USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 1035 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 111 ASN : amide:sc= -0.492 K(o=-1,f=-4.5!) USER MOD Set 1.2: A 127 LYS NZ :NH3+ -165:sc= -0.511 (180deg=-0.875) USER MOD Set 2.1: A 1 MET CE :methyl -106:sc= -1.29 (180deg=-2.74!) USER MOD Set 2.2: A 79 HIS : no HD1:sc= -2.53 K(o=-3.8,f=-2.2) USER MOD Single : A 1 MET N :NH3+ 167:sc= -0.0287 (180deg=-0.222) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0865) USER MOD Single : A 5 GLN : amide:sc= -1.02 K(o=-1,f=-4!) USER MOD Single : A 13 ASN : amide:sc= -0.67 K(o=-0.67,f=-1.9) USER MOD Single : A 15 ASN : amide:sc= -0.281 X(o=-0.28,f=-0.028) USER MOD Single : A 16 ASN : amide:sc= -4.54! C(o=-4.5!,f=-1.9!) USER MOD Single : A 21 THR OG1 : rot -100:sc= -4.44! USER MOD Single : A 28 HIS : no HE2:sc= 0.0855 K(o=0.085,f=-0.45) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ -155:sc= -0.346 (180deg=-1.05) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -160:sc= -0.248 USER MOD Single : A 48 GLN : amide:sc= -0.779 K(o=-0.78,f=-0.13) USER MOD Single : A 55 GLN : amide:sc= -0.287 K(o=-0.29,f=-2.6!) USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.0879 USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 64 HIS : no HD1:sc= -0.0361 X(o=-0.036,f=0) USER MOD Single : A 66 SER OG : rot 2:sc= 1.11 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0.0304 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -1.75! C(o=-1.8!,f=-4.5!) USER MOD Single : A 105 MET CE :methyl 158:sc= -0.102 (180deg=-1.12) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -4.01 K(o=-4,f=-2.7) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.627 14.879 12.084 1.00 0.00 N ATOM 2 CA MET A 1 12.763 15.327 11.230 1.00 0.00 C ATOM 3 C MET A 1 13.582 14.111 10.795 1.00 0.00 C ATOM 4 O MET A 1 14.774 14.199 10.573 1.00 0.00 O ATOM 5 CB MET A 1 13.654 16.282 12.026 1.00 0.00 C ATOM 6 CG MET A 1 13.669 17.651 11.346 1.00 0.00 C ATOM 7 SD MET A 1 15.291 17.930 10.597 1.00 0.00 S ATOM 8 CE MET A 1 15.027 16.918 9.121 1.00 0.00 C ATOM 0 H1 MET A 1 11.203 15.702 12.558 1.00 0.00 H new ATOM 0 H2 MET A 1 10.910 14.413 11.492 1.00 0.00 H new ATOM 0 H3 MET A 1 11.974 14.209 12.800 1.00 0.00 H new ATOM 0 HA MET A 1 12.376 15.840 10.350 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.284 16.375 13.047 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.667 15.884 12.089 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.891 17.700 10.584 1.00 0.00 H new ATOM 0 HG3 MET A 1 13.452 18.433 12.073 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.591 15.989 9.211 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.966 16.690 9.021 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.365 17.464 8.240 1.00 0.00 H new ATOM 20 N LYS A 2 12.953 12.974 10.674 1.00 0.00 N ATOM 21 CA LYS A 2 13.696 11.752 10.257 1.00 0.00 C ATOM 22 C LYS A 2 13.077 11.186 8.978 1.00 0.00 C ATOM 23 O LYS A 2 11.878 11.230 8.785 1.00 0.00 O ATOM 24 CB LYS A 2 13.615 10.704 11.368 1.00 0.00 C ATOM 25 CG LYS A 2 14.913 9.896 11.405 1.00 0.00 C ATOM 26 CD LYS A 2 14.724 8.587 10.637 1.00 0.00 C ATOM 27 CE LYS A 2 15.071 7.409 11.547 1.00 0.00 C ATOM 28 NZ LYS A 2 16.518 7.081 11.406 1.00 0.00 N ATOM 0 H LYS A 2 11.957 12.839 10.846 1.00 0.00 H new ATOM 0 HA LYS A 2 14.739 12.008 10.071 1.00 0.00 H new ATOM 0 HB2 LYS A 2 13.450 11.190 12.329 1.00 0.00 H new ATOM 0 HB3 LYS A 2 12.767 10.041 11.196 1.00 0.00 H new ATOM 0 HG2 LYS A 2 15.726 10.474 10.965 1.00 0.00 H new ATOM 0 HG3 LYS A 2 15.194 9.687 12.437 1.00 0.00 H new ATOM 0 HD2 LYS A 2 13.694 8.502 10.290 1.00 0.00 H new ATOM 0 HD3 LYS A 2 15.360 8.577 9.752 1.00 0.00 H new ATOM 0 HE2 LYS A 2 14.843 7.657 12.584 1.00 0.00 H new ATOM 0 HE3 LYS A 2 14.464 6.542 11.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 16.754 6.279 12.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 16.722 6.827 10.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 17.089 7.907 11.676 1.00 0.00 H new ATOM 42 N LYS A 3 13.886 10.651 8.105 1.00 0.00 N ATOM 43 CA LYS A 3 13.344 10.080 6.840 1.00 0.00 C ATOM 44 C LYS A 3 12.306 9.007 7.173 1.00 0.00 C ATOM 45 O LYS A 3 12.401 8.328 8.176 1.00 0.00 O ATOM 46 CB LYS A 3 14.482 9.456 6.031 1.00 0.00 C ATOM 47 CG LYS A 3 14.664 10.233 4.728 1.00 0.00 C ATOM 48 CD LYS A 3 15.400 11.542 5.016 1.00 0.00 C ATOM 49 CE LYS A 3 15.205 12.506 3.846 1.00 0.00 C ATOM 50 NZ LYS A 3 15.841 11.937 2.625 1.00 0.00 N ATOM 0 H LYS A 3 14.898 10.585 8.213 1.00 0.00 H new ATOM 0 HA LYS A 3 12.876 10.871 6.254 1.00 0.00 H new ATOM 0 HB2 LYS A 3 15.406 9.473 6.609 1.00 0.00 H new ATOM 0 HB3 LYS A 3 14.260 8.411 5.816 1.00 0.00 H new ATOM 0 HG2 LYS A 3 15.228 9.636 4.011 1.00 0.00 H new ATOM 0 HG3 LYS A 3 13.694 10.440 4.277 1.00 0.00 H new ATOM 0 HD2 LYS A 3 15.022 11.989 5.936 1.00 0.00 H new ATOM 0 HD3 LYS A 3 16.462 11.348 5.168 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.142 12.673 3.672 1.00 0.00 H new ATOM 0 HE3 LYS A 3 15.646 13.475 4.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.906 12.672 1.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 16.795 11.595 2.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.267 11.146 2.271 1.00 0.00 H new ATOM 64 N LEU A 4 11.316 8.847 6.338 1.00 0.00 N ATOM 65 CA LEU A 4 10.276 7.817 6.612 1.00 0.00 C ATOM 66 C LEU A 4 9.989 7.019 5.339 1.00 0.00 C ATOM 67 O LEU A 4 8.959 7.178 4.714 1.00 0.00 O ATOM 68 CB LEU A 4 8.991 8.501 7.084 1.00 0.00 C ATOM 69 CG LEU A 4 9.327 9.528 8.164 1.00 0.00 C ATOM 70 CD1 LEU A 4 8.071 10.327 8.513 1.00 0.00 C ATOM 71 CD2 LEU A 4 9.835 8.805 9.414 1.00 0.00 C ATOM 0 H LEU A 4 11.183 9.383 5.481 1.00 0.00 H new ATOM 0 HA LEU A 4 10.636 7.141 7.387 1.00 0.00 H new ATOM 0 HB2 LEU A 4 8.497 8.989 6.244 1.00 0.00 H new ATOM 0 HB3 LEU A 4 8.295 7.760 7.476 1.00 0.00 H new ATOM 0 HG LEU A 4 10.099 10.204 7.796 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.309 11.060 9.284 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.708 10.841 7.623 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.300 9.650 8.882 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.075 9.537 10.185 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.063 8.129 9.782 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.729 8.233 9.165 1.00 0.00 H new ATOM 83 N GLN A 5 10.888 6.156 4.953 1.00 0.00 N ATOM 84 CA GLN A 5 10.655 5.345 3.727 1.00 0.00 C ATOM 85 C GLN A 5 9.882 4.082 4.109 1.00 0.00 C ATOM 86 O GLN A 5 10.358 3.256 4.861 1.00 0.00 O ATOM 87 CB GLN A 5 11.998 4.959 3.102 1.00 0.00 C ATOM 88 CG GLN A 5 12.951 6.153 3.168 1.00 0.00 C ATOM 89 CD GLN A 5 14.141 5.807 4.063 1.00 0.00 C ATOM 90 OE1 GLN A 5 14.200 4.731 4.625 1.00 0.00 O ATOM 91 NE2 GLN A 5 15.100 6.680 4.221 1.00 0.00 N ATOM 0 H GLN A 5 11.771 5.978 5.432 1.00 0.00 H new ATOM 0 HA GLN A 5 10.081 5.924 3.004 1.00 0.00 H new ATOM 0 HB2 GLN A 5 12.427 4.108 3.631 1.00 0.00 H new ATOM 0 HB3 GLN A 5 11.854 4.651 2.066 1.00 0.00 H new ATOM 0 HG2 GLN A 5 13.298 6.411 2.167 1.00 0.00 H new ATOM 0 HG3 GLN A 5 12.430 7.027 3.560 1.00 0.00 H new ATOM 0 HE21 GLN A 5 15.050 7.583 3.749 1.00 0.00 H new ATOM 0 HE22 GLN A 5 15.898 6.459 4.816 1.00 0.00 H new ATOM 100 N ILE A 6 8.686 3.928 3.608 1.00 0.00 N ATOM 101 CA ILE A 6 7.886 2.722 3.959 1.00 0.00 C ATOM 102 C ILE A 6 7.715 1.835 2.722 1.00 0.00 C ATOM 103 O ILE A 6 7.512 2.309 1.622 1.00 0.00 O ATOM 104 CB ILE A 6 6.514 3.168 4.496 1.00 0.00 C ATOM 105 CG1 ILE A 6 6.617 3.383 6.007 1.00 0.00 C ATOM 106 CG2 ILE A 6 5.447 2.102 4.215 1.00 0.00 C ATOM 107 CD1 ILE A 6 7.353 4.693 6.285 1.00 0.00 C ATOM 0 H ILE A 6 8.230 4.583 2.973 1.00 0.00 H new ATOM 0 HA ILE A 6 8.401 2.146 4.728 1.00 0.00 H new ATOM 0 HB ILE A 6 6.226 4.093 3.997 1.00 0.00 H new ATOM 0 HG12 ILE A 6 5.621 3.411 6.450 1.00 0.00 H new ATOM 0 HG13 ILE A 6 7.148 2.550 6.469 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.486 2.438 4.603 1.00 0.00 H new ATOM 0 HG22 ILE A 6 5.368 1.941 3.140 1.00 0.00 H new ATOM 0 HG23 ILE A 6 5.728 1.168 4.702 1.00 0.00 H new ATOM 0 HD11 ILE A 6 7.427 4.847 7.361 1.00 0.00 H new ATOM 0 HD12 ILE A 6 8.354 4.646 5.855 1.00 0.00 H new ATOM 0 HD13 ILE A 6 6.804 5.521 5.837 1.00 0.00 H new ATOM 119 N ALA A 7 7.781 0.547 2.909 1.00 0.00 N ATOM 120 CA ALA A 7 7.606 -0.391 1.767 1.00 0.00 C ATOM 121 C ALA A 7 6.210 -0.993 1.859 1.00 0.00 C ATOM 122 O ALA A 7 5.913 -1.756 2.757 1.00 0.00 O ATOM 123 CB ALA A 7 8.654 -1.503 1.845 1.00 0.00 C ATOM 0 H ALA A 7 7.950 0.101 3.811 1.00 0.00 H new ATOM 0 HA ALA A 7 7.729 0.138 0.822 1.00 0.00 H new ATOM 0 HB1 ALA A 7 8.522 -2.187 1.007 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.652 -1.066 1.803 1.00 0.00 H new ATOM 0 HB3 ALA A 7 8.536 -2.049 2.781 1.00 0.00 H new ATOM 129 N VAL A 8 5.340 -0.645 0.957 