975 -19.110 -7.233 -2.660 1.00 0.00 N ATOM 1218 CD2 HIS A 975 -18.044 -7.478 -4.546 1.00 0.00 C ATOM 1219 CE1 HIS A 975 -19.889 -6.754 -3.613 1.00 0.00 C ATOM 1220 NE2 HIS A 975 -19.265 -6.890 -4.768 1.00 0.00 N ATOM 0 H HIS A 975 -17.680 -5.946 -1.761 1.00 0.00 H new ATOM 0 HA HIS A 975 -15.914 -7.951 -0.537 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -16.082 -8.708 -3.089 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -17.247 -9.174 -1.865 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -17.304 -7.719 -5.295 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -20.870 -6.324 -3.471 1.00 0.00 H new ATOM 0 HE2 HIS A 975 -19.630 -6.605 -5.677 1.00 0.00 H new ATOM 1229 N VAL A 976 -13.780 -7.094 -1.402 1.00 0.00 N ATOM 1230 CA VAL A 976 -12.488 -6.570 -1.825 1.00 0.00 C ATOM 1231 C VAL A 976 -12.047 -7.135 -3.170 1.00 0.00 C ATOM 1232 O VAL A 976 -12.162 -8.333 -3.426 1.00 0.00 O ATOM 1233 CB VAL A 976 -11.406 -6.864 -0.770 1.00 0.00 C ATOM 1234 CG1 VAL A 976 -10.050 -6.352 -1.230 1.00 0.00 C ATOM 1235 CG2 VAL A 976 -11.796 -6.246 0.564 1.00 0.00 C ATOM 0 H VAL A 976 -13.731 -7.738 -0.612 1.00 0.00 H new ATOM 0 HA VAL A 976 -12.611 -5.492 -1.934 1.00 0.00 H new ATOM 0 HB VAL A 976 -11.328 -7.944 -0.642 1.00 0.00 H new ATOM 0 HG11 VAL A 976 -9.301 -6.571 -0.469 1.00 0.00 H new ATOM 0 HG12 VAL A 976 -9.773 -6.843 -2.163 1.00 0.00 H new ATOM 0 HG13 VAL A 976 -10.102 -5.275 -1.388 1.00 0.00 H new ATOM 0 HG21 VAL A 976 -11.024 -6.460 1.303 1.00 0.00 H new ATOM 0 HG22 VAL A 976 -11.899 -5.167 0.449 1.00 0.00 H new ATOM 0 HG23 VAL A 976 -12.744 -6.668 0.897 1.00 0.00 H new ATOM 1245 N ILE A 977 -11.525 -6.252 -4.015 1.00 0.00 N ATOM 1246 CA ILE A 977 -11.038 -6.633 -5.330 1.00 0.00 C ATOM 1247 C ILE A 977 -9.619 -7.176 -5.221 1.00 0.00 C ATOM 1248 O ILE A 977 -8.670 -6.581 -5.730 1.00 0.00 O ATOM 1249 CB ILE A 977 -11.075 -5.449 -6.318 1.00 0.00 C ATOM 1250 CG1 ILE A 977 -12.451 -4.787 -6.315 1.00 0.00 C ATOM 1251 CG2 ILE A 977 -10.740 -5.917 -7.718 1.00 0.00 C ATOM 1252 CD1 ILE A 977 -13.588 -5.720 -6.675 1.00 0.00 C ATOM 0 H ILE A 977 -11.429 -5.258 -3.806 1.00 0.00 H new ATOM 0 HA ILE A 977 -11.698 -7.409 -5.717 1.00 0.00 H new ATOM 0 HB ILE A 977 -10.331 -4.719 -5.998 1.00 0.00 H new ATOM 0 HG12 ILE A 977 -12.638 -4.368 -5.326 1.00 0.00 H new ATOM 0 HG13 ILE A 977 -12.443 -3.954 -7.018 1.00 0.00 H new ATOM 0 HG21 ILE A 977 -10.771 -5.069 -8.402 1.00 0.00 H new ATOM 0 HG22 ILE A 977 -9.741 -6.354 -7.726 1.00 0.00 H new ATOM 0 HG23 ILE A 977 -11.466 -6.665 -8.035 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -14.530 -5.172 -6.650 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -13.427 -6.120 -7.676 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -13.626 -6.541 -5.958 1.00 0.00 H new ATOM 1264 N THR A 978 -9.505 -8.307 -4.530 1.00 0.00 N ATOM 1265 CA THR A 978 -8.230 -8.995 -4.291 1.00 0.00 C ATOM 1266 C THR A 978 -7.400 -8.306 -3.216 1.00 0.00 C ATOM 1267 O THR A 978 -6.827 -8.972 -2.353 1.00 0.00 O ATOM 1268 CB THR A 978 -7.360 -9.110 -5.563 1.00 0.00 C ATOM 1269 OG1 THR A 978 -6.683 -7.874 -5.816 1.00 0.00 O ATOM 1270 CG2 THR A 978 -8.204 -9.476 -6.769 1.00 0.00 C ATOM 0 H THR A 978 -10.305 -8.782 -4.112 1.00 0.00 H new ATOM 0 HA THR A 978 -8.513 -9.994 -3.960 1.00 0.00 H new ATOM 0 HB THR A 978 -6.627 -9.899 -5.395 1.00 0.00 H new ATOM 0 HG1 THR A 978 -7.328 -7.206 -6.128 1.00 0.00 H new ATOM 0 HG21 THR A 978 -7.567 -9.550 -7.650 1.00 0.00 H new ATOM 0 HG22 THR A 978 -8.693 -10.434 -6.593 1.00 0.00 H new ATOM 0 HG23 THR A 978 -8.959 -8.707 -6.931 1.00 0.00 H new ATOM 1278 N ASP A 979 -7.321 -6.983 -3.266 1.00 0.00 N ATOM 1279 CA ASP A 979 -6.537 -6.247 -2.285 1.00 0.00 C ATOM 1280 C ASP A 979 -6.998 -4.798 -2.167 1.00 0.00 C ATOM 1281 O ASP A 979 -7.234 -4.128 -3.170 1.00 0.00 O ATOM 1282 CB ASP A 979 -5.055 -6.302 -2.662 1.00 0.00 C ATOM 1283 CG ASP A 979 -4.784 -5.799 -4.069 1.00 0.00 C ATOM 1284 OD1 ASP A 979 -5.751 -5.445 -4.774 1.00 0.00 O ATOM 1285 OD2 ASP A 979 -3.600 -5.766 -4.467 1.00 0.00 O ATOM 0 H ASP A 979 -7.784 -6.404 -3.966 1.00 0.00 H new ATOM 0 HA ASP A 979 -6.684 -6.718 -1.313 1.00 0.00 H new ATOM 0 HB2 ASP A 979 -4.482 -5.706 -1.952 1.00 0.00 H new ATOM 0 HB3 ASP A 979 -4.701 -7.329 -2.574 1.00 0.00 H new ATOM 1290 N ILE A 980 -7.123 -4.318 -0.932 1.00 0.00 N ATOM 1291 CA ILE A 980 -7.553 -2.947 -0.692 1.00 0.00 C ATOM 1292 C ILE A 980 -6.365 -1.990 -0.656 1.00 0.00 C ATOM 1293 O ILE A 980 -6.426 -0.934 -0.026 1.00 0.00 O ATOM 1294 CB ILE A 980 -8.348 -2.817 0.622 1.00 0.00 C ATOM 1295 CG1 ILE A 980 -7.556 -3.403 1.792 1.00 0.00 C ATOM 1296 CG2 ILE A 980 -9.700 -3.501 0.490 1.00 0.00 C ATOM 1297 CD1 ILE A 980 -8.279 -3.303 3.120 1.00 0.00 C ATOM 0 H ILE A 980 -6.933 -4.857 -0.087 1.00 0.00 H new ATOM 0 HA ILE A 980 -8.205 -2.679 -1.523 1.00 0.00 H new ATOM 0 HB ILE A 980 -8.515 -1.759 0.823 1.00 0.00 H new ATOM 0 HG12 ILE A 980 -7.337 -4.450 1.584 1.00 0.00 H new ATOM 0 HG13 ILE A 980 -6.599 -2.886 1.868 1.00 0.00 H new ATOM 0 HG21 ILE A 980 -10.251 -3.402 1.425 1.00 0.00 H new ATOM 0 HG22 ILE A 980 -10.266 -3.035 -0.316 1.00 0.00 H new ATOM 0 HG23 ILE A 980 -9.553 -4.558 0.266 1.00 0.00 H new ATOM 0 HD11 ILE A 980 -7.660 -3.738 3.905 1.00 0.00 H new ATOM 0 HD12 ILE A 980 -8.474 -2.256 3.350 1.00 0.00 H new ATOM 0 HD13 ILE A 980 -9.224 -3.844 3.062 1.00 0.00 H new ATOM 1309 N GLN A 981 -5.290 -2.355 -1.349 1.00 0.00 N ATOM 1310 CA GLN A 981 -4.100 -1.513 -1.409 1.00 0.00 C ATOM 1311 C GLN A 981 -4.328 -0.349 -2.361 1.00 0.00 C ATOM 1312 O GLN A 981 -5.037 -0.488 -3.359 1.00 0.00 O ATOM 1313 