1.00 0.00 N ATOM 130 CA VAL A 8 3.960 -1.192 1.029 1.00 0.00 C ATOM 131 C VAL A 8 3.567 -1.812 -0.302 1.00 0.00 C ATOM 132 O VAL A 8 3.155 -1.129 -1.218 1.00 0.00 O ATOM 133 CB VAL A 8 2.983 -0.065 1.343 1.00 0.00 C ATOM 134 CG1 VAL A 8 3.204 1.096 0.373 1.00 0.00 C ATOM 135 CG2 VAL A 8 1.559 -0.579 1.176 1.00 0.00 C ATOM 0 H VAL A 8 5.522 -0.011 0.179 1.00 0.00 H new ATOM 0 HA VAL A 8 3.928 -1.952 1.809 1.00 0.00 H new ATOM 0 HB VAL A 8 3.144 0.277 2.365 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.503 1.899 0.601 1.00 0.00 H new ATOM 0 HG12 VAL A 8 4.225 1.465 0.474 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.042 0.752 -0.649 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.854 0.222 1.399 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.412 -0.916 0.150 1.00 0.00 H new ATOM 0 HG23 VAL A 8 1.390 -1.411 1.859 1.00 0.00 H new ATOM 145 N GLY A 9 3.645 -3.101 -0.408 1.00 0.00 N ATOM 146 CA GLY A 9 3.222 -3.741 -1.672 1.00 0.00 C ATOM 147 C GLY A 9 1.712 -3.935 -1.591 1.00 0.00 C ATOM 148 O GLY A 9 1.219 -4.629 -0.723 1.00 0.00 O ATOM 0 H GLY A 9 3.980 -3.734 0.318 1.00 0.00 H new ATOM 0 HA2 GLY A 9 3.485 -3.118 -2.527 1.00 0.00 H new ATOM 0 HA3 GLY A 9 3.727 -4.697 -1.808 1.00 0.00 H new ATOM 152 N ILE A 10 0.964 -3.332 -2.469 1.00 0.00 N ATOM 153 CA ILE A 10 -0.502 -3.503 -2.398 1.00 0.00 C ATOM 154 C ILE A 10 -0.842 -4.825 -3.067 1.00 0.00 C ATOM 155 O ILE A 10 0.019 -5.476 -3.623 1.00 0.00 O ATOM 156 CB ILE A 10 -1.216 -2.354 -3.112 1.00 0.00 C ATOM 157 CG1 ILE A 10 -0.452 -1.032 -2.931 1.00 0.00 C ATOM 158 CG2 ILE A 10 -2.614 -2.206 -2.527 1.00 0.00 C ATOM 159 CD1 ILE A 10 -0.782 -0.107 -4.105 1.00 0.00 C ATOM 0 H ILE A 10 1.304 -2.735 -3.223 1.00 0.00 H new ATOM 0 HA ILE A 10 -0.830 -3.500 -1.359 1.00 0.00 H new ATOM 0 HB ILE A 10 -1.266 -2.580 -4.177 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -0.732 -0.560 -1.989 1.00 0.00 H new ATOM 0 HG13 ILE A 10 0.621 -1.219 -2.888 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -3.134 -1.389 -3.028 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -3.169 -3.133 -2.672 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -2.541 -1.990 -1.461 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -0.246 0.835 -3.988 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -0.481 -0.582 -5.039 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -1.855 0.086 -4.126 1.00 0.00 H new ATOM 171 N ILE A 11 -2.067 -5.255 -3.014 1.00 0.00 N ATOM 172 CA ILE A 11 -2.378 -6.563 -3.654 1.00 0.00 C ATOM 173 C ILE A 11 -3.777 -6.534 -4.278 1.00 0.00 C ATOM 174 O ILE A 11 -4.639 -5.782 -3.876 1.00 0.00 O ATOM 175 CB ILE A 11 -2.254 -7.687 -2.608 1.00 0.00 C ATOM 176 CG1 ILE A 11 -1.333 -7.216 -1.469 1.00 0.00 C ATOM 177 CG2 ILE A 11 -1.646 -8.927 -3.267 1.00 0.00 C ATOM 178 CD1 ILE A 11 -0.941 -8.383 -0.548 1.00 0.00 C ATOM 0 H ILE A 11 -2.849 -4.775 -2.569 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.665 -6.755 -4.456 1.00 0.00 H new ATOM 0 HB ILE A 11 -3.239 -7.930 -2.210 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -0.434 -6.764 -1.889 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -1.837 -6.444 -0.887 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -1.557 -9.724 -2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.289 -9.258 -4.083 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.659 -8.683 -3.659 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.290 -8.017 0.246 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -1.839 -8.818 -0.110 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.415 -9.142 -1.127 1.00 0.00 H new ATOM 190 N ARG A 12 -3.988 -7.338 -5.284 1.00 0.00 N ATOM 191 CA ARG A 12 -5.311 -7.366 -5.979 1.00 0.00 C ATOM 192 C ARG A 12 -5.459 -8.695 -6.731 1.00 0.00 C ATOM 193 O ARG A 12 -4.563 -9.120 -7.430 1.00 0.00 O ATOM 194 CB ARG A 12 -5.374 -6.206 -6.973 1.00 0.00 C ATOM 195 CG ARG A 12 -6.786 -6.091 -7.550 1.00 0.00 C ATOM 196 CD ARG A 12 -6.772 -5.134 -8.745 1.00 0.00 C ATOM 197 NE ARG A 12 -5.973 -5.732 -9.854 1.00 0.00 N ATOM 198 CZ ARG A 12 -6.059 -5.241 -11.061 1.00 0.00 C ATOM 199 NH1 ARG A 12 -5.531 -4.077 -11.331 1.00 0.00 N ATOM 200 NH2 ARG A 12 -6.671 -5.912 -11.997 1.00 0.00 N ATOM 0 H ARG A 12 -3.294 -7.984 -5.660 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.117 -7.270 -5.251 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.097 -5.275 -6.477 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -4.655 -6.365 -7.777 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -7.145 -7.072 -7.860 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -7.474 -5.727 -6.787 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.791 -4.940 -9.081 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.345 -4.175 -8.451 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.359 -6.525 -9.669 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.052 -3.552 -10.599 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -5.598 -3.693 -12.274 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -7.083 -6.821 -11.787 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.738 -5.528 -12.939 1.00 0.00 H new ATOM 214 N ASN A 13 -6.570 -9.364 -6.576 1.00 0.00 N ATOM 215 CA ASN A 13 -6.752 -10.676 -7.268 1.00 0.00 C ATOM 216 C ASN A 13 -7.499 -10.488 -8.588 1.00 0.00 C ATOM 217 O ASN A 13 -7.591 -9.399 -9.118 1.00 0.00 O ATOM 218 CB ASN A 13 -7.555 -11.621 -6.371 1.00 0.00 C ATOM 219 CG ASN A 13 -6.640 -12.729 -5.846 1.00 0.00 C ATOM 220 OD1 ASN A 13 -6.593 -12.983 -4.660 1.00 0.00 O ATOM 221 ND2 ASN A 13 -5.904 -13.405 -6.686 1.00 0.00 N ATOM 0 H ASN A 13 -7.358 -9.062 -6.003 1.00 0.00 H new ATOM 0 HA ASN A 13 -5.768 -11.099 -7.473 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -7.988 -11.068 -5.538 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -8.384 -12.054 -6.931 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -5.291 -14.145 -6.345 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -5.942 -13.193 -7.683 1.00 0.00 H new ATOM 228 N GLU A 14 -8.029 -11.556 -9.121 1.00 0.00 N ATOM 229 CA GLU A 14 -8.773 -11.469 -10.412 1.00 0.00 C ATOM 230 C GLU A 14 -10.229 -11.104 -10.143 1.00 0.00 C ATOM 231 O GLU A 14 -10.990 -10.834 -11.052 1.00 0.00 O ATOM 232 CB GLU A 14 -8.715 -12.817 -11.124 1.00 0.00 C ATOM 233 CG GLU A 14 -7.596 -12.802 -12.167 1.00 0.00 C ATOM 234 CD GLU A 14 -7.138 -14.234 -12.443 1.00 0.00 C ATOM 235 OE1 GLU A 14 -6.937 -14.966 -11.487 1.00 0.00 O ATOM 236 OE2 GLU A 14 -6.997 -14.577 -13.605 1.00 0.00 O ATOM 0 H GLU A 14 -7.978 -12.491 -8.716 1.00 0.00 H new ATOM 0 HA GLU A 14 -8.317 -10.703 -11.039 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -8.541 -13.614 -10.401 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -9.671 -13.027 -11.605 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -7.949 -12.338 -13.088 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.758 -12.203 -11.809 1.00 0.00 H new ATOM 243 N ASN A 15 -10.625 -11.075 -8.902 1.00 0.00 N ATOM 244 CA ASN A 15 -12.030 -10.704 -8.584 1.00 0.00 C ATOM 245 C ASN A 15 -12.132 -9.177 -8.523 1.00 0.00 C ATOM 246 O ASN A 15 -13.117 -8.623 -8.077 1.00 0.00 O ATOM 247 CB ASN A 15 -12.438 -11.311 -7.239 1.00 0.00 C ATOM 248 CG ASN A 15 -13.961 -11.437 -7.181 1.00 0.00 C ATOM 249 OD1 ASN A 15 -14.521 -12.399 -7.670 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.659 -10.500 -6.602 1.00 0.00 N ATOM 0 H ASN A 15 -10.038 -11.292 -8.096 1.00 0.00 H new ATOM 0 HA ASN A 15 -12.699 -11.088 -9.354 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -11.976 -12.290 -7.114 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -12.082 -10.684 -6.421 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -15.675 -10.574 -6.559 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -14.189 -9.693 -6.192 1.00 0.00 H new ATOM 257 N ASN A 16 -11.116 -8.499 -8.990 1.00 0.00 N ATOM 258 CA ASN A 16 -11.124 -7.015 -8.992 1.00 0.00 C ATOM 259 C ASN A 16 -11.262 -6.477 -7.565 1.00 0.00 C ATOM 260 O ASN A 16 -11.991 -5.539 -7.312 1.00 0.00 O ATOM 261 CB ASN A 16 -12.291 -6.540 -9.849 1.00 0.00 C ATOM 262 CG ASN A 16 -12.356 -5.012 -9.842 1.00 0.00 C ATOM 263 OD1 ASN A 16 -13.386 -4.436 -9.555 1.00 0.00 O ATOM 264 ND2 ASN A 16 -11.288 -4.327 -10.151 1.00 0.00 N ATOM 0 H ASN A 16 -10.271 -8.922 -9.375 1.00 0.00 H new ATOM 0 HA ASN A 16 -10.185 -6.643 -9.401 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -12.174 -6.903 -10.870 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -13.225 -6.954 -9.468 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -11.318 -3.307 -10.151 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -10.423 -4.812 -10.392 1.00 0.00 H new ATOM 271 N GLU A 17 -10.547 -7.051 -6.637 1.00 0.00 N ATOM 272 CA GLU A 17 -10.612 -6.562 -5.228 1.00 0.00 C ATOM 273 C GLU A 17 -9.185 -6.290 -4.750 1.00 0.00 C ATOM 274 O GLU A 17 -8.241 -6.869 -5.250 1.00 0.00 O ATOM 275 CB GLU A 17 -11.263 -7.612 -4.315 1.00 0.00 C ATOM 276 CG GLU A 17 -11.859 -8.750 -5.148 1.00 0.00 C ATOM 277 CD GLU A 17 -12.560 -9.748 -4.224 1.00 0.00 C ATOM 278 OE1 GLU A 17 -11.872 -10.565 -3.636 1.00 0.00 O ATOM 279 OE2 GLU A 17 -13.774 -9.678 -4.122 1.00 0.00 O ATOM 0 H GLU A 17 -9.919 -7.839 -6.793 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.214 -5.654 -5.188 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -10.522 -8.010 -3.622 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -12.044 -7.146 -3.714 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.568 -8.351 -5.874 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.073 -9.251 -5.713 1.00 0.00 H new ATOM 286 N ILE A 18 -9.006 -5.415 -3.800 1.00 0.00 N ATOM 287 CA ILE A 18 -7.622 -5.124 -3.328 1.00 0.00 C ATOM 288 C ILE A 18 -7.491 -5.454 -1.842 1.00 0.00 C ATOM 289 O ILE A 18 -8.453 -5.459 -1.101 1.00 0.00 O ATOM 290 CB ILE A 18 -7.299 -3.643 -3.542 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.087 -3.107 -4.740 1.00 0.00 C ATOM 292 CG2 ILE A 18 -5.801 -3.481 -3.812 1.00 0.00 C ATOM 293 CD1 ILE A 18 -7.982 -1.581 -4.777 1.00 0.00 C ATOM 0 H ILE A 18 -9.748 -4.894 -3.334 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.925 -5.738 -3.898 1.00 0.00 H new ATOM 0 HB ILE A 18 -7.575 -3.085 -2.648 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -7.697 -3.532 -5.665 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -9.132 -3.409 -4.666 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.571 -2.427 -3.964 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.235 -3.857 -2.960 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -5.529 -4.044 -4.705 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -8.543 -1.198 -5.630 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -8.393 -1.166 -3.857 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -6.936 -1.290 -4.871 1.00 0.00 H new ATOM 305 N PHE A 19 -6.292 -5.709 -1.406 1.00 0.00 N ATOM 306 CA PHE A 19 -6.053 -6.018 0.026 1.00 0.00 C ATOM 307 C PHE A 19 -5.458 -4.771 0.677 1.00 0.00 C ATOM 308 O PHE A 19 -4.256 -4.609 0.752 1.00 0.00 O ATOM 309 CB PHE A 19 -5.073 -7.194 0.131 1.00 0.00 C ATOM 310 CG PHE A 19 -4.465 -7.242 1.512 1.00 0.00 C ATOM 311 CD1 PHE A 19 -5.189 -7.785 2.581 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.174 -6.745 1.723 1.00 0.00 C ATOM 313 CE1 PHE A 19 -4.621 -7.831 3.859 1.00 0.00 C ATOM 314 CE2 PHE A 19 -2.605 -6.792 2.999 1.00 0.00 C ATOM 315 CZ PHE A 19 -3.327 -7.334 4.069 1.00 0.00 C ATOM 0 H PHE A 19 -5.456 -5.716 -1.991 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.980 -6.294 0.529 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.592 -8.129 -0.079 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.287 -7.090 -0.617 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.186 -8.168 2.419 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.617 -6.325 0.899 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -5.179 -8.249 4.683 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.608 -6.410 3.159 1.00 0.00 H new ATOM 0 HZ PHE A 19 -2.888 -7.369 5.055 1.00 0.00 H new ATOM 325 N ILE A 20 -6.293 -3.874 1.120 1.00 0.00 N ATOM 326 CA ILE A 20 -5.782 -2.619 1.731 1.00 0.00 C ATOM 327 C ILE A 20 -5.333 -2.879 3.163 1.00 0.00 C ATOM 328 O ILE A 20 -5.460 -3.964 3.694 1.00 0.00 O ATOM 329 CB ILE A 20 -6.895 -1.544 1.673 1.00 0.00 C ATOM 330 CG1 ILE A 20 -6.626 -0.632 0.481 1.00 0.00 C ATOM 331 CG2 ILE A 20 -6.974 -0.686 2.944 1.00 0.00 C ATOM 332 CD1 ILE A 20 -5.218 -0.064 0.610 1.00 0.00 C ATOM 0 H ILE A 20 -7.309 -3.957 1.085 1.00 0.00 H new ATOM 0 HA ILE A 20 -4.916 -2.257 1.176 1.00 0.00 H new ATOM 0 HB ILE A 20 -7.847 -2.066 1.579 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -6.725 -1.189 -0.451 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.358 0.175 0.450 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -7.774 0.047 2.839 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -7.179 -1.326 3.803 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -6.026 -0.170 3.094 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.011 0.591 -0.236 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.138 0.504 1.537 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.496 -0.880 0.622 1.00 0.00 H new ATOM 344 N THR A 21 -4.805 -1.872 3.776 1.00 0.00 N ATOM 345 CA THR A 21 -4.327 -1.997 5.175 1.00 0.00 C ATOM 346 C THR A 21 -4.388 -0.623 5.831 1.00 0.00 C ATOM 347 O THR A 21 -4.168 0.387 5.192 1.00 0.00 O ATOM 348 CB THR A 21 -2.888 -2.496 5.182 1.00 0.00 C ATOM 349 OG1 THR A 21 -2.505 -2.861 3.862 1.00 0.00 O ATOM 350 CG2 THR A 21 -2.769 -3.708 6.108 1.00 0.00 C ATOM 0 H THR A 21 -4.680 -0.948 3.363 1.00 0.00 H new ATOM 0 HA THR A 21 -4.953 -2.704 5.720 1.00 0.00 H new ATOM 0 HB THR A 21 -2.231 -1.704 5.542 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.565 -3.834 3.761 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.739 -4.063 6.111 1.00 0.00 H new ATOM 0 HG22 THR A 21 -3.058 -3.423 7.120 1.00 0.00 H new ATOM 0 HG23 THR A 21 -3.426 -4.503 5.754 1.00 0.00 H new ATOM 358 N ARG A 22 -4.711 -0.567 7.089 1.00 0.00 N ATOM 359 CA ARG A 22 -4.813 0.744 7.754 1.00 0.00 C ATOM 360 C ARG A 22 -4.573 0.590 9.258 1.00 0.00 C ATOM 361 O ARG A 22 -5.418 0.101 9.982 1.00 0.00 O ATOM 362 CB ARG A 22 -6.215 1.266 7.510 1.00 0.00 C ATOM 363 CG ARG A 22 -6.423 2.535 8.314 1.00 0.00 C ATOM 364 CD ARG A 22 -5.552 3.654 7.738 1.00 0.00 C ATOM 365 NE ARG A 22 -4.498 4.022 8.722 1.00 0.00 N ATOM 366 CZ ARG A 22 -3.472 4.734 8.344 1.00 0.00 C ATOM 367 NH1 ARG A 22 -3.549 6.037 8.343 1.00 0.00 N ATOM 368 NH2 ARG A 22 -2.369 4.146 7.968 1.00 0.00 N ATOM 0 H ARG A 22 -4.908 -1.375 7.680 1.00 0.00 H new ATOM 0 HA ARG A 22 -4.067 1.433 7.359 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -6.362 1.466 6.449 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -6.951 0.515 7.797 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -7.473 2.827 8.287 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -6.167 2.362 9.359 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -5.094 3.328 6.804 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.166 4.524 7.505 1.00 0.00 H new ATOM 0 HE ARG A 22 -4.578 3.718 9.692 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -4.410 6.497 8.637 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -2.748 6.595 8.048 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -2.308 3.128 7.969 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.568 4.705 7.673 1.00 0.00 H new ATOM 382 N ARG A 23 -3.433 1.011 9.737 1.00 0.00 N ATOM 383 CA ARG A 23 -3.149 0.896 11.184 1.00 0.00 C ATOM 384 C ARG A 23 -4.188 1.701 11.967 1.00 0.00 C ATOM 385 O ARG A 23 -4.105 2.909 12.059 1.00 0.00 O ATOM 386 CB ARG A 23 -1.756 1.455 11.452 1.00 0.00 C ATOM 387 CG ARG A 23 -1.547 2.742 10.650 1.00 0.00 C ATOM 388 CD ARG A 23 -0.913 3.806 11.550 1.00 0.00 C ATOM 389 NE ARG A 23 0.543 3.522 11.703 1.00 0.00 N ATOM 390 CZ ARG A 23 1.339 4.436 12.188 1.00 0.00 C ATOM 391 NH1 ARG A 23 0.849 5.422 12.888 1.00 0.00 N ATOM 392 NH2 ARG A 23 2.625 4.361 11.978 1.00 0.00 N ATOM 0 H ARG A 23 -2.688 1.430 9.181 1.00 0.00 H new ATOM 0 HA ARG A 23 -3.195 -0.147 11.497 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -1.634 1.656 12.516 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -1.000 0.719 11.178 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.905 2.548 9.791 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -2.500 3.100 10.261 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -1.058 4.796 11.119 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -1.399 3.809 12.526 1.00 0.00 H new ATOM 0 HE ARG A 23 0.917 2.614 11.429 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -0.155 5.478 13.056 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.470 6.136 13.267 1.00 0.00 H new ATOM 0 HH21 ARG A 23 3.009 3.588 11.435 1.00 0.00 H new ATOM 0 HH22 ARG A 23 3.246 5.076 12.357 1.00 0.00 H new ATOM 406 N ALA A 24 -5.171 1.036 12.520 1.00 0.00 N ATOM 407 CA ALA A 24 -6.229 1.751 13.297 1.00 0.00 C ATOM 408 C ALA A 24 -5.605 2.902 14.089 1.00 0.00 C ATOM 409 O ALA A 24 -4.888 2.693 15.049 1.00 0.00 O ATOM 410 CB ALA A 24 -6.895 0.775 14.268 1.00 0.00 C ATOM 0 H ALA A 24 -5.287 0.024 12.466 1.00 0.00 H new ATOM 0 HA ALA A 24 -6.972 2.149 12.606 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -7.667 1.296 14.835 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -7.346 -0.044 13.708 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -6.147 0.377 14.954 1.00 0.00 H new ATOM 416 N ALA A 25 -5.868 4.118 13.693 1.00 0.00 N ATOM 417 CA ALA A 25 -5.288 5.280 14.420 1.00 0.00 C ATOM 418 C ALA A 25 -6.407 6.236 14.838 1.00 0.00 C ATOM 419 O ALA A 25 -6.244 7.440 14.833 1.00 0.00 O ATOM 420 CB ALA A 25 -4.305 6.011 13.504 1.00 0.00 C ATOM 0 H ALA A 25 -6.460 4.356 12.897 1.00 0.00 H new ATOM 0 HA ALA A 25 -4.765 4.928 15.309 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -3.879 6.863 14.034 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -3.507 5.330 13.210 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -4.829 6.362 12.615 1.00 0.00 H new ATOM 426 N ASP A 26 -7.542 5.708 15.204 1.00 0.00 N ATOM 427 CA ASP A 26 -8.671 6.586 15.628 1.00 0.00 C ATOM 428 C ASP A 26 -9.241 7.321 14.412 1.00 0.00 C ATOM 429 O ASP A 26 -10.112 8.158 14.535 1.00 0.00 O ATOM 430 CB ASP A 26 -8.157 7.608 16.645 1.00 0.00 C ATOM 431 CG ASP A 26 -7.118 6.944 17.550 1.00 0.00 C ATOM 432 OD1 ASP A 26 -7.518 6.303 18.507 1.00 0.00 O ATOM 433 OD2 ASP A 26 -5.939 7.087 17.268 1.00 0.00 O ATOM 0 H ASP A 26 -7.738 4.707 15.228 1.00 0.00 H new ATOM 0 HA ASP A 26 -9.455 5.977 16.079 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.715 8.460 16.129 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -8.984 7.991 17.242 1.00 0.00 H new ATOM 438 N ALA A 27 -8.758 7.015 13.238 1.00 0.00 N ATOM 439 CA ALA A 27 -9.276 7.699 12.019 1.00 0.00 C ATOM 440 C ALA A 27 -9.380 9.204 12.279 1.00 0.00 C ATOM 441 O ALA A 27 -8.752 9.733 13.175 1.00 0.00 O ATOM 442 CB ALA A 27 -10.657 7.145 11.670 1.00 0.00 C ATOM 0 H ALA A 27 -8.028 6.322 13.071 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.593 7.522 11.188 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.035 7.646 10.779 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.582 6.074 11.481 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.340 7.320 12.501 1.00 0.00 H new ATOM 448 N HIS A 28 -10.168 9.898 11.504 1.00 0.00 N ATOM 449 CA HIS A 28 -10.308 11.368 11.709 1.00 0.00 C ATOM 450 C HIS A 28 -11.354 11.922 10.740 1.00 0.00 C ATOM 451 O HIS A 28 -11.125 12.902 10.059 1.00 0.00 O ATOM 452 CB HIS A 28 -8.963 12.049 11.450 1.00 0.00 C ATOM 453 CG HIS A 28 -8.681 13.040 12.546 1.00 0.00 C ATOM 454 ND1 HIS A 28 -8.433 12.651 13.853 1.00 0.00 N ATOM 455 CD2 HIS A 28 -8.599 14.410 12.542 1.00 0.00 C ATOM 456 CE1 HIS A 28 -8.214 13.766 14.573 1.00 0.00 C ATOM 457 NE2 HIS A 28 -8.305 14.866 13.822 1.00 0.00 N ATOM 0 H HIS A 28 -10.720 9.511 10.739 1.00 0.00 H new ATOM 0 HA HIS A 28 -10.623 11.563 12.734 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -8.169 11.304 11.406 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -8.979 12.554 10.484 1.00 0.00 H new ATOM 0 HD1 HIS A 28 -8.419 11.694 14.205 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -8.741 15.039 11.676 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -7.992 13.771 15.630 1.00 0.00 H new ATOM 465 N MET A 29 -12.501 11.303 10.673 1.00 0.00 N ATOM 466 CA MET A 29 -13.562 11.794 9.747 1.00 0.00 C ATOM 467 C MET A 29 -14.613 10.698 9.551 1.00 0.00 C ATOM 468 O MET A 29 -15.600 10.635 10.259 1.00 0.00 O ATOM 469 CB MET A 29 -12.936 12.142 8.395 1.00 0.00 C ATOM 470 CG MET A 29 -12.856 13.663 8.240 1.00 0.00 C ATOM 471 SD MET A 29 -14.048 14.206 6.991 1.00 0.00 S ATOM 472 CE MET A 29 -12.945 14.097 5.562 1.00 0.00 C ATOM 0 H MET A 29 -12.750 10.478 11.219 1.00 0.00 H new ATOM 0 HA MET A 29 -14.033 12.681 10.171 1.00 0.00 H new ATOM 0 HB2 MET A 29 -11.940 11.706 8.322 1.00 0.00 H new ATOM 0 HB3 MET A 29 -13.531 11.715 7.587 1.00 0.00 H new ATOM 0 HG2 MET A 29 -13.066 14.148 9.193 1.00 0.00 H new ATOM 0 HG3 MET A 29 -11.848 13.957 7.948 1.00 0.00 H new ATOM 0 HE1 MET A 29 -13.484 14.394 4.663 1.00 0.00 H new ATOM 0 HE2 MET A 29 -12.092 14.760 5.709 1.00 0.00 H new ATOM 0 HE3 MET A 29 -12.592 13.072 5.452 1.00 0.00 H new ATOM 482 N ALA A 30 -14.407 9.832 8.598 1.00 0.00 N ATOM 483 CA ALA A 30 -15.390 8.739 8.357 1.00 0.00 C ATOM 484 C ALA A 30 -14.638 7.428 8.122 1.00 0.00 C ATOM 485 O ALA A 30 -14.367 6.683 9.044 1.00 0.00 O ATOM 486 CB ALA A 30 -16.236 9.074 7.126 1.00 0.00 C ATOM 0 H ALA A 30 -13.599 9.834 7.975 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.042 8.635 9.224 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.955 8.274 6.950 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -16.769 10.010 7.294 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -15.588 9.177 6.256 1.00 0.00 H new ATOM 492 N ASN A 31 -14.288 7.145 6.898 1.00 0.00 N ATOM 493 CA ASN A 31 -13.543 5.889 6.608 1.00 0.00 C ATOM 494 C ASN A 31 -12.078 6.232 6.343 1.00 0.00 C ATOM 495 O ASN A 31 -11.751 6.891 5.377 1.00 0.00 O ATOM 496 CB ASN A 31 -14.139 5.210 5.373 1.00 0.00 C ATOM 497 CG ASN A 31 -15.636 4.982 5.586 1.00 0.00 C ATOM 498 OD1 ASN A 31 -16.451 5.777 5.159 1.00 0.00 O ATOM 499 ND2 ASN A 31 -16.035 3.923 6.236 1.00 0.00 N ATOM 0 H ASN A 31 -14.486 7.730 6.086 1.00 0.00 H new ATOM 0 HA ASN A 31 -13.618 5.212 7.459 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -13.977 5.830 4.491 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -13.638 4.259 5.191 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -17.031 3.762 6.386 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -15.351 3.256 6.594 1.00 0.00 H new ATOM 506 N LYS A 32 -11.193 5.801 7.197 1.00 0.00 N ATOM 507 CA LYS A 32 -9.754 6.116 6.990 1.00 0.00 C ATOM 508 C LYS A 32 -8.971 4.830 6.717 1.00 0.00 C ATOM 509 O LYS A 32 -9.062 3.868 7.452 1.00 0.00 O ATOM 510 CB LYS A 32 -9.197 6.793 8.244 1.00 0.00 C ATOM 511 CG LYS A 32 -9.813 8.186 8.394 1.00 0.00 C ATOM 512 CD LYS A 32 -9.744 8.927 7.057 1.00 0.00 C ATOM 513 CE LYS A 32 -9.555 10.422 7.313 1.00 0.00 C ATOM 514 NZ LYS A 32 -8.118 10.778 7.140 1.00 0.00 N ATOM 0 H LYS A 32 -11.403 5.246 8.027 1.00 0.00 H new ATOM 0 HA LYS A 32 -9.654 6.784 6.135 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.419 6.190 9.124 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.112 6.870 8.176 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.849 8.103 8.721 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -9.281 8.749 9.161 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.919 8.542 6.458 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.658 8.757 6.487 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.170 11.000 6.623 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -9.884 10.674 8.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.902 11.630 7.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.523 9.991 7.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.924 10.962 6.135 1.00 0.00 H new ATOM 528 N LEU A 33 -8.197 4.815 5.666 1.00 0.00 N ATOM 529 CA LEU A 33 -7.396 3.607 5.336 1.00 0.00 C ATOM 530 C LEU A 33 -6.082 4.026 4.708 1.00 0.00 C ATOM 531 O LEU A 33 -5.768 5.193 4.601 1.00 0.00 O ATOM 532 CB LEU A 33 -8.151 2.724 4.365 1.00 0.00 C ATOM 533 CG LEU A 33 -8.728 3.573 3.247 1.00 0.00 C ATOM 534 CD1 LEU A 33 -8.355 2.958 1.898 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.242 3.606 3.407 1.00 0.00 C ATOM 0 H LEU A 33 -8.086 5.595 5.018 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.208 3.050 6.254 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.484 1.966 3.953 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.951 2.196 4.884 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.329 4.586 3.291 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.769 3.567 1.094 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -7.270 2.920 1.803 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.760 1.948 1.834 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -10.679 4.212 2.613 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.636 2.592 3.348 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.496 4.039 4.375 1.00 0.00 H new ATOM 547 N GLU A 34 -5.317 3.075 4.290 1.00 0.00 N ATOM 548 CA GLU A 34 -4.023 3.391 3.657 1.00 0.00 C ATOM 549 C GLU A 34 -3.552 2.170 2.909 1.00 0.00 C ATOM 550 O GLU A 34 -4.329 1.325 2.524 1.00 0.00 O ATOM 551 CB GLU A 34 -2.992 3.755 4.725 1.00 0.00 C ATOM 552 CG GLU A 34 -2.036 4.816 4.179 1.00 0.00 C ATOM 553 CD GLU A 34 -0.675 4.679 4.866 1.00 0.00 C ATOM 554 OE1 GLU A 34 -0.563 3.852 5.756 1.00 0.00 O ATOM 555 OE2 GLU A 34 0.232 5.404 4.491 1.00 0.00 O ATOM 0 H GLU A 34 -5.534 2.081 4.360 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.141 4.236 2.978 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -3.495 4.129 5.617 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -2.434 2.867 5.023 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.924 4.700 3.101 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -2.444 5.812 4.352 1.00 0.00 H new ATOM 562 N PHE A 35 -2.284 2.054 2.734 1.00 0.00 N ATOM 563 CA PHE A 35 -1.748 0.865 2.042 1.00 0.00 C ATOM 564 C PHE A 35 -0.925 0.065 3.050 1.00 0.00 C