CB GLN A 981 -2.875 -2.317 -1.850 1.00 0.00 C ATOM 1314 CG GLN A 981 -2.408 -3.336 -0.824 1.00 0.00 C ATOM 1315 CD GLN A 981 -1.130 -4.039 -1.236 1.00 0.00 C ATOM 1316 OE1 GLN A 981 -1.082 -4.713 -2.264 1.00 0.00 O ATOM 1317 NE2 GLN A 981 -0.084 -3.882 -0.433 1.00 0.00 N ATOM 0 H GLN A 981 -5.219 -3.226 -1.875 1.00 0.00 H new ATOM 0 HA GLN A 981 -3.911 -1.126 -0.408 1.00 0.00 H new ATOM 0 HB2 GLN A 981 -3.107 -2.833 -2.781 1.00 0.00 H new ATOM 0 HB3 GLN A 981 -2.057 -1.628 -2.062 1.00 0.00 H new ATOM 0 HG2 GLN A 981 -2.251 -2.837 0.132 1.00 0.00 H new ATOM 0 HG3 GLN A 981 -3.192 -4.077 -0.671 1.00 0.00 H new ATOM 0 HE21 GLN A 981 -0.169 -3.314 0.410 1.00 0.00 H new ATOM 0 HE22 GLN A 981 0.804 -4.330 -0.659 1.00 0.00 H new ATOM 1326 N VAL A 982 -3.734 0.798 -2.049 1.00 0.00 N ATOM 1327 CA VAL A 982 -3.884 1.983 -2.886 1.00 0.00 C ATOM 1328 C VAL A 982 -3.597 1.658 -4.349 1.00 0.00 C ATOM 1329 O VAL A 982 -2.443 1.613 -4.777 1.00 0.00 O ATOM 1330 CB VAL A 982 -2.956 3.122 -2.424 1.00 0.00 C ATOM 1331 CG1 VAL A 982 -3.009 4.283 -3.402 1.00 0.00 C ATOM 1332 CG2 VAL A 982 -3.331 3.580 -1.023 1.00 0.00 C ATOM 0 H VAL A 982 -3.146 0.932 -1.226 1.00 0.00 H new ATOM 0 HA VAL A 982 -4.918 2.314 -2.788 1.00 0.00 H new ATOM 0 HB VAL A 982 -1.934 2.745 -2.398 1.00 0.00 H new ATOM 0 HG11 VAL A 982 -2.347 5.078 -3.059 1.00 0.00 H new ATOM 0 HG12 VAL A 982 -2.689 3.944 -4.387 1.00 0.00 H new ATOM 0 HG13 VAL A 982 -4.029 4.661 -3.463 1.00 0.00 H new ATOM 0 HG21 VAL A 982 -2.665 4.385 -0.713 1.00 0.00 H new ATOM 0 HG22 VAL A 982 -4.360 3.939 -1.021 1.00 0.00 H new ATOM 0 HG23 VAL A 982 -3.237 2.744 -0.330 1.00 0.00 H new ATOM 1342 N GLY A 983 -4.666 1.433 -5.103 1.00 0.00 N ATOM 1343 CA GLY A 983 -4.541 1.111 -6.511 1.00 0.00 C ATOM 1344 C GLY A 983 -5.845 0.592 -7.081 1.00 0.00 C ATOM 1345 O GLY A 983 -6.431 1.206 -7.972 1.00 0.00 O ATOM 0 H GLY A 983 -5.626 1.468 -4.760 1.00 0.00 H new ATOM 0 HA2 GLY A 983 -4.230 1.999 -7.062 1.00 0.00 H new ATOM 0 HA3 GLY A 983 -3.760 0.362 -6.646 1.00 0.00 H new ATOM 1349 N SER A 984 -6.310 -0.536 -6.549 1.00 0.00 N ATOM 1350 CA SER A 984 -7.564 -1.127 -6.991 1.00 0.00 C ATOM 1351 C SER A 984 -8.738 -0.440 -6.310 1.00 0.00 C ATOM 1352 O SER A 984 -8.668 0.740 -5.963 1.00 0.00 O ATOM 1353 CB SER A 984 -7.576 -2.626 -6.685 1.00 0.00 C ATOM 1354 OG SER A 984 -7.461 -2.862 -5.295 1.00 0.00 O ATOM 0 H SER A 984 -5.835 -1.057 -5.812 1.00 0.00 H new ATOM 0 HA SER A 984 -7.657 -0.989 -8.068 1.00 0.00 H new ATOM 0 HB2 SER A 984 -8.500 -3.069 -7.057 1.00 0.00 H new ATOM 0 HB3 SER A 984 -6.754 -3.114 -7.209 1.00 0.00 H new ATOM 0 HG SER A 984 -7.129 -3.771 -5.144 1.00 0.00 H new ATOM 1360 N ARG A 985 -9.810 -1.188 -6.110 1.00 0.00 N ATOM 1361 CA ARG A 985 -10.999 -0.657 -5.460 1.00 0.00 C ATOM 1362 C ARG A 985 -11.759 -1.761 -4.731 1.00 0.00 C ATOM 1363 O ARG A 985 -11.238 -2.857 -4.528 1.00 0.00 O ATOM 1364 CB ARG A 985 -11.910 0.013 -6.492 1.00 0.00 C ATOM 1365 CG ARG A 985 -12.422 -0.937 -7.562 1.00 0.00 C ATOM 1366 CD ARG A 985 -13.313 -0.219 -8.564 1.00 0.00 C ATOM 1367 NE ARG A 985 -12.592 0.819 -9.298 1.00 0.00 N ATOM 1368 CZ ARG A 985 -11.579 0.573 -10.124 1.00 0.00 C ATOM 1369 NH1 ARG A 985 -11.177 -0.673 -10.337 1.00 0.00 N ATOM 1370 NH2 ARG A 985 -10.970 1.575 -10.745 1.00 0.00 N ATOM 0 H ARG A 985 -9.883 -2.167 -6.388 1.00 0.00 H new ATOM 0 HA ARG A 985 -10.684 0.085 -4.727 1.00 0.00 H new ATOM 0 HB2 ARG A 985 -12.761 0.459 -5.977 1.00 0.00 H new ATOM 0 HB3 ARG A 985 -11.365 0.826 -6.971 1.00 0.00 H new ATOM 0 HG2 ARG A 985 -11.578 -1.389 -8.083 1.00 0.00 H new ATOM 0 HG3 ARG A 985 -12.979 -1.748 -7.094 1.00 0.00 H new ATOM 0 HD2 ARG A 985 -13.721 -0.943 -9.269 1.00 0.00 H new ATOM 0 HD3 ARG A 985 -14.158 0.228 -8.041 1.00 0.00 H new ATOM 0 HE ARG A 985 -12.883 1.788 -9.169 1.00 0.00 H new ATOM 0 HH11 ARG A 985 -11.645 -1.447 -9.866 1.00 0.00 H new ATOM 0 HH12 ARG A 985 -10.400 -0.857 -10.971 1.00 0.00 H new ATOM 0 HH21 ARG A 985 -11.279 2.535 -10.589 1.00 0.00 H new ATOM 0 HH22 ARG A 985 -10.193 1.386 -11.378 1.00 0.00 H new ATOM 1384 N ILE A 986 -12.996 -1.462 -4.352 1.00 0.00 N ATOM 1385 CA ILE A 986 -13.849 -2.418 -3.658 1.00 0.00 C ATOM 1386 C ILE A 986 -15.308 -2.192 -4.033 1.00 0.00 C ATOM 1387 O ILE A 986 -15.795 -1.062 -4.007 1.00 0.00 O ATOM 1388 CB ILE A 986 -13.698 -2.319 -2.128 1.00 0.00 C ATOM 1389 CG1 ILE A 986 -13.929 -0.881 -1.660 1.00 0.00 C ATOM 1390 CG2 ILE A 986 -12.328 -2.819 -1.696 1.00 0.00 C ATOM 1391 CD1 ILE A 986 -13.869 -0.717 -0.158 1.00 0.00 C ATOM 0 H ILE A 986 -13.434 -0.555 -4.516 1.00 0.00 H new ATOM 0 HA ILE A 986 -13.534 -3.414 -3.968 1.00 0.00 H new ATOM 0 HB ILE A 986 -14.452 -2.952 -1.661 1.00 0.00 H new ATOM 0 HG12 ILE A 986 -13.181 -0.234 -2.118 1.00 0.00 H new ATOM 0 HG13 ILE A 986 -14.903 -0.544 -2.015 1.00 0.00 H new ATOM 0 HG21 ILE A 986 -12.238 -2.742 -0.612 1.00 0.00 H new ATOM 0 HG22 ILE A 986 -12.209 -3.860 -1.997 1.00 0.00 H new ATOM 0 HG23 ILE A 986 -11.554 -2.214 -2.168 1.00 0.00 H new ATOM 0 HD11 ILE A 986 -14.042 0.328 0.101 1.00 0.00 H new ATOM 0 HD12 ILE A 986 -14.635 -1.338 0.307 1.00 0.00 H new ATOM 0 HD13 ILE A 986 -12.887 -1.023 0.202 1.00 0.00 H new ATOM 1403 N THR A 987 -16.003 -3.266 -4.384 1.00 0.00 N ATOM 1404 CA THR A 987 -17.404 -3.161 -4.764 1.00 0.00 C ATOM 1405 C THR A 987 -18.325 -3.503 -3.603 1.00 0.00 C ATOM 1406 O THR A 987 -18.111 -4.485 -2.896 1.00 0.00 O ATOM 1407 CB THR A 987 -17.737 -4.049 -5.975 1.00 0.00 C ATOM 1408 OG1 THR A 987 -16.982 -5.263 -5.917 1.00 0.00 O ATOM 1409 CG2 THR A 987 -17.442 -3.315 -7.271 1.00 0.00 C ATOM 0 H THR A 987 -15.623 -4.212 -4.413 1.00 0.00 H new ATOM 0 HA THR A 987 -17.571 -2.121 -5.046 1.00 0.00 H new ATOM 0 HB THR A 987 -18.800 -4.289 -5.946 1.00 0.00 H new ATOM 0 HG1 THR A 987 -17.202 -5.822 -6.691 1.00 0.00 H new ATOM 0 HG21 THR A 987 -17.684 -3.959 -8.117 1.00 0.00 H new ATOM 0 HG22 THR A 987 -18.045 -2.408 -7.321 1.00 0.00 H new ATOM 0 HG23 THR A 987 -16.385 -3.050 -7.307 1.00 0.00 H new ATOM 1417 N TYR A 988 -19.343 -2.674 -3.409 1.00 0.00 N ATOM 1418 CA TYR A 988 -20.298 -2.876 -2.326 1.00 0.00 C ATOM 1419 C TYR A 988 -21.607 -3.461 -2.845 1.00 0.00 C ATOM 1420 O TYR A 988 -22.063 -3.118 -3.936 1.00 0.00 O ATOM 1421 CB TYR A 988 -20.590 -1.555 -1.604 1.00 0.00 C ATOM 1422 CG TYR A 988 -19.367 -0.844 -1.065 1.00 0.00 C ATOM 1423 CD1 TYR A 988 -18.396 -0.336 -1.920 1.00 0.00 C ATOM 1424 CD2 TYR A 988 -19.198 -0.660 0.300 1.00 0.00 C ATOM 1425 CE1 TYR A 988 -17.289 0.330 -1.426 1.00 0.00 C ATOM 1426 CE2 TYR A 988 -18.097 0.007 0.801 1.00 0.00 C ATOM 1427 CZ TYR A 988 -17.145 0.499 -0.066 1.00 0.00 C ATOM 1428 OH TYR A 988 -16.050 1.167 0.430 1.00 0.00 O ATOM 0 H TYR A 988 -19.529 -1.855 -3.988 1.00 0.00 H new ATOM 0 HA TYR A 988 -19.848 -3.580 -1.626 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -21.108 -0.887 -2.293 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -21.273 -1.752 -0.777 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -18.508 -0.463 -2.987 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -19.941 -1.045 0.983 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -16.541 0.716 -2.103 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -17.983 0.142 1.866 1.00 0.00 H new ATOM 0 HH TYR A 988 -16.102 1.199 1.408 1.00 0.00 H new ATOM 1438 N SER A 989 -22.214 -4.333 -2.048 1.00 0.00 N ATOM 1439 CA SER A 989 -23.482 -4.955 -2.415 1.00 0.00 C ATOM 1440 C SER A 989 -24.250 -5.374 -1.168 1.00 0.00 C ATOM 1441 O SER A 989 -23.717 -6.079 -0.309 1.00 0.00 O ATOM 1442 CB SER A 989 -23.245 -6.167 -3.316 1.00 0.00 C ATOM 1443 OG SER A 989 -24.469 -6.780 -3.681 1.00 0.00 O ATOM 0 H SER A 989 -21.848 -4.626 -1.142 1.00 0.00 H new ATOM 0 HA SER A 989 -24.075 -4.223 -2.963 1.00 0.00 H new ATOM 0 HB2 SER A 989 -22.708 -5.858 -4.213 1.00 0.00 H new ATOM 0 HB3 SER A 989 -22.613 -6.889 -2.800 1.00 0.00 H new ATOM 0 HG SER A 989 -24.289 -7.551 -4.258 1.00 0.00 H new ATOM 1449 N CYS A 990 -25.503 -4.940 -1.068 1.00 0.00 N ATOM 1450 CA CYS A 990 -26.332 -5.279 0.081 1.00 0.00 C ATOM 1451 C CYS A 990 -26.565 -6.784 0.142 1.00 0.00 C ATOM 1452 O CYS A 990 -26.360 -7.491 -0.845 1.00 0.00 O ATOM 1453 CB CYS A 990 -27.671 -4.542 0.032 1.00 0.00 C ATOM 1454 SG CYS A 990 -28.595 -4.618 1.599 1.00 0.00 S ATOM 0 H CYS A 990 -25.964 -4.356 -1.766 1.00 0.00 H new ATOM 0 HA CYS A 990 -25.803 -4.965 0.981 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -27.494 -3.498 -0.226 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -28.283 -4.968 -0.763 1.00 0.00 H new ATOM 1459 N THR A 991 -26.983 -7.273 1.304 1.00 0.00 N ATOM 1460 CA THR A 991 -27.226 -8.699 1.482 1.00 0.00 C ATOM 1461 C THR A 991 -28.373 -9.190 0.612 1.00 0.00 C ATOM 1462 O THR A 991 -28.219 -10.144 -0.152 1.00 0.00 O ATOM 1463 CB THR A 991 -27.512 -9.047 2.957 1.00 0.00 C ATOM 1464 OG1 THR A 991 -27.872 -10.429 3.074 1.00 0.00 O ATOM 1465 CG2 THR A 991 -28.624 -8.176 3.522 1.00 0.00 C ATOM 0 H THR A 991 -27.160 -6.706 2.133 1.00 0.00 H new ATOM 0 HA THR A 991 -26.313 -9.207 1.172 1.00 0.00 H new ATOM 0 HB THR A 991 -26.605 -8.858 3.530 1.00 0.00 H new ATOM 0 HG1 THR A 991 -28.050 -10.642 4.014 1.00 0.00 H new ATOM 0 HG21 THR A 991 -28.803 -8.444 4.563 1.00 0.00 H new ATOM 0 HG22 THR A 991 -28.331 -7.128 3.463 1.00 0.00 H new ATOM 0 HG23 THR A 991 -29.536 -8.331 2.945 1.00 0.00 H new ATOM 1473 N THR A 992 -29.514 -8.532 0.734 1.00 0.00 N ATOM 1474 CA THR A 992 -30.699 -8.893 -0.037 1.00 0.00 C ATOM 1475 C THR A 992 -31.925 -8.087 0.388 1.00 0.00 C ATOM 1476 O THR A 992 -32.077 -7.741 1.560 1.00 0.00 O ATOM 1477 CB THR A 992 -31.018 -10.389 0.113 1.00 0.00 C ATOM 1478 OG1 THR A 992 -32.105 -10.752 -0.746 1.00 0.00 O ATOM 1479 CG2 THR A 992 -31.371 -10.728 1.554 1.00 0.00 C ATOM 0 H THR A 992 -29.648 -7.740 1.363 1.00 0.00 H new ATOM 0 HA THR A 992 -30.471 -8.665 -1.078 1.00 0.00 H new ATOM 0 HB THR A 992 -30.129 -10.953 -0.170 1.00 0.00 H new ATOM 0 HG1 THR A 992 -32.298 -11.707 -0.643 1.00 0.00 H new ATOM 0 HG21 THR A 992 -31.593 -11.792 1.634 1.00 0.00 H new ATOM 0 HG22 THR A 992 -30.529 -10.483 2.202 1.00 0.00 H new ATOM 0 HG23 THR A 992 -32.244 -10.152 1.860 1.00 0.00 H new ATOM 1487 N GLY A 993 -32.806 -7.813 -0.571 1.00 0.00 N ATOM 1488 CA GLY A 993 -34.023 -7.076 -0.282 1.00 0.00 C ATOM 1489 C GLY A 993 -33.849 -5.568 -0.302 1.00 0.00 C ATOM 1490 O GLY A 993 -34.718 -4.850 -0.795 1.00 0.00 O ATOM 0 H GLY A 993 -32.697 -8.090 -1.547 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -34.786 -7.353 -1.010 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -34.394 -7.376 0.698 1.00 0.00 H new ATOM 1494 N HIS A 994 -32.741 -5.080 0.245 1.00 0.00 N ATOM 1495 CA HIS A 994 -32.487 -3.646 0.291 1.00 0.00 C ATOM 1496 C HIS A 994 -31.522 -3.222 -0.809 1.00 0.00 C ATOM 1497 O HIS A 994 -30.579 -3.945 -1.135 1.00 0.00 O ATOM 1498 CB HIS A 994 -31.914 -3.257 1.655 1.00 0.00 C ATOM 1499 CG HIS A 994 -32.778 -3.659 2.812 1.00 0.00 C ATOM 1500 ND1 HIS A 994 -33.184 -4.958 3.033 1.00 0.00 N ATOM 1501 CD2 HIS A 994 -33.304 -2.926 3.822 1.00 0.00 C ATOM 1502 CE1 HIS A 994 -33.923 -5.006 4.127 1.00 0.00 C ATOM 1503 NE2 HIS A 994 -34.010 -3.786 4.623 1.00 0.00 N ATOM 0 H HIS A 994 -32.008 -5.654 