ATOM 565 O PHE A 35 -0.499 0.600 4.055 1.00 0.00 O ATOM 566 CB PHE A 35 -0.886 1.311 0.859 1.00 0.00 C ATOM 567 CG PHE A 35 -1.784 1.939 -0.180 1.00 0.00 C ATOM 568 CD1 PHE A 35 -2.562 1.126 -1.014 1.00 0.00 C ATOM 569 CD2 PHE A 35 -1.849 3.332 -0.303 1.00 0.00 C ATOM 570 CE1 PHE A 35 -3.405 1.705 -1.968 1.00 0.00 C ATOM 571 CE2 PHE A 35 -2.691 3.911 -1.260 1.00 0.00 C ATOM 572 CZ PHE A 35 -3.470 3.098 -2.092 1.00 0.00 C ATOM 0 H PHE A 35 -1.587 2.733 3.040 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.553 0.241 1.655 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.131 2.025 1.189 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.355 0.459 0.435 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -2.511 0.051 -0.920 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.250 3.960 0.340 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.006 1.077 -2.609 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.740 4.986 -1.356 1.00 0.00 H new ATOM 0 HZ PHE A 35 -4.121 3.545 -2.829 1.00 0.00 H new ATOM 582 N PRO A 36 -0.733 -1.192 2.764 1.00 0.00 N ATOM 583 CA PRO A 36 0.028 -2.082 3.652 1.00 0.00 C ATOM 584 C PRO A 36 1.444 -1.535 3.861 1.00 0.00 C ATOM 585 O PRO A 36 1.682 -0.348 3.754 1.00 0.00 O ATOM 586 CB PRO A 36 0.056 -3.431 2.923 1.00 0.00 C ATOM 587 CG PRO A 36 -0.725 -3.268 1.594 1.00 0.00 C ATOM 588 CD PRO A 36 -1.253 -1.826 1.538 1.00 0.00 C ATOM 0 HA PRO A 36 -0.418 -2.169 4.643 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.083 -3.738 2.727 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -0.397 -4.208 3.539 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -0.077 -3.472 0.742 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.549 -3.980 1.545 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -0.902 -1.309 0.645 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.342 -1.803 1.511 1.00 0.00 H new ATOM 596 N GLY A 37 2.381 -2.388 4.161 1.00 0.00 N ATOM 597 CA GLY A 37 3.776 -1.917 4.380 1.00 0.00 C ATOM 598 C GLY A 37 3.921 -1.396 5.811 1.00 0.00 C ATOM 599 O GLY A 37 3.042 -1.559 6.634 1.00 0.00 O ATOM 0 H GLY A 37 2.241 -3.393 4.264 1.00 0.00 H new ATOM 0 HA2 GLY A 37 4.478 -2.733 4.206 1.00 0.00 H new ATOM 0 HA3 GLY A 37 4.021 -1.129 3.668 1.00 0.00 H new ATOM 603 N GLY A 38 5.028 -0.774 6.111 1.00 0.00 N ATOM 604 CA GLY A 38 5.239 -0.241 7.486 1.00 0.00 C ATOM 605 C GLY A 38 6.633 0.382 7.570 1.00 0.00 C ATOM 606 O GLY A 38 6.834 1.398 8.207 1.00 0.00 O ATOM 0 H GLY A 38 5.797 -0.612 5.461 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.479 0.504 7.722 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.139 -1.041 8.219 1.00 0.00 H new ATOM 610 N LYS A 39 7.592 -0.219 6.924 1.00 0.00 N ATOM 611 CA LYS A 39 8.975 0.326 6.951 1.00 0.00 C ATOM 612 C LYS A 39 9.819 -0.400 5.902 1.00 0.00 C ATOM 613 O LYS A 39 9.659 -1.583 5.674 1.00 0.00 O ATOM 614 CB LYS A 39 9.589 0.113 8.335 1.00 0.00 C ATOM 615 CG LYS A 39 10.439 1.329 8.703 1.00 0.00 C ATOM 616 CD LYS A 39 10.434 1.517 10.220 1.00 0.00 C ATOM 617 CE LYS A 39 11.258 2.754 10.583 1.00 0.00 C ATOM 618 NZ LYS A 39 12.362 2.361 11.502 1.00 0.00 N ATOM 0 H LYS A 39 7.475 -1.071 6.375 1.00 0.00 H new ATOM 0 HA LYS A 39 8.950 1.393 6.732 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.803 -0.033 9.076 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.202 -0.788 8.339 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.460 1.193 8.346 1.00 0.00 H new ATOM 0 HG3 LYS A 39 10.047 2.221 8.214 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.411 1.630 10.580 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.848 0.635 10.708 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.666 3.210 9.681 1.00 0.00 H new ATOM 0 HE3 LYS A 39 10.623 3.501 11.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.923 3.201 11.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.962 1.944 12.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.973 1.663 11.032 1.00 0.00 H new ATOM 632 N ILE A 40 10.715 0.295 5.258 1.00 0.00 N ATOM 633 CA ILE A 40 11.561 -0.362 4.223 1.00 0.00 C ATOM 634 C ILE A 40 12.937 -0.687 4.811 1.00 0.00 C ATOM 635 O ILE A 40 13.695 0.193 5.168 1.00 0.00 O ATOM 636 CB ILE A 40 11.721 0.578 3.028 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.329 -0.193 1.855 1.00 0.00 C ATOM 638 CG2 ILE A 40 12.640 1.741 3.404 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.042 0.553 0.552 1.00 0.00 C ATOM 0 H ILE A 40 10.898 1.288 5.403 1.00 0.00 H new ATOM 0 HA ILE A 40 11.084 -1.286 3.897 1.00 0.00 H new ATOM 0 HB ILE A 40 10.744 0.970 2.743 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.404 -0.301 1.995 1.00 0.00 H new ATOM 0 HG13 ILE A 40 11.911 -1.199 1.811 1.00 0.00 H new ATOM 0 HG21 ILE A 40 12.751 2.408 2.549 1.00 0.00 H new ATOM 0 HG22 ILE A 40 12.207 2.291 4.240 1.00 0.00 H new ATOM 0 HG23 ILE A 40 13.618 1.354 3.691 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.475 0.004 -0.284 1.00 0.00 H new ATOM 0 HD12 ILE A 40 10.964 0.638 0.411 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.482 1.549 0.599 1.00 0.00 H new ATOM 651 N GLU A 41 13.265 -1.948 4.915 1.00 0.00 N ATOM 652 CA GLU A 41 14.590 -2.332 5.477 1.00 0.00 C ATOM 653 C GLU A 41 15.535 -2.710 4.334 1.00 0.00 C ATOM 654 O GLU A 41 15.192 -2.605 3.174 1.00 0.00 O ATOM 655 CB GLU A 41 14.423 -3.534 6.410 1.00 0.00 C ATOM 656 CG GLU A 41 13.070 -3.451 7.119 1.00 0.00 C ATOM 657 CD GLU A 41 12.786 -4.773 7.833 1.00 0.00 C ATOM 658 OE1 GLU A 41 13.634 -5.206 8.596 1.00 0.00 O ATOM 659 OE2 GLU A 41 11.724 -5.331 7.606 1.00 0.00 O ATOM 0 H GLU A 41 12.671 -2.728 4.634 1.00 0.00 H new ATOM 0 HA GLU A 41 15.003 -1.492 6.035 1.00 0.00 H new ATOM 0 HB2 GLU A 41 14.490 -4.461 5.840 1.00 0.00 H new ATOM 0 HB3 GLU A 41 15.229 -3.552 7.144 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.074 -2.631 7.837 1.00 0.00 H new ATOM 0 HG3 GLU A 41 12.282 -3.239 6.397 1.00 0.00 H new ATOM 666 N MET A 42 16.722 -3.153 4.652 1.00 0.00 N ATOM 667 CA MET A 42 17.683 -3.538 3.581 1.00 0.00 C ATOM 668 C MET A 42 17.757 -2.418 2.540 1.00 0.00 C ATOM 669 O MET A 42 17.115 -1.395 2.672 1.00 0.00 O ATOM 670 CB MET A 42 17.199 -4.827 2.910 1.00 0.00 C ATOM 671 CG MET A 42 18.023 -6.013 3.416 1.00 0.00 C ATOM 672 SD MET A 42 17.436 -6.501 5.060 1.00 0.00 S ATOM 673 CE MET A 42 19.058 -6.827 5.790 1.00 0.00 C ATOM 0 H MET A 42 17.066 -3.264 5.606 1.00 0.00 H new ATOM 0 HA MET A 42 18.671 -3.699 4.013 1.00 0.00 H new ATOM 0 HB2 MET A 42 16.143 -4.987 3.127 1.00 0.00 H new ATOM 0 HB3 MET A 42 17.293 -4.742 1.827 1.00 0.00 H new ATOM 0 HG2 MET A 42 17.937 -6.851 2.724 1.00 0.00 H new ATOM 0 HG3 MET A 42 19.078 -5.744 3.460 1.00 0.00 H new ATOM 0 HE1 MET A 42 18.934 -7.148 6.824 1.00 0.00 H new ATOM 0 HE2 MET A 42 19.561 -7.612 5.224 1.00 0.00 H new ATOM 0 HE3 MET A 42 19.659 -5.918 5.762 1.00 0.00 H new ATOM 683 N GLY A 43 18.530 -2.600 1.504 1.00 0.00 N ATOM 684 CA GLY A 43 18.630 -1.542 0.460 1.00 0.00 C ATOM 685 C GLY A 43 17.223 -1.158 0.004 1.00 0.00 C ATOM 686 O GLY A 43 16.322 -1.973 -0.004 1.00 0.00 O ATOM 0 H GLY A 43 19.095 -3.433 1.336 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.148 -0.669 0.857 1.00 0.00 H new ATOM 0 HA3 GLY A 43 19.215 -1.902 -0.386 1.00 0.00 H new ATOM 690 N GLU A 44 17.022 0.074 -0.372 1.00 0.00 N ATOM 691 CA GLU A 44 15.665 0.496 -0.817 1.00 0.00 C ATOM 692 C GLU A 44 15.539 0.318 -2.329 1.00 0.00 C ATOM 693 O GLU A 44 16.289 0.883 -3.100 1.00 0.00 O ATOM 694 CB GLU A 44 15.439 1.965 -0.462 1.00 0.00 C ATOM 695 CG GLU A 44 15.037 2.083 1.011 1.00 0.00 C ATOM 696 CD GLU A 44 16.269 1.893 1.899 1.00 0.00 C ATOM 697 OE1 GLU A 44 17.362 1.850 1.362 1.00 0.00 O ATOM 698 OE2 GLU A 44 16.097 1.798 3.103 1.00 0.00 O ATOM 0 H GLU A 44 17.735 0.804 -0.391 1.00 0.00 H new ATOM 0 HA GLU A 44 14.919 -0.119 -0.314 1.00 0.00 H new ATOM 0 HB2 GLU A 44 16.347 2.538 -0.648 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.660 2.387 -1.097 1.00 0.00 H new ATOM 0 HG2 GLU A 44 14.589 3.059 1.199 1.00 0.00 H new ATOM 0 HG3 GLU A 44 14.283 1.334 1.253 1.00 0.00 H new ATOM 705 N THR A 45 14.587 -0.461 -2.756 1.00 0.00 N ATOM 706 CA THR A 45 14.399 -0.678 -4.214 1.00 0.00 C ATOM 707 C THR A 45 12.978 -1.190 -4.480 1.00 0.00 C ATOM 708 O THR A 45 12.201 -1.369 -3.564 1.00 0.00 O ATOM 709 CB THR A 45 15.415 -1.699 -4.714 1.00 0.00 C ATOM 710 OG1 THR A 45 16.223 -2.127 -3.628 1.00 0.00 O ATOM 711 CG2 THR A 45 16.286 -1.052 -5.789 1.00 0.00 C ATOM 0 H THR A 45 13.929 -0.958 -2.155 1.00 0.00 H new ATOM 0 HA THR A 45 14.546 0.265 -4.741 1.00 0.00 H new ATOM 0 HB THR A 45 14.900 -2.561 -5.138 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.053 -2.518 -3.972 1.00 0.00 H new ATOM 0 HG21 THR A 45 17.015 -1.777 -6.151 1.00 0.00 H new ATOM 0 HG22 THR A 45 15.658 -0.724 -6.617 1.00 