0.661 1.00 0.00 H new ATOM 0 HA HIS A 994 -33.435 -3.132 0.134 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -30.932 -3.716 1.770 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -31.766 -2.177 1.682 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -33.189 -1.862 3.969 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -34.378 -5.892 4.544 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -34.520 -3.525 5.467 1.00 0.00 H new ATOM 1512 N ARG A 995 -31.756 -2.041 -1.366 1.00 0.00 N ATOM 1513 CA ARG A 995 -30.903 -1.508 -2.418 1.00 0.00 C ATOM 1514 C ARG A 995 -29.801 -0.650 -1.809 1.00 0.00 C ATOM 1515 O ARG A 995 -29.990 -0.043 -0.755 1.00 0.00 O ATOM 1516 CB ARG A 995 -31.727 -0.684 -3.410 1.00 0.00 C ATOM 1517 CG ARG A 995 -32.381 0.541 -2.793 1.00 0.00 C ATOM 1518 CD ARG A 995 -33.213 1.301 -3.814 1.00 0.00 C ATOM 1519 NE ARG A 995 -32.422 1.705 -4.973 1.00 0.00 N ATOM 1520 CZ ARG A 995 -32.915 2.387 -6.003 1.00 0.00 C ATOM 1521 NH1 ARG A 995 -34.190 2.751 -6.012 1.00 0.00 N ATOM 1522 NH2 ARG A 995 -32.132 2.707 -7.024 1.00 0.00 N ATOM 0 H ARG A 995 -32.532 -1.433 -1.105 1.00 0.00 H new ATOM 0 HA ARG A 995 -30.449 -2.341 -2.955 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -31.082 -0.366 -4.229 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -32.501 -1.319 -3.842 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -33.014 0.236 -1.960 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -31.613 1.199 -2.385 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -34.044 0.676 -4.142 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -33.645 2.185 -3.344 1.00 0.00 H new ATOM 0 HE ARG A 995 -31.435 1.450 -4.994 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -34.795 2.508 -5.228 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -34.565 3.274 -6.803 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -31.150 2.430 -7.020 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -32.511 3.230 -7.813 1.00 0.00 H new ATOM 1536 N LEU A 996 -28.645 -0.625 -2.460 1.00 0.00 N ATOM 1537 CA LEU A 996 -27.506 0.144 -1.971 1.00 0.00 C ATOM 1538 C LEU A 996 -27.733 1.645 -2.143 1.00 0.00 C ATOM 1539 O LEU A 996 -28.061 2.113 -3.234 1.00 0.00 O ATOM 1540 CB LEU A 996 -26.234 -0.290 -2.704 1.00 0.00 C ATOM 1541 CG LEU A 996 -24.931 0.302 -2.176 1.00 0.00 C ATOM 1542 CD1 LEU A 996 -23.779 -0.659 -2.419 1.00 0.00 C ATOM 1543 CD2 LEU A 996 -24.664 1.646 -2.823 1.00 0.00 C ATOM 0 H LEU A 996 -28.471 -1.129 -3.329 1.00 0.00 H new ATOM 0 HA LEU A 996 -27.393 -0.054 -0.905 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -26.163 -1.377 -2.658 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -26.333 -0.022 -3.756 1.00 0.00 H new ATOM 0 HG LEU A 996 -25.023 0.456 -1.101 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -22.855 -0.224 -2.037 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -23.976 -1.600 -1.906 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -23.678 -0.843 -3.489 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -23.731 2.057 -2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -24.586 1.521 -3.903 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -25.483 2.329 -2.595 1.00 0.00 H new ATOM 1555 N ILE A 997 -27.537 2.396 -1.060 1.00 0.00 N ATOM 1556 CA ILE A 997 -27.701 3.846 -1.090 1.00 0.00 C ATOM 1557 C ILE A 997 -26.366 4.548 -0.870 1.00 0.00 C ATOM 1558 O ILE A 997 -25.707 4.344 0.150 1.00 0.00 O ATOM 1559 CB ILE A 997 -28.711 4.334 -0.023 1.00 0.00 C ATOM 1560 CG1 ILE A 997 -30.146 4.143 -0.505 1.00 0.00 C ATOM 1561 CG2 ILE A 997 -28.478 5.788 0.328 1.00 0.00 C ATOM 1562 CD1 ILE A 997 -30.557 2.702 -0.593 1.00 0.00 C ATOM 0 H ILE A 997 -27.264 2.022 -0.151 1.00 0.00 H new ATOM 0 HA ILE A 997 -28.089 4.098 -2.077 1.00 0.00 H new ATOM 0 HB ILE A 997 -28.556 3.732 0.872 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -30.822 4.665 0.172 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -30.257 4.606 -1.486 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -29.203 6.102 1.080 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -27.470 5.910 0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -28.594 6.401 -0.566 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -31.588 2.638 -0.942 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -29.904 2.180 -1.292 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -30.478 2.240 0.391 1.00 0.00 H new ATOM 1574 N GLY A 998 -25.979 5.383 -1.827 1.00 0.00 N ATOM 1575 CA GLY A 998 -24.729 6.109 -1.713 1.00 0.00 C ATOM 1576 C GLY A 998 -23.881 6.020 -2.961 1.00 0.00 C ATOM 1577 O GLY A 998 -23.528 7.039 -3.554 1.00 0.00 O ATOM 0 H GLY A 998 -26.508 5.570 -2.679 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -24.941 7.156 -1.498 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -24.164 5.718 -0.867 1.00 0.00 H new ATOM 1581 N HIS A 999 -23.549 4.800 -3.356 1.00 0.00 N ATOM 1582 CA HIS A 999 -22.728 4.590 -4.541 1.00 0.00 C ATOM 1583 C HIS A 999 -22.837 3.150 -5.047 1.00 0.00 C ATOM 1584 O HIS A 999 -23.926 2.685 -5.383 1.00 0.00 O ATOM 1585 CB HIS A 999 -21.275 4.944 -4.231 1.00 0.00 C ATOM 1586 CG HIS A 999 -20.465 5.250 -5.449 1.00 0.00 C ATOM 1587 ND1 HIS A 999 -20.143 4.312 -6.407 1.00 0.00 N ATOM 1588 CD2 HIS A 999 -19.925 6.412 -5.865 1.00 0.00 C ATOM 1589 CE1 HIS A 999 -19.435 4.890 -7.362 1.00 0.00 C ATOM 1590 NE2 HIS A 999 -19.288 6.166 -7.056 1.00 0.00 N ATOM 0 H HIS A 999 -23.833 3.945 -2.878 1.00 0.00 H new ATOM 0 HA HIS A 999 -23.094 5.243 -5.333 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -21.253 5.806 -3.564 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -20.813 4.114 -3.696 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -19.983 7.362 -5.355 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -19.044 4.402 -8.242 1.00 0.00 H new ATOM 0 HE2 HIS A 999 -18.784 6.856 -7.613 1.00 0.00 H new ATOM 1599 N SER A1000 -21.697 2.457 -5.109 1.00 0.00 N ATOM 1600 CA SER A1000 -21.651 1.076 -5.579 1.00 0.00 C ATOM 1601 C SER A1000 -20.212 0.566 -5.603 1.00 0.00 C ATOM 1602 O SER A1000 -19.967 -0.639 -5.565 1.00 0.00 O ATOM 1603 CB SER A1000 -22.266 0.962 -6.976 1.00 0.00 C ATOM 1604 OG SER A1000 -21.577 1.776 -7.907 1.00 0.00 O ATOM 0 H SER A1000 -20.790 2.836 -4.837 1.00 0.00 H new ATOM 0 HA SER A1000 -22.231 0.464 -4.888 1.00 0.00 H new ATOM 0 HB2 SER A1000 -22.237 -0.077 -7.305 1.00 0.00 H new ATOM 0 HB3 SER A1000 -23.315 1.255 -6.939 1.00 0.00 H new ATOM 0 HG SER A1000 -21.080 2.472 -7.428 1.00 0.00 H new ATOM 1610 N SER A1001 -19.265 1.498 -5.676 1.00 0.00 N ATOM 1611 CA SER A1001 -17.846 1.157 -5.716 1.00 0.00 C ATOM 1612 C SER A1001 -16.996 2.314 -5.195 1.00 0.00 C ATOM 1613 O SER A1001 -17.443 3.460 -5.168 1.00 0.00 O ATOM 1614 CB SER A1001 -17.425 0.808 -7.144 1.00 0.00 C ATOM 1615 OG SER A1001 -18.170 -0.290 -7.642 1.00 0.00 O ATOM 0 H SER A1001 -19.456 2.499 -5.709 1.00 0.00 H new ATOM 0 HA SER A1001 -17.687 0.291 -5.074 1.00 0.00 H new ATOM 0 HB2 SER A1001 -17.570 1.673 -7.791 1.00 0.00 H new ATOM 0 HB3 SER A1001 -16.362 0.569 -7.165 1.00 0.00 H new ATOM 0 HG SER A1001 -17.883 -0.492 -8.557 1.00 0.00 H new ATOM 1621 N ALA A1002 -15.771 2.004 -4.778 1.00 0.00 N ATOM 1622 CA ALA A1002 -14.863 3.019 -4.255 1.00 0.00 C ATOM 1623 C ALA A1002 -13.408 2.626 -4.490 1.00 0.00 C ATOM 1624 O ALA A1002 -13.000 1.507 -4.179 1.00 0.00 O ATOM 1625 CB ALA A1002 -15.114 3.236 -2.771 1.00 0.00 C ATOM 0 H ALA A1002 -15.386 1.060 -4.792 1.00 0.00 H new ATOM 0 HA ALA A1002 -15.054 3.951 -4.787 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -14.430 3.996 -2.394 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -16.142 3.566 -2.620 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -14.951 2.302 -2.234 1.00 0.00 H new ATOM 1631 N GLU A1003 -12.633 3.554 -5.045 1.00 0.00 N ATOM 1632 CA GLU A1003 -11.223 3.304 -5.330 1.00 0.00 C ATOM 1633 C GLU A1003 -10.336 3.800 -4.197 1.00 0.00 C ATOM 1634 O GLU A1003 -10.514 4.912 -3.698 1.00 0.00 O ATOM 1635 CB GLU A1003 -10.814 3.995 -6.633 1.00 0.00 C ATOM 1636 CG GLU A1003 -9.417 3.624 -7.104 1.00 0.00 C ATOM 1637 CD GLU A1003 -9.036 4.313 -8.401 1.00 0.00 C ATOM 1638 OE1 GLU A1003 -9.865 5.082 -8.933 1.00 0.00 O ATOM 1639 OE2 GLU A1003 -7.908 4.083 -8.886 1.00 0.00 O ATOM 0 H GLU A1003 -12.957 4.485 -5.306 1.00 0.00 H new ATOM 0 HA GLU A1003 -11.092 2.227 -5.430 1.00 0.00 H new ATOM 0 HB2 GLU A1003 -11.532 3.738 -7.412 1.00 0.00 H new ATOM 0 HB3 GLU A1003 -10.867 5.075 -6.494 1.00 0.00 H new ATOM 0 HG2 GLU A1003 -8.695 3.888 -6.331 1.00 0.00 H new ATOM 0 HG3 GLU A1003 -9.358 2.544 -7.240 1.00 0.00 H new ATOM 1646 N CYS A1004 -9.368 2.978 -3.807 1.00 0.00 N ATOM 1647 CA CYS A1004 -8.441 3.347 -2.746 1.00 0.00 C ATOM 1648 C CYS A1004 -7.473 4.406 -3.265 1.00 0.00 C ATOM 1649 O CYS A1004 -6.769 4.180 -4.248 1.00 0.00 O ATOM 1650 CB CYS A1004 -7.666 2.115 -2.272 1.00 0.00 C ATOM 1651 SG CYS A1004 -6.692 2.372 -0.754 1.00 0.00 S ATOM 0 H CYS A1004 -9.206 2.055 -4.209 1.00 0.00 H new ATOM 0 HA CYS A1004 -9.001 3.751 -1.903 1.00 0.00 H new ATOM 0 HB2 CYS A1004 -8.371 1.301 -2.103 1.00 0.00 H new ATOM 0 HB3 CYS A1004 -6.995 1.795 -3.069 1.00 0.00 H new ATOM 1656 N ILE A1005 -7.445 5.566 -2.616 1.00 0.00 N ATOM 1657 CA ILE A1005 -6.561 6.642 -3.049 1.00 0.00 C ATOM 1658 C ILE A1005 -5.824 7.280 -1.886 1.00 0.00 C ATOM 1659 O ILE A1005 -6.376 7.460 -0.801 1.00 0.00 O ATOM 1660 CB ILE A1005 -7.326 7.734 -3.814 1.00 0.00 C ATOM 1661 CG1 ILE A1005 -8.512 8.234 -2.987 1.00 0.00 C ATOM 1662 CG2 ILE A1005 -7.781 7.200 -5.161 1.00 0.00 C ATOM 1663 CD1 ILE A1005 -9.236 9.408 -3.610 1.00 0.00 C ATOM 0 H ILE A1005 -8.016 5.783 -1.799 1.00 0.00 H new ATOM 0 HA ILE A1005 -5.833 6.179 -3.715 1.00 0.00 H new ATOM 0 HB ILE A1005 -6.662 8.580 -3.988 1.00 0.00 H new ATOM 0 HG12 ILE A1005 -9.218 7.415 -2.848 1.00 0.00 H new ATOM 0 HG13 ILE A1005 -8.158 8.521 -1.997 1.00 0.00 H new ATOM 0 HG21 ILE A1005 -8.322 7.979 -5.697 1.00 0.00 H new ATOM 0 HG22 ILE A1005 -6.912 6.895 -5.744 1.00 0.00 H new ATOM 0 HG23 ILE A1005 -8.436 6.342 -5.010 1.00 0.00 H new ATOM 0 HD11 ILE A1005 -10.064 9.707 -2.968 1.00 0.00 H new ATOM 0 HD12 ILE A1005 -8.545 10.243 -3.723 1.00 0.00 H new ATOM 0 HD13 ILE A1005 -9.621 9.120 -4.588 1.00 0.00 H new ATOM 1675 N LEU A1006 -4.567 7.623 -2.130 1.00 0.00 N ATOM 1676 CA LEU A1006 -3.730 8.248 -1.111 1.00 0.00 C ATOM 1677 C LEU A1006 -3.952 9.757 -1.070 1.00 0.00 C ATOM 1678 O LEU A1006 -3.909 10.429 -2.101 1.00 0.00 O ATOM 1679 CB LEU A1006 -2.254 7.954 -1.379 1.00 0.00 C ATOM 1680 CG LEU A1006 -1.289 8.529 -0.342 1.00 0.00 C ATOM 1681 CD1 LEU A1006 -1.473 7.836 1.000 1.00 0.00 C ATOM 1682 CD2 LEU A1006 0.150 8.395 -0.819 1.00 0.00 C ATOM 0 H LEU A1006 -4.102 7.479 -3.026 1.00 0.00 H new ATOM 0 HA LEU A1006 -4.011 7.828 -0.145 1.00 0.00 H new ATOM 0 HB2 LEU A1006 -2.115 6.874 -1.425 1.00 0.00 H new ATOM 0 HB3 LEU A1006 -1.991 8.351 -2.359 1.00 0.00 H new ATOM 0 HG LEU A1006 -1.512 9.588 -0.216 1.00 0.00 H new ATOM 0 HD11 LEU A1006 -0.778 8.258 1.726 1.00 0.00 H new ATOM 0 HD12 LEU A1006 -2.495 7.983 1.348 1.00 0.00 H new ATOM 0 HD13 LEU A1006 -1.278 6.769 0.889 1.00 0.00 H new ATOM 0 HD21 LEU A1006 0.822 8.810 -0.068 1.00 0.00 H new ATOM 0 HD22 LEU A1006 0.385 7.342 -0.975 1.00 0.00 H new ATOM 0 HD23 LEU A1006 0.275 8.937 -1.756 1.00 0.00 H new ATOM 1694 N SER A1007 -4.179 10.284 0.129 1.00 0.00 N ATOM 1695 CA SER A1007 -4.397 11.715 0.310 1.00 0.00 C ATOM 1696 C SER A1007 -3.098 12.413 0.707 1.00 0.00 C ATOM 1697 O SER A1007 -3.058 13.161 1.684 1.00 0.00 O ATOM 1698 CB SER A1007 -5.470 11.962 1.373 1.00 0.00 C ATOM 1699 OG SER A1007 -5.712 13.348 1.542 1.00 0.00 O ATOM 0 H SER A1007 -4.217 9.740 0.991 1.00 0.00 H new ATOM 0 HA SER A1007 -4.739 12.129 -0.639 1.00 0.00 H new ATOM 0 HB2 SER A1007 -6.394 11.461 1.085 1.00 0.00 H new ATOM 0 HB3 SER A1007 -5.154 11.527 2.321 1.00 0.00 H new ATOM 0 HG SER A1007 -4.871 13.803 1.754 1.00 0.00 H new ATOM 1705 N GLY A1008 -2.037 12.158 -0.052 1.00 0.00 N ATOM 1706 CA GLY A1008 -0.753 12.766 0.244 1.00 0.00 C ATOM 1707 C GLY A1008 0.006 12.021 1.325 1.00 0.00 C ATOM 1708 O GLY A1008 1.229 11.902 1.263 1.00 0.00 O ATOM 0 H GLY A1008 -2.043 11.542 -0.865 1.00 0.00 H new ATOM 0 HA2 GLY A1008 -0.151 12.796 -0.664 1.00 0.00 H new ATOM 0 HA3 GLY A1008 -0.907 13.798 0.558 1.00 0.00 H new ATOM 1712 N ASN A1009 -0.722 11.516 2.319 1.00 0.00 N ATOM 1713 CA ASN A1009 -0.111 10.776 3.418 1.00 0.00 C ATOM 1714 C ASN A1009 -1.057 9.698 3.934 1.00 0.00 C ATOM 1715 O ASN A1009 -0.675 8.536 4.068 1.00 0.00 O ATOM 1716 CB ASN A1009 0.252 11.723 4.563 1.00 0.00 C ATOM 1717 CG ASN A1009 1.179 12.840 4.125 1.00 0.00 C ATOM 1718 OD1 ASN A1009 2.289 12.591 3.655 1.00 0.00 O ATOM 1719 ND2 ASN A1009 0.728 14.079 4.281 1.00 0.00 N ATOM 0 H ASN A1009 -1.736 11.606 2.385 1.00 0.00 H new ATOM 0 HA ASN A1009 0.795 10.302 3.041 1.00 0.00 H new ATOM 0 HB2 ASN A1009 -0.660 12.154 4.976 1.00 0.00 H new ATOM 0 HB3 ASN A1009 0.727 11.155 5.363 1.00 0.00 H new ATOM 0 HD21 ASN A1009 1.309 14.871 4.007 1.00 0.00 H new ATOM 0 HD22 ASN A1009 -0.199 14.238 4.675 1.00 0.00 H new ATOM 1726 N THR A1010 -2.291 10.095 4.222 1.00 0.00 N ATOM 1727 CA THR A1010 -3.294 9.166 4.724 1.00 0.00 C ATOM 1728 C THR A1010 -4.141 8.610 3.584 1.00 0.00 C ATOM 1729 O THR A1010 -4.726 9.365 2.808 1.00 0.00 O ATOM 1730 CB THR A1010 -4.213 9.846 5.754 1.00 0.00 C ATOM 1731 OG1 THR A1010 -3.432 10.394 6.822 1.00 0.00 O ATOM 1732 CG2 THR A1010 -5.219 8.857 6.318 1.00 0.00 C ATOM 0 H THR A1010 -2.620 11.055 4.116 1.00 0.00 H new ATOM 0 HA THR A1010 -2.763 8.347 5.208 1.00 0.00 H new ATOM 0 HB THR A1010 -4.754 10.646 5.250 1.00 0.00 H new ATOM 0 HG1 THR A1010 -4.024 10.826 7.472 1.00 0.00 H new ATOM 0 HG21 THR A1010 -5.857 9.361 7.044 1.00 0.00 H new ATOM 0 HG22 THR A1010 -5.832 8.461 5.509 1.00 0.00 H new ATOM 0 HG23 THR A1010 -4.690 8.039 6.807 1.00 0.00 H new ATOM 1740 N ALA A1011 -4.199 7.286 3.486 1.00 0.00 N ATOM 1741 CA ALA A1011 -4.972 6.630 2.438 1.00 0.00 C ATOM 1742 C ALA A1011 -6.446 6.528 2.810 1.00 0.00 C ATOM 1743 O ALA A1011 -6.790 6.179 3.939 1.00 0.00 O ATOM 1744 CB ALA A1011 -4.404 5.249 2.149 1.00 0.00 C ATOM 0 H ALA A1011 -3.720 6.646 4.120 1.00 0.00 H new ATOM 0 HA ALA A1011 -4.898 7.241 1.538 1.00 0.00 H new ATOM 0 HB1 ALA A1011 -4.991 4.771 1.365 1.00 0.00 H new ATOM 0 HB2 ALA A1011 -3.369 5.343 1.821 1.00 0.00 H new ATOM 0 HB3 ALA A1011 -4.445 4.642 3.054 1.00 0.00 H new ATOM 1750 N HIS A1012 -7.312 6.828 1.848 1.00 0.00 N ATOM 1751 CA HIS A1012 -8.755 6.766 2.065 1.00 0.00 C ATOM 1752 C HIS A1012 -9.497 6.612 0.741 1.00 0.00 C ATOM 1753 O HIS A1012 -9.041 7.093 -0.297 1.00 0.00 O ATOM 1754 CB HIS A1012 -9.247 8.014 2.802 1.00 0.00 C ATOM 1755 CG HIS A1012 -9.043 9.288 2.043 1.00 0.00 C ATOM 1756 ND1 HIS A1012 -9.599 9.524 0.802 1.00 0.00 N ATOM 1757 CD2 HIS A1012 -8.348 10.406 2.359 1.00 0.00 C ATOM 1758 CE1 HIS A1012 -9.253 10.729 0.389 1.00 0.00 C ATOM 1759 NE2 HIS A1012 -8.495 11.286 1.315 1.00 0.00 N ATOM 0 H HIS A1012 -7.040 7.117 0.908 1.00 0.00 H new ATOM 0 HA HIS A1012 -8.963 5.892 2.683 1.00 0.00 H new ATOM 0 HB2 HIS A1012 -10.309 7.899 3.021 1.00 0.00 H new ATOM 0 HB3 HIS A1012 -8.730 8.086 3.759 1.00 0.00 H new ATOM 0 HD2 HIS A1012 -7.783 10.574 3.264 1.00 0.00 H new ATOM 0 HE1 HIS A1012 -9.541 11.182 -0.548 1.00 0.00 H new ATOM 0 HE2 HIS A1012 -8.085 12.219 1.264 1.00 0.00 H new ATOM 1768 N TRP A1013 -10.640 5.933 0.780 1.00 0.00 N ATOM 1769 CA TRP A1013 -11.443 5.716 -0.415 1.00 0.00 C ATOM 1770 C TRP A1013 -12.049 7.025 -0.895 1.00 0.00 C ATOM 1771 O TRP A1013 -12.403 7.889 -0.092 1.00 0.00 O ATOM 1772 CB TRP A1013 -12.551 4.699 -0.149 1.00 0.00 C ATOM 1773 CG TRP A1013 -12.073 3.485 0.582 1.00 0.00 C ATOM 1774 CD1 TRP A1013 -12.013 3.321 1.933 1.00 0.00 C ATOM 1775 CD2 TRP A1013 -11.566 2.277 0.006 1.00 0.00 C ATOM 1776 NE1 TRP A1013 -11.513 2.078 2.237 1.00 0.00 N ATOM 1777 CE2 TRP A1013 -11.229 1.419 1.070 1.00 0.00 C ATOM 1778 CE3 TRP A1013 -11.369 1.835 -1.304 1.00 0.00 C ATOM 1779 CZ2 TRP A1013 -10.706 0.145 0.863 1.00 0.00 C ATOM 1780 CZ3 TRP A1013 -10.848 0.572 -1.510 1.00 0.00 C ATOM 1781 CH2 TRP A1013 -10.522 -0.260 -0.432 1.00 0.00 C ATOM 0 H TRP A1013 -11.030 5.524 1.629 1.00 0.00 H new ATOM 0 HA TRP A1013 -10.788 5.322 -1.192 1.00 0.00 H new ATOM 0 HB2 TRP A1013 -13.342 5.176 0.430 1.00 0.00 H new ATOM 0 HB3 TRP A1013 -12.991 4.394 -1.098 1.00 0.00 H new ATOM 0 HD1 TRP A1013 -12.315 4.061 2.660 1.00 0.00 H new ATOM 0 HE1 TRP A1013 -11.376 1.707 3.177 1.00 0.00 H new ATOM 0 HE3 TRP A1013 -11.620 2.469 -2.141 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 -10.455 -0.499 1.693 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 -10.690 0.221 -2.519 1.00 0.00 H new ATOM 0 HH2 TRP A1013 -10.117 -1.242 -0.626 1.00 0.00 H new ATOM 1792 N SER A1014 -12.168 7.163 -2.206 1.00 0.00 N ATOM 1793 CA SER A1014 -12.733 8.365 -2.801 1.00 0.00 C ATOM 1794 C SER A1014 -14.125 8.658 -2.243 1.00 0.00 C ATOM 1795 O SER A1014 -14.455 9.807 -1.949 1.00 0.00 O ATOM 1796 CB SER A1014 -12.814 8.204 -4.317 1.00 0.00 C ATOM 1797 OG SER A1014 -11.528 8.017 -4.882 1.00 0.00 O ATOM 0 H SER A1014 -11.880 6.455 -2.881 1.00 0.00 H new ATOM 0 HA SER A1014 -12.081 9.203 -2.553 1.00 0.00 H new ATOM 0 HB2 SER A1014 -13.449 7.352 -4.561 1.00 0.00 H new ATOM 0 HB3 SER A1014 -13.282 9.086 -4.755 1.00 0.00 H new ATOM 0 HG SER A1014 -11.407 8.636 -5.632 1.00 0.00 H new ATOM 1803 N THR A1015 -14.939 7.615 -2.112 1.00 0.00 N ATOM 1804 CA THR A1015 -16.300 7.765 -1.604 1.00 0.00 C ATOM 1805 C THR A1015 -16.409 7.381 -0.132 1.00 0.00 C ATOM 1806 O THR A1015 -15.465 7.543 0.640 1.00 0.00 O ATOM 1807 CB THR A1015 -17.291 6.919 -2.424 1.00 0.00 C ATOM 1808 OG1 THR A1015 -16.937 5.534 -2.345 1.00 0.00 O ATOM 1809 CG2 THR A1015 -17.304 7.363 -3.879 1.00 0.00 C ATOM 0 H THR A1015 -14.681 6.657 -2.350 1.00 0.00 H new ATOM 0 HA THR A1015 -16.553 8.821 -1.703 1.00 0.00 H new ATOM 0 HB THR A1015 -18.288 7.061 -2.007 1.00 0.00 H new ATOM 0 HG1 THR A1015 -17.713 4.984 -2.580 1.00 0.00 H new ATOM 0 HG21 THR A1015 -18.011 6.752 -4.440 1.00 0.00 H new ATOM 0 HG22 THR A1015 -17.603 8.410 -3.937 1.00 0.00 H new ATOM 0 HG23 THR A1015 -16.307 7.246 -4.304 1.00 0.00 H new ATOM 1817 N LYS A1016 -17.579 6.871 0.240 1.00 0.00 N ATOM 1818 CA LYS A1016 -17.847 6.458 1.612 1.00 0.00 C ATOM 1819 C LYS A1016 -18.828 5.286 1.638 1.00 0.00 C ATOM 1820 O LYS A1016 -19.629 5.118 0.718 1.00 0.00 O ATOM 1821 CB LYS A1016 -18.405 7.625 2.436 1.00 0.00 C ATOM 1822 CG LYS A1016 -19.745 8.156 1.943 1.00 0.00 C ATOM 1823 CD LYS A1016 -19.613 8.865 0.605 1.00 0.00 C ATOM 1824 CE LYS A1016 -20.941 9.452 0.152 1.00 0.00 C ATOM 1825 NZ LYS A1016 -20.819 10.169 -1.147 1.00 0.00 N ATOM 0 H LYS A1016 -18.363 6.733 -0.397 1.00 0.00 H new ATOM 0 HA LYS A1016 -16.904 6.139 2.056 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -18.514 7.304 3.472 1.00 0.00 H new ATOM 0 HB3 LYS A1016 -17.680 8.439 2.429 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -20.451 7.331 1.849 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -20.157 8.845 2.681 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -18.871 9.660 0.685 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -19.249 8.163 -0.146 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -21.677 8.654 0.058 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -21.312 10.139 0.912 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -21.746 10.554 -1.420 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -20.136 10.947 -1.051 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -20.490 9.508 -1.879 1.00 0.00 H new ATOM 1839 N PRO A1017 -18.770 4.450 2.692 1.00 0.00 N ATOM 1840 CA PRO A1017 -19.650 3.281 2.829 1.00 0.00 C ATOM 1841 C PRO A1017 -21.129 3.632 2.659 1.00 0.00 C ATOM 1842 O PRO A1017 -21.629 4.570 3.280 1.00 0.00 O ATOM 1843 CB PRO A1017 -19.376 2.798 4.254 1.00 0.00 C ATOM 1844 CG PRO A1017 -17.993 3.266 4.550 1.00 0.00 C ATOM 1845 CD PRO A1017 -17.837 4.575 3.828 1.00 0.00 C ATOM 0 HA PRO A1017 -19.451 2.533 2.062 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -20.095 3.215 4.959 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -19.451 1.713 4.326 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -17.844 3.392 5.623 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -17.254 2.541 4.208 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -18.093 5.420 4.467 1.00 0.00 H new ATOM 0 HD3 PRO A1017 -16.812 4.729 3.491 1.00 0.00 H new ATOM 1853 N PRO A1018 -21.847 2.875 1.807 1.00 0.00 N ATOM 1854 CA PRO A1018 -23.273 3.104 1.550 1.00 0.00 C ATOM 1855 C PRO A1018 -24.164 2.591 2.677 1.00 0.00 C ATOM 1856 O PRO A1018 -23.702 2.365 3.795 1.00 0.00 O ATOM 1857 CB PRO A1018 -23.522 2.307 0.272 1.00 0.00 C ATOM 1858 CG PRO A1018 -22.544 1.186 0.338 1.00 0.00 C ATOM 1859 CD PRO A1018 -21.325 1.738 1.025 1.00 0.00 C ATOM 0 HA PRO A1018 -23.508 4.165 1.470 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -24.547 1.938 0.227 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -23.365 2.920 -0.616 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -22.955 0.342 0.892 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -22.299 0.823 -0.660 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -20.856 0.993 1.667 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -20.571 2.059 0.306 1.00 0.00 H new ATOM 1867 N ILE A1019 -25.448 2.410 2.369 1.00 0.00 N ATOM 1868 CA ILE A1019 -26.412 1.922 3.352 1.00 0.00 C ATOM 1869 C ILE A1019 -27.458 1.029 2.706 1.00 0.00 C ATOM 1870 O ILE A1019 -27.940 1.321 1.612 1.00 0.00 O ATOM 1871 CB ILE A1019 -27.190 3.067 4.021 1.00 0.00 C ATOM 1872 CG1 ILE A1019 -26.351 4.333 4.132 1.00 0.00 C ATOM 1873 CG2 ILE A1019 -27.674 2.633 5.396 1.00 0.00 C ATOM 1874 CD1 ILE A1019 -27.197 5.558 4.386 1.00 0.00 C ATOM 0 H ILE A1019 -25.843 2.594 1.447 1.00 0.00 H new ATOM 0 HA ILE A1019 -25.819 1.377 4.087 1.00 0.00 H new ATOM 0 HB ILE A1019 -28.049 3.298 3.391 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -25.629 4.218 4.940 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -25.782 4.471 3.213 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -28.224 3.450 5.863 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -28.328 1.767 5.295 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -26.818 2.371 6.017 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -26.554 