0.00 H new ATOM 0 HG23 THR A 45 16.807 -0.193 -5.367 1.00 0.00 H new ATOM 719 N PRO A 46 12.683 -1.392 -5.739 1.00 0.00 N ATOM 720 CA PRO A 46 11.358 -1.865 -6.178 1.00 0.00 C ATOM 721 C PRO A 46 11.171 -3.348 -5.849 1.00 0.00 C ATOM 722 O PRO A 46 10.064 -3.848 -5.805 1.00 0.00 O ATOM 723 CB PRO A 46 11.367 -1.661 -7.699 1.00 0.00 C ATOM 724 CG PRO A 46 12.811 -1.267 -8.110 1.00 0.00 C ATOM 725 CD PRO A 46 13.645 -1.159 -6.829 1.00 0.00 C ATOM 0 HA PRO A 46 10.547 -1.331 -5.682 1.00 0.00 H new ATOM 0 HB2 PRO A 46 11.059 -2.573 -8.210 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.661 -0.881 -7.985 1.00 0.00 H new ATOM 0 HG2 PRO A 46 13.235 -2.014 -8.781 1.00 0.00 H new ATOM 0 HG3 PRO A 46 12.811 -0.319 -8.648 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.447 -1.897 -6.815 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.113 -0.178 -6.742 1.00 0.00 H new ATOM 733 N GLU A 47 12.242 -4.063 -5.637 1.00 0.00 N ATOM 734 CA GLU A 47 12.114 -5.515 -5.333 1.00 0.00 C ATOM 735 C GLU A 47 12.806 -5.837 -4.009 1.00 0.00 C ATOM 736 O GLU A 47 12.203 -6.329 -3.094 1.00 0.00 O ATOM 737 CB GLU A 47 12.784 -6.316 -6.447 1.00 0.00 C ATOM 738 CG GLU A 47 11.743 -7.188 -7.150 1.00 0.00 C ATOM 739 CD GLU A 47 10.747 -6.293 -7.889 1.00 0.00 C ATOM 740 OE1 GLU A 47 9.765 -5.903 -7.278 1.00 0.00 O ATOM 741 OE2 GLU A 47 10.984 -6.010 -9.051 1.00 0.00 O ATOM 0 H GLU A 47 13.197 -3.705 -5.661 1.00 0.00 H new ATOM 0 HA GLU A 47 11.058 -5.774 -5.260 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.251 -5.641 -7.164 1.00 0.00 H new ATOM 0 HB3 GLU A 47 13.576 -6.940 -6.034 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.232 -7.863 -7.852 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.221 -7.809 -6.422 1.00 0.00 H new ATOM 748 N GLN A 48 14.071 -5.568 -3.919 1.00 0.00 N ATOM 749 CA GLN A 48 14.838 -5.853 -2.691 1.00 0.00 C ATOM 750 C GLN A 48 14.064 -5.428 -1.473 1.00 0.00 C ATOM 751 O GLN A 48 14.171 -5.997 -0.405 1.00 0.00 O ATOM 752 CB GLN A 48 16.136 -5.065 -2.750 1.00 0.00 C ATOM 753 CG GLN A 48 17.262 -6.003 -2.405 1.00 0.00 C ATOM 754 CD GLN A 48 18.564 -5.512 -3.038 1.00 0.00 C ATOM 755 OE1 GLN A 48 19.594 -5.481 -2.393 1.00 0.00 O ATOM 756 NE2 GLN A 48 18.564 -5.124 -4.284 1.00 0.00 N ATOM 0 H GLN A 48 14.619 -5.150 -4.671 1.00 0.00 H new ATOM 0 HA GLN A 48 15.032 -6.924 -2.625 1.00 0.00 H new ATOM 0 HB2 GLN A 48 16.282 -4.643 -3.745 1.00 0.00 H new ATOM 0 HB3 GLN A 48 16.107 -4.229 -2.051 1.00 0.00 H new ATOM 0 HG2 GLN A 48 17.375 -6.066 -1.323 1.00 0.00 H new ATOM 0 HG3 GLN A 48 17.031 -7.007 -2.760 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.700 -5.150 -4.826 1.00 0.00 H new ATOM 0 HE22 GLN A 48 19.428 -4.795 -4.716 1.00 0.00 H new ATOM 765 N ALA A 49 13.322 -4.406 -1.621 1.00 0.00 N ATOM 766 CA ALA A 49 12.549 -3.897 -0.472 1.00 0.00 C ATOM 767 C ALA A 49 11.252 -4.697 -0.284 1.00 0.00 C ATOM 768 O ALA A 49 10.995 -5.244 0.770 1.00 0.00 O ATOM 769 CB ALA A 49 12.218 -2.417 -0.680 1.00 0.00 C ATOM 0 H ALA A 49 13.207 -3.886 -2.491 1.00 0.00 H new ATOM 0 HA ALA A 49 13.157 -4.011 0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.647 -2.049 0.172 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.142 -1.847 -0.772 1.00 0.00 H new ATOM 0 HB3 ALA A 49 11.628 -2.300 -1.589 1.00 0.00 H new ATOM 775 N VAL A 50 10.430 -4.747 -1.292 1.00 0.00 N ATOM 776 CA VAL A 50 9.132 -5.481 -1.185 1.00 0.00 C ATOM 777 C VAL A 50 9.343 -6.980 -1.413 1.00 0.00 C ATOM 778 O VAL A 50 8.408 -7.755 -1.437 1.00 0.00 O ATOM 779 CB VAL A 50 8.182 -4.911 -2.234 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.393 -5.606 -3.582 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.738 -5.098 -1.785 1.00 0.00 C ATOM 0 H VAL A 50 10.600 -4.307 -2.197 1.00 0.00 H new ATOM 0 HA VAL A 50 8.711 -5.355 -0.188 1.00 0.00 H new ATOM 0 HB VAL A 50 8.392 -3.847 -2.348 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.707 -5.187 -4.319 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.420 -5.452 -3.914 1.00 0.00 H new ATOM 0 HG13 VAL A 50 8.202 -6.674 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.066 -4.688 -2.539 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.532 -6.160 -1.654 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.581 -4.579 -0.839 1.00 0.00 H new ATOM 791 N VAL A 51 10.562 -7.386 -1.554 1.00 0.00 N ATOM 792 CA VAL A 51 10.859 -8.821 -1.750 1.00 0.00 C ATOM 793 C VAL A 51 10.868 -9.422 -0.366 1.00 0.00 C ATOM 794 O VAL A 51 10.407 -10.517 -0.115 1.00 0.00 O ATOM 795 CB VAL A 51 12.234 -8.955 -2.394 1.00 0.00 C ATOM 796 CG1 VAL A 51 13.290 -8.447 -1.423 1.00 0.00 C ATOM 797 CG2 VAL A 51 12.514 -10.409 -2.715 1.00 0.00 C ATOM 0 H VAL A 51 11.379 -6.776 -1.542 1.00 0.00 H new ATOM 0 HA VAL A 51 10.133 -9.318 -2.394 1.00 0.00 H new ATOM 0 HB VAL A 51 12.259 -8.372 -3.314 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.277 -8.540 -1.877 1.00 0.00 H new ATOM 0 HG12 VAL A 51 13.095 -7.400 -1.189 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.255 -9.036 -0.507 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.498 -10.497 -3.175 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.489 -10.996 -1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 51 11.757 -10.782 -3.405 1.00 0.00 H new ATOM 807 N ARG A 52 11.385 -8.651 0.537 1.00 0.00 N ATOM 808 CA ARG A 52 11.452 -9.054 1.949 1.00 0.00 C ATOM 809 C ARG A 52 10.053 -8.944 2.556 1.00 0.00 C ATOM 810 O ARG A 52 9.694 -9.694 3.440 1.00 0.00 O ATOM 811 CB ARG A 52 12.396 -8.092 2.666 1.00 0.00 C ATOM 812 CG ARG A 52 13.712 -8.799 2.995 1.00 0.00 C ATOM 813 CD ARG A 52 13.453 -9.983 3.928 1.00 0.00 C ATOM 814 NE ARG A 52 14.528 -10.999 3.743 1.00 0.00 N ATOM 815 CZ ARG A 52 14.684 -11.952 4.618 1.00 0.00 C ATOM 816 NH1 ARG A 52 14.734 -11.668 5.890 1.00 0.00 N ATOM 817 NH2 ARG A 52 14.792 -13.191 4.221 1.00 0.00 N ATOM 0 H ARG A 52 11.775 -7.729 0.343 1.00 0.00 H new ATOM 0 HA ARG A 52 11.811 -10.078 2.048 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.588 -7.222 2.038 1.00 0.00 H new ATOM 0 HB3 ARG A 52 11.931 -7.727 3.582 1.00 0.00 H new ATOM 0 HG2 ARG A 52 14.187 -9.146 2.077 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.402 -8.099 3.466 1.00 0.00 H new ATOM 0 HD2 ARG A 52 13.429 -9.646 4.964 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.479 -10.424 3.714 1.00 0.00 H new ATOM 0 HE ARG A 52 15.142 -10.948 2.930 1.00 0.00 H new ATOM 0 HH11 ARG A 52 14.651 -10.700 6.200 1.00 0.00 H new ATOM 0 HH12 ARG A 52 14.856 -12.414 6.575 1.00 0.00 H new ATOM 0 HH21 ARG A 52 14.754 -13.413 3.226 1.00 0.00 H new ATOM 0 HH22 ARG A 52 14.914 -13.937 4.906 1.00 0.00 H new ATOM 831 N GLU A 53 9.250 -8.021 2.082 1.00 0.00 N ATOM 832 CA GLU A 53 7.874 -7.888 2.639 1.00 0.00 C ATOM 833 C GLU A 53 7.027 -9.070 2.166 1.00 0.00 C ATOM 834 O GLU A 53 5.904 -9.258 2.592 1.00 0.00 O ATOM 835 CB GLU A 53 7.252 -6.579 2.154 1.00 0.00 C ATOM 836 CG GLU A 53 7.859 -5.410 2.933 1.00 0.00 C ATOM 837 CD GLU A 53 6.855 -4.912 3.973 1.00 0.00 C ATOM 838 OE1 GLU A 53 6.015 -5.698 4.380 1.00 0.00 O ATOM 839 OE2 GLU A 53 6.944 -3.754 4.346 1.00 0.00 O ATOM 0 H GLU A 53 9.488 -7.362 1.341 1.00 0.00 H new ATOM 0 HA GLU A 53 7.915 -7.882 3.728 1.00 0.00 H new ATOM 0 HB2 GLU A 53 7.432 -6.452 1.086 1.00 0.00 H new ATOM 0 HB3 GLU A 53 6.171 -6.603 2.295 1.00 0.00 H new ATOM 0 HG2 GLU A 53 8.780 -5.725 3.423 1.00 0.00 H new ATOM 0 HG3 GLU A 53 8.122 -4.602 2.250 1.00 0.00 H new ATOM 846 N LEU A 54 7.567 -9.866 1.289 1.00 0.00 N ATOM 847 CA LEU A 54 6.822 -11.042 0.772 1.00 0.00 C ATOM 848 C LEU A 54 6.828 -12.149 1.823 1.00 0.00 C ATOM 849 O LEU A 54 5.810 -12.494 2.381 1.00 0.00 O ATOM 850 CB LEU A 54 7.519 -11.558 -0.492 1.00 0.00 C ATOM 851 CG LEU A 54 6.490 -11.846 -1.587 1.00 0.00 C ATOM 852 CD1 LEU A 54 5.373 -12.731 -1.031 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.905 -10.524 -2.085 1.00 0.00 C ATOM 0 H LEU A 54 8.504 -9.749 0.904 1.00 0.00 H new ATOM 0 HA LEU A 54 5.796 -10.754 0.545 1.00 0.00 H new ATOM 0 HB2 LEU A 54 8.239 -10.820 -0.845 1.00 0.00 H new ATOM 0 HB3 LEU A 54 8.079 -12.465 -0.262 1.00 0.00 H new ATOM 0 HG LEU A 54 6.973 -12.367 -2.414 1.00 0.00 H new ATOM 0 HD11 LEU A 54 4.644 -12.932 -1.816 1.00 0.00 H new ATOM 0 HD12 LEU A 54 5.796 -13.672 -0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.883 -12.220 -0.202 1.00 0.00 H new ATOM 0 HD21 LEU A 54 5.171 -10.722 -2.866 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.423 -10.005 -1.257 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.704 -9.901 -2.488 1.00 0.00 H new ATOM 865 N GLN A 55 7.971 -12.720 2.078 1.00 0.00 N ATOM 866 CA GLN A 55 8.051 -13.829 3.077 1.00 0.00 C ATOM 867 C GLN A 55 8.135 -13.286 4.507 1.00 0.00 C ATOM 868 O GLN A 55 7.905 -14.005 5.459 1.00 0.00 O ATOM 869 CB GLN A 55 9.288 -14.681 