6.436 4.458 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -27.902 5.690 3.565 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -27.746 5.434 5.319 1.00 0.00 H new ATOM 1886 N CYS A1020 -27.856 -0.023 3.407 1.00 0.00 N ATOM 1887 CA CYS A1020 -28.904 -0.895 2.902 1.00 0.00 C ATOM 1888 C CYS A1020 -30.255 -0.268 3.204 1.00 0.00 C ATOM 1889 O CYS A1020 -30.519 0.135 4.337 1.00 0.00 O ATOM 1890 CB CYS A1020 -28.830 -2.289 3.528 1.00 0.00 C ATOM 1891 SG CYS A1020 -27.551 -3.376 2.823 1.00 0.00 S ATOM 0 H CYS A1020 -27.475 -0.290 4.315 1.00 0.00 H new ATOM 0 HA CYS A1020 -28.769 -1.009 1.826 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -28.647 -2.182 4.597 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -29.800 -2.774 3.417 1.00 0.00 H new ATOM 1896 N GLN A1021 -31.106 -0.175 2.195 1.00 0.00 N ATOM 1897 CA GLN A1021 -32.420 0.421 2.378 1.00 0.00 C ATOM 1898 C GLN A1021 -33.451 -0.315 1.535 1.00 0.00 C ATOM 1899 O GLN A1021 -33.265 -0.499 0.333 1.00 0.00 O ATOM 1900 CB GLN A1021 -32.376 1.899 1.990 1.00 0.00 C ATOM 1901 CG GLN A1021 -33.461 2.743 2.634 1.00 0.00 C ATOM 1902 CD GLN A1021 -33.303 2.859 4.139 1.00 0.00 C ATOM 1903 OE1 GLN A1021 -34.173 3.396 4.824 1.00 0.00 O ATOM 1904 NE2 GLN A1021 -32.182 2.370 4.662 1.00 0.00 N ATOM 0 H GLN A1021 -30.913 -0.502 1.248 1.00 0.00 H new ATOM 0 HA GLN A1021 -32.706 0.339 3.427 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -31.403 2.307 2.265 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -32.462 1.982 0.907 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -33.448 3.740 2.194 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -34.435 2.308 2.408 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -31.486 1.932 4.058 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -32.018 2.433 5.667 1.00 0.00 H new ATOM 1913 N ARG A1022 -34.531 -0.750 2.177 1.00 0.00 N ATOM 1914 CA ARG A1022 -35.583 -1.486 1.487 1.00 0.00 C ATOM 1915 C ARG A1022 -36.009 -0.780 0.218 1.00 0.00 C ATOM 1916 O ARG A1022 -36.077 0.448 0.157 1.00 0.00 O ATOM 1917 CB ARG A1022 -36.794 -1.687 2.392 1.00 0.00 C ATOM 1918 CG ARG A1022 -37.458 -0.390 2.812 1.00 0.00 C ATOM 1919 CD ARG A1022 -38.854 -0.641 3.346 1.00 0.00 C ATOM 1920 NE ARG A1022 -39.479 0.577 3.857 1.00 0.00 N ATOM 1921 CZ ARG A1022 -39.749 1.642 3.105 1.00 0.00 C ATOM 1922 NH1 ARG A1022 -39.467 1.636 1.810 1.00 0.00 N ATOM 1923 NH2 ARG A1022 -40.309 2.714 3.652 1.00 0.00 N ATOM 0 H ARG A1022 -34.700 -0.605 3.173 1.00 0.00 H new ATOM 0 HA ARG A1022 -35.172 -2.460 1.222 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -37.525 -2.309 1.875 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -36.485 -2.233 3.283 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -36.855 0.100 3.577 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -37.507 0.289 1.961 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -39.474 -1.060 2.553 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -38.808 -1.385 4.142 1.00 0.00 H new ATOM 0 HE ARG A1022 -39.722 0.613 4.847 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -39.041 0.813 1.385 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -39.676 2.455 1.239 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -40.532 2.721 4.647 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -40.516 3.531 3.077 1.00 0.00 H new ATOM 1937 N ILE A1023 -36.286 -1.579 -0.794 1.00 0.00 N ATOM 1938 CA ILE A1023 -36.701 -1.069 -2.081 1.00 0.00 C ATOM 1939 C ILE A1023 -38.147 -0.578 -2.040 1.00 0.00 C ATOM 1940 O ILE A1023 -39.033 -1.279 -1.550 1.00 0.00 O ATOM 1941 CB ILE A1023 -36.563 -2.153 -3.157 1.00 0.00 C ATOM 1942 CG1 ILE A1023 -35.196 -2.834 -3.057 1.00 0.00 C ATOM 1943 CG2 ILE A1023 -36.746 -1.535 -4.521 1.00 0.00 C ATOM 1944 CD1 ILE A1023 -35.003 -3.961 -4.050 1.00 0.00 C ATOM 0 H ILE A1023 -36.229 -2.596 -0.745 1.00 0.00 H new ATOM 0 HA ILE A1023 -36.052 -0.228 -2.327 1.00 0.00 H new ATOM 0 HB ILE A1023 -37.332 -2.910 -3.002 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -34.416 -2.088 -3.211 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -35.068 -3.225 -2.048 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -36.648 -2.306 -5.286 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -37.736 -1.083 -4.586 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -35.987 -0.769 -4.678 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -34.012 -4.395 -3.919 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -35.760 -4.727 -3.882 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -35.098 -3.573 -5.064 1.00 0.00 H new ATOM 1956 N PRO A1024 -38.407 0.638 -2.555 1.00 0.00 N ATOM 1957 CA PRO A1024 -39.754 1.220 -2.575 1.00 0.00 C ATOM 1958 C PRO A1024 -40.716 0.429 -3.455 1.00 0.00 C ATOM 1959 O PRO A1024 -40.254 -0.503 -4.147 1.00 0.00 O ATOM 1960 CB PRO A1024 -39.524 2.620 -3.154 1.00 0.00 C ATOM 1961 CG PRO A1024 -38.271 2.492 -3.943 1.00 0.00 C ATOM 1962 CD PRO A1024 -37.414 1.544 -3.160 1.00 0.00 C ATOM 1963 OXT PRO A1024 -41.923 0.749 -3.446 1.00 0.00 O ATOM 0 HA PRO A1024 -40.213 1.222 -1.586 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -40.359 2.933 -3.782 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -39.422 3.365 -2.365 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -38.472 2.108 -4.943 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -37.781 3.458 -4.065 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -36.713 1.008 -3.800 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -36.824 2.061 -2.404 1.00 0.00 H new TER 1971 PRO A1024