2.786 1.00 0.00 C ATOM 870 CG GLN A 55 8.999 -15.617 1.611 1.00 0.00 C ATOM 871 CD GLN A 55 9.258 -17.063 2.035 1.00 0.00 C ATOM 872 OE1 GLN A 55 9.232 -17.378 3.208 1.00 0.00 O ATOM 873 NE2 GLN A 55 9.510 -17.961 1.123 1.00 0.00 N ATOM 0 H GLN A 55 8.857 -12.469 1.639 1.00 0.00 H new ATOM 0 HA GLN A 55 7.147 -14.432 2.993 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.138 -14.039 2.553 1.00 0.00 H new ATOM 0 HB3 GLN A 55 9.559 -15.261 3.668 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.965 -15.502 1.286 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.631 -15.357 0.761 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.532 -17.696 0.138 1.00 0.00 H new ATOM 0 HE22 GLN A 55 9.685 -18.928 1.395 1.00 0.00 H new ATOM 882 N GLU A 56 8.474 -12.039 4.679 1.00 0.00 N ATOM 883 CA GLU A 56 8.580 -11.491 6.065 1.00 0.00 C ATOM 884 C GLU A 56 7.193 -11.134 6.607 1.00 0.00 C ATOM 885 O GLU A 56 7.071 -10.377 7.548 1.00 0.00 O ATOM 886 CB GLU A 56 9.446 -10.232 6.061 1.00 0.00 C ATOM 887 CG GLU A 56 10.861 -10.576 5.591 1.00 0.00 C ATOM 888 CD GLU A 56 11.804 -10.616 6.796 1.00 0.00 C ATOM 889 OE1 GLU A 56 12.296 -9.565 7.174 1.00 0.00 O ATOM 890 OE2 GLU A 56 12.018 -11.697 7.320 1.00 0.00 O ATOM 0 H GLU A 56 8.681 -11.379 3.929 1.00 0.00 H new ATOM 0 HA GLU A 56 9.032 -12.252 6.701 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.008 -9.480 5.404 1.00 0.00 H new ATOM 0 HB3 GLU A 56 9.480 -9.800 7.061 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.862 -11.540 5.083 1.00 0.00 H new ATOM 0 HG3 GLU A 56 11.206 -9.835 4.870 1.00 0.00 H new ATOM 897 N GLU A 57 6.145 -11.651 6.027 1.00 0.00 N ATOM 898 CA GLU A 57 4.790 -11.303 6.529 1.00 0.00 C ATOM 899 C GLU A 57 3.834 -12.491 6.367 1.00 0.00 C ATOM 900 O GLU A 57 3.355 -13.050 7.334 1.00 0.00 O ATOM 901 CB GLU A 57 4.271 -10.109 5.733 1.00 0.00 C ATOM 902 CG GLU A 57 4.489 -8.827 6.538 1.00 0.00 C ATOM 903 CD GLU A 57 3.840 -8.972 7.914 1.00 0.00 C ATOM 904 OE1 GLU A 57 2.782 -9.574 7.986 1.00 0.00 O ATOM 905 OE2 GLU A 57 4.409 -8.476 8.872 1.00 0.00 O ATOM 0 H GLU A 57 6.169 -12.293 5.235 1.00 0.00 H new ATOM 0 HA GLU A 57 4.847 -11.054 7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.789 -10.043 4.776 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.211 -10.238 5.513 1.00 0.00 H new ATOM 0 HG2 GLU A 57 5.556 -8.630 6.646 1.00 0.00 H new ATOM 0 HG3 GLU A 57 4.060 -7.976 6.010 1.00 0.00 H new ATOM 912 N VAL A 58 3.547 -12.876 5.154 1.00 0.00 N ATOM 913 CA VAL A 58 2.615 -14.023 4.930 1.00 0.00 C ATOM 914 C VAL A 58 3.315 -15.071 4.059 1.00 0.00 C ATOM 915 O VAL A 58 3.088 -16.258 4.180 1.00 0.00 O ATOM 916 CB VAL A 58 1.362 -13.522 4.196 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.836 -12.246 4.845 1.00 0.00 C ATOM 918 CG2 VAL A 58 1.724 -13.220 2.754 1.00 0.00 C ATOM 0 H VAL A 58 3.917 -12.447 4.306 1.00 0.00 H new ATOM 0 HA VAL A 58 2.332 -14.460 5.888 1.00 0.00 H new ATOM 0 HB VAL A 58 0.592 -14.292 4.247 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.052 -11.906 4.312 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.580 -12.446 5.885 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.603 -11.473 4.802 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.841 -12.863 2.224 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.498 -12.453 2.726 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.094 -14.126 2.274 1.00 0.00 H new ATOM 928 N GLY A 59 4.162 -14.621 3.176 1.00 0.00 N ATOM 929 CA GLY A 59 4.893 -15.545 2.275 1.00 0.00 C ATOM 930 C GLY A 59 3.942 -16.119 1.224 1.00 0.00 C ATOM 931 O GLY A 59 3.663 -17.300 1.200 1.00 0.00 O ATOM 0 H GLY A 59 4.380 -13.634 3.041 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.711 -15.016 1.786 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.338 -16.354 2.855 1.00 0.00 H new ATOM 935 N ILE A 60 3.468 -15.292 0.335 1.00 0.00 N ATOM 936 CA ILE A 60 2.561 -15.792 -0.742 1.00 0.00 C ATOM 937 C ILE A 60 3.404 -16.075 -1.980 1.00 0.00 C ATOM 938 O ILE A 60 4.561 -15.710 -2.048 1.00 0.00 O ATOM 939 CB ILE A 60 1.501 -14.737 -1.116 1.00 0.00 C ATOM 940 CG1 ILE A 60 1.917 -13.362 -0.601 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.147 -15.109 -0.509 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.015 -12.290 -1.209 1.00 0.00 C ATOM 0 H ILE A 60 3.668 -14.292 0.305 1.00 0.00 H new ATOM 0 HA ILE A 60 2.053 -16.687 -0.383 1.00 0.00 H new ATOM 0 HB ILE A 60 1.417 -14.707 -2.202 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.849 -13.334 0.487 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.957 -13.165 -0.860 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.593 -14.356 -0.781 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.168 -16.081 -0.890 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.235 -15.156 0.576 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.315 -11.310 -0.839 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.106 -12.311 -2.295 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -0.020 -12.483 -0.927 1.00 0.00 H new ATOM 954 N THR A 61 2.830 -16.685 -2.973 1.00 0.00 N ATOM 955 CA THR A 61 3.592 -16.943 -4.216 1.00 0.00 C ATOM 956 C THR A 61 2.963 -16.092 -5.312 1.00 0.00 C ATOM 957 O THR A 61 2.046 -16.520 -5.983 1.00 0.00 O ATOM 958 CB THR A 61 3.522 -18.416 -4.607 1.00 0.00 C ATOM 959 OG1 THR A 61 3.606 -19.229 -3.444 1.00 0.00 O ATOM 960 CG2 THR A 61 4.690 -18.723 -5.541 1.00 0.00 C ATOM 0 H THR A 61 1.865 -17.016 -2.976 1.00 0.00 H new ATOM 0 HA THR A 61 4.642 -16.692 -4.069 1.00 0.00 H new ATOM 0 HB THR A 61 2.577 -18.625 -5.109 1.00 0.00 H new ATOM 0 HG1 THR A 61 3.559 -20.174 -3.701 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.657 -19.773 -5.832 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.618 -18.098 -6.431 1.00 0.00 H new ATOM 0 HG23 THR A 61 5.630 -18.518 -5.028 1.00 0.00 H new ATOM 968 N PRO A 62 3.458 -14.893 -5.437 1.00 0.00 N ATOM 969 CA PRO A 62 2.941 -13.936 -6.418 1.00 0.00 C ATOM 970 C PRO A 62 3.070 -14.505 -7.826 1.00 0.00 C ATOM 971 O PRO A 62 4.104 -15.010 -8.216 1.00 0.00 O ATOM 972 CB PRO A 62 3.800 -12.686 -6.234 1.00 0.00 C ATOM 973 CG PRO A 62 4.897 -13.020 -5.191 1.00 0.00 C ATOM 974 CD PRO A 62 4.583 -14.405 -4.623 1.00 0.00 C ATOM 0 HA PRO A 62 1.883 -13.715 -6.277 1.00 0.00 H new ATOM 0 HB2 PRO A 62 4.250 -12.388 -7.181 1.00 0.00 H new ATOM 0 HB3 PRO A 62 3.190 -11.849 -5.894 1.00 0.00 H new ATOM 0 HG2 PRO A 62 5.883 -13.010 -5.655 1.00 0.00 H new ATOM 0 HG3 PRO A 62 4.911 -12.274 -4.397 1.00 0.00 H new ATOM 0 HD2 PRO A 62 5.444 -15.069 -4.698 1.00 0.00 H new ATOM 0 HD3 PRO A 62 4.314 -14.349 -3.568 1.00 0.00 H new ATOM 982 N GLN A 63 2.014 -14.445 -8.583 1.00 0.00 N ATOM 983 CA GLN A 63 2.048 -15.000 -9.959 1.00 0.00 C ATOM 984 C GLN A 63 2.428 -13.906 -10.960 1.00 0.00 C ATOM 985 O GLN A 63 3.372 -14.047 -11.712 1.00 0.00 O ATOM 986 CB GLN A 63 0.668 -15.563 -10.296 1.00 0.00 C ATOM 987 CG GLN A 63 0.036 -16.154 -9.029 1.00 0.00 C ATOM 988 CD GLN A 63 -0.605 -17.502 -9.362 1.00 0.00 C ATOM 989 OE1 GLN A 63 -1.448 -17.586 -10.232 1.00 0.00 O ATOM 990 NE2 GLN A 63 -0.238 -18.566 -8.703 1.00 0.00 N ATOM 0 H GLN A 63 1.123 -14.033 -8.305 1.00 0.00 H new ATOM 0 HA GLN A 63 2.794 -15.793 -10.017 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.031 -14.776 -10.701 1.00 0.00 H new ATOM 0 HB3 GLN A 63 0.754 -16.331 -11.065 1.00 0.00 H new ATOM 0 HG2 GLN A 63 0.794 -16.280 -8.256 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.714 -15.471 -8.631 1.00 0.00 H new ATOM 0 HE21 GLN A 63 0.470 -18.494 -7.972 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.659 -19.470 -8.918 1.00 0.00 H new ATOM 999 N HIS A 64 1.707 -12.817 -10.985 1.00 0.00 N ATOM 1000 CA HIS A 64 2.050 -11.734 -11.952 1.00 0.00 C ATOM 1001 C HIS A 64 1.836 -10.364 -11.308 1.00 0.00 C ATOM 1002 O HIS A 64 0.720 -9.965 -11.037 1.00 0.00 O ATOM 1003 CB HIS A 64 1.155 -11.852 -13.187 1.00 0.00 C ATOM 1004 CG HIS A 64 1.481 -10.739 -14.147 1.00 0.00 C ATOM 1005 ND1 HIS A 64 0.507 -10.104 -14.903 1.00 0.00 N ATOM 1006 CD2 HIS A 64 2.667 -10.131 -14.477 1.00 0.00 C ATOM 1007 CE1 HIS A 64 1.120 -9.161 -15.642 1.00 0.00 C ATOM 1008 NE2 HIS A 64 2.437 -9.136 -15.421 1.00 0.00 N ATOM 0 H HIS A 64 0.904 -12.631 -10.385 1.00 0.00 H new ATOM 0 HA HIS A 64 3.097 -11.836 -12.239 1.00 0.00 H new ATOM 0 HB2 HIS A 64 1.306 -12.818 -13.668 1.00 0.00 H new ATOM 0 HB3 HIS A 64 0.106 -11.801 -12.896 1.00 0.00 H new ATOM 0 HD2 HIS A 64 3.632 -10.387 -14.066 1.00 0.00 H new ATOM 0 HE1 HIS A 64 0.609 -8.504 -16.330 1.00 0.00 H new ATOM 0 HE2 HIS A 64 3.126 -8.520 -15.852 1.00 0.00 H new ATOM 1016 N PHE A 65 2.892 -9.629 -11.075 1.00 0.00 N ATOM 1017 CA PHE A 65 2.726 -8.281 -10.464 1.00 0.00 C ATOM 1018 C PHE A 65 3.591 -7.260 -11.190 1.00 0.00 C ATOM 1019 O PHE A 65 4.368 -7.581 -12.067 1.00 0.00 O ATOM 1020 CB PHE A 65 3.135 -8.301 -8.994 1.00 0.00 C ATOM 1021 CG PHE A 65 4.509 -8.913 -8.850 1.00 0.00 C ATOM 1022 CD1 PHE A 65 5.629 -8.241 -9.355 1.00 0.00 C ATOM 1023 CD2 PHE A 65 4.664 -10.144 -8.203 1.00 0.00 C ATOM 1024 CE1 PHE A 65 6.904 -8.800 -9.214 1.00 0.00 C ATOM 1025 CE2 PHE A 65 5.941 -10.704 -8.064 1.00 0.00 C ATOM 1026 CZ PHE A 65 7.060 -10.030 -8.568 1.00 0.00 C ATOM 0 H PHE A 65 3.853 -9.902 -11.280 1.00 0.00 H new ATOM 0 HA PHE A 65 1.675 -8.006 -10.549 1.00 0.00 H new ATOM 0 HB2 PHE A 65 3.135 -7.287 -8.594 1.00 0.00 H new ATOM 0 HB3 PHE A 65 2.410 -8.872 -8.414 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.509 -7.291 -9.854 1.00 0.00 H new ATOM 0 HD2 PHE A 65 3.801 -10.662 -7.811 1.00 0.00 H new ATOM 0 HE1 PHE A 65 7.767 -8.281 -9.604 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.062 -11.656 -7.568 1.00 0.00 H new ATOM 0 HZ PHE A 65 8.044 -10.461 -8.458 1.00 0.00 H new ATOM 1036 N SER A 66 3.456 -6.027 -10.805 1.00 0.00 N ATOM 1037 CA SER A 66 4.258 -4.938 -11.434 1.00 0.00 C ATOM 1038 C SER A 66 4.231 -3.709 -10.522 1.00 0.00 C ATOM 1039 O SER A 66 3.610 -3.719 -9.477 1.00 0.00 O ATOM 1040 CB SER A 66 3.654 -4.577 -12.791 1.00 0.00 C ATOM 1041 OG SER A 66 3.989 -5.583 -13.737 1.00 0.00 O ATOM 0 H SER A 66 2.817 -5.719 -10.072 1.00 0.00 H new ATOM 0 HA SER A 66 5.286 -5.272 -11.574 1.00 0.00 H new ATOM 0 HB2 SER A 66 2.571 -4.487 -12.707 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.030 -3.609 -13.123 1.00 0.00 H new ATOM 0 HG SER A 66 4.510 -6.286 -13.296 1.00 0.00 H new ATOM 1047 N LEU A 67 4.878 -2.642 -10.909 1.00 0.00 N ATOM 1048 CA LEU A 67 4.854 -1.417 -10.058 1.00 0.00 C ATOM 1049 C LEU A 67 3.945 -0.379 -10.707 1.00 0.00 C ATOM 1050 O LEU A 67 4.289 0.222 -11.704 1.00 0.00 O ATOM 1051 CB LEU A 67 6.260 -0.824 -9.920 1.00 0.00 C ATOM 1052 CG LEU A 67 6.161 0.571 -9.282 1.00 0.00 C ATOM 1053 CD1 LEU A 67 5.650 0.446 -7.846 1.00 0.00 C ATOM 1054 CD2 LEU A 67 7.544 1.228 -9.271 1.00 0.00 C ATOM 0 H LEU A 67 5.418 -2.565 -11.771 1.00 0.00 H new ATOM 0 HA LEU A 67 4.485 -1.686 -9.068 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.883 -1.474 -9.306 1.00 0.00 H new ATOM 0 HB3 LEU A 67 6.737 -0.757 -10.898 1.00 0.00 H new ATOM 0 HG LEU A 67 5.470 1.182 -9.862 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.581 1.437 -7.397 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.665 -0.020 -7.850 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.340 -0.168 -7.267 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.473 2.217 -8.819 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.234 0.613 -8.693 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.910 1.322 -10.293 1.00 0.00 H new ATOM 1066 N PHE A 68 2.794 -0.150 -10.146 1.00 0.00 N ATOM 1067 CA PHE A 68 1.883 0.863 -10.730 1.00 0.00 C ATOM 1068 C PHE A 68 2.698 2.123 -11.015 1.00 0.00 C ATOM 1069 O PHE A 68 3.164 2.351 -12.114 1.00 0.00 O ATOM 1070 CB PHE A 68 0.772 1.170 -9.714 1.00 0.00 C ATOM 1071 CG PHE A 68 0.233 2.563 -9.932 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -0.349 2.904 -11.158 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.327 3.513 -8.911 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -0.838 4.197 -11.360 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.159 4.806 -9.115 1.00 0.00 C ATOM 1076 CZ PHE A 68 -0.741 5.146 -10.337 1.00 0.00 C ATOM 0 H PHE A 68 2.447 -0.620 -9.310 1.00 0.00 H new ATOM 0 HA PHE A 68 1.431 0.500 -11.653 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.033 0.442 -9.814 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.161 1.078 -8.700 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.420 2.169 -11.946 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.775 3.247 -7.965 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -1.290 4.463 -12.304 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.085 5.542 -8.328 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.118 6.146 -10.493 1.00 0.00 H new ATOM 1086 N GLU A 69 2.872 2.933 -10.016 1.00 0.00 N ATOM 1087 CA GLU A 69 3.661 4.185 -10.183 1.00 0.00 C ATOM 1088 C GLU A 69 4.388 4.496 -8.874 1.00 0.00 C ATOM 1089 O GLU A 69 4.216 3.817 -7.880 1.00 0.00 O ATOM 1090 CB GLU A 69 2.724 5.341 -10.540 1.00 0.00 C ATOM 1091 CG GLU A 69 3.148 5.944 -11.880 1.00 0.00 C ATOM 1092 CD GLU A 69 2.143 5.542 -12.962 1.00 0.00 C ATOM 1093 OE1 GLU A 69 2.322 4.487 -13.547 1.00 0.00 O ATOM 1094 OE2 GLU A 69 1.211 6.297 -13.186 1.00 0.00 O ATOM 0 H GLU A 69 2.498 2.783 -9.079 1.00 0.00 H new ATOM 0 HA GLU A 69 4.388 4.056 -10.985 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.695 4.985 -10.598 1.00 0.00 H new ATOM 0 HB3 GLU A 69 2.754 6.102 -9.760 1.00 0.00 H new ATOM 0 HG2 GLU A 69 3.199 7.030 -11.802 1.00 0.00 H new ATOM 0 HG3 GLU A 69 4.146 5.596 -12.148 1.00 0.00 H new ATOM 1101 N LYS A 70 5.202 5.515 -8.863 1.00 0.00 N ATOM 1102 CA LYS A 70 5.942 5.865 -7.617 1.00 0.00 C ATOM 1103 C LYS A 70 5.817 7.367 -7.350 1.00 0.00 C ATOM 1104 O LYS A 70 6.077 8.183 -8.211 1.00 0.00 O ATOM 1105 CB LYS A 70 7.419 5.500 -7.788 1.00 0.00 C ATOM 1106 CG LYS A 70 7.876 4.643 -6.607 1.00 0.00 C ATOM 1107 CD LYS A 70 8.521 3.360 -7.131 1.00 0.00 C ATOM 1108 CE LYS A 70 10.044 3.508 -7.104 1.00 0.00 C ATOM 1109 NZ LYS A 70 10.571 3.466 -8.496 1.00 0.00 N ATOM 0 H LYS A 70 5.387 6.121 -9.663 1.00 0.00 H new ATOM 0 HA LYS A 70 5.522 5.313 -6.777 1.00 0.00 H new ATOM 0 HB2 LYS A 70 7.564 4.957 -8.722 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.023 6.405 -7.849 1.00 0.00 H new ATOM 0 HG2 LYS A 70 8.588 5.197 -5.995 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.026 4.402 -5.968 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.216 2.511 -6.519 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.182 3.159 -8.147 1.00 0.00 H new ATOM 0 HE2 LYS A 70 10.320 4.448 -6.627 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.487 2.708 -6.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 11.606 3.567 -8.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.319 2.558 -8.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 10.157 4.244 -9.048 1.00 0.00 H new ATOM 1123 N LEU A 71 5.429 7.740 -6.160 1.00 0.00 N ATOM 1124 CA LEU A 71 5.297 9.191 -5.842 1.00 0.00 C ATOM 1125 C LEU A 71 6.213 9.542 -4.669 1.00 0.00 C ATOM 1126 O LEU A 71 6.949 8.714 -4.172 1.00 0.00 O ATOM 1127 CB LEU A 71 3.848 9.513 -5.466 1.00 0.00 C ATOM 1128 CG LEU A 71 3.225 8.323 -4.734 1.00 0.00 C ATOM 1129 CD1 LEU A 71 4.023 8.027 -3.463 1.00 0.00 C ATOM 1130 CD2 LEU A 71 1.781 8.658 -4.351 1.00 0.00 C ATOM 0 H LEU A 71 5.198 7.105 -5.396 1.00 0.00 H new ATOM 0 HA LEU A 71 5.580 9.775 -6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 71 3.816 10.399 -4.832 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.272 9.742 -6.363 1.00 0.00 H new ATOM 0 HG LEU A 71 3.240 7.451 -5.388 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.578 7.179 -2.943 1.00 0.00 H new ATOM 0 HD12 LEU A 71 5.054 7.790 -3.727 1.00 0.00 H new ATOM 0 HD13 LEU A 71 4.007 8.901 -2.812 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.337 7.810 -3.829 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.771 9.531 -3.699 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.206 8.871 -5.252 1.00 0.00 H new ATOM 1142 N GLU A 72 6.170 10.767 -4.223 1.00 0.00 N ATOM 1143 CA GLU A 72 7.037 11.178 -3.083 1.00 0.00 C ATOM 1144 C GLU A 72 6.456 12.434 -2.430 1.00 0.00 C ATOM 1145 O GLU A 72 5.683 13.155 -3.029 1.00 0.00 O ATOM 1146 CB GLU A 72 8.450 11.470 -3.594 1.00 0.00 C ATOM 1147 CG GLU A 72 8.401 12.593 -4.631 1.00 0.00 C ATOM 1148 CD GLU A 72 8.895 13.894 -3.999 1.00 0.00 C ATOM 1149 OE1 GLU A 72 8.455 14.202 -2.904 1.00 0.00 O ATOM 1150 OE2 GLU A 72 9.708 14.559 -4.619 1.00 0.00 O ATOM 0 H GLU A 72 5.571 11.502 -4.599 1.00 0.00 H new ATOM 0 HA GLU A 72 7.079 10.374 -2.348 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.095 11.757 -2.764 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.880 10.572 -4.037 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.020 12.336 -5.490 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.382 12.719 -4.998 1.00 0.00 H new ATOM 1157 N TYR A 73 6.812 12.694 -1.201 1.00 0.00 N ATOM 1158 CA TYR A 73 6.271 13.894 -0.506 1.00 0.00 C ATOM 1159 C TYR A 73 7.332 14.466 0.441 1.00 0.00 C ATOM 1160 O TYR A 73 8.126 13.746 1.011 1.00 0.00 O ATOM 1161 CB TYR A 73 5.043 13.482 0.304 1.00 0.00 C ATOM 1162 CG TYR A 73 3.873 14.366 -0.054 1.00 0.00 C ATOM 1163 CD1 TYR A 73 3.940 15.747 0.169 1.00 0.00 C ATOM 1164 CD2 TYR A 73 2.719 13.802 -0.609 1.00 0.00 C ATOM 1165 CE1 TYR A 73 2.852 16.562 -0.162 1.00 0.00 C ATOM 1166 CE2 TYR A 73 1.629 14.617 -0.940 1.00 0.00 C ATOM 1167 CZ TYR A 73 1.696 15.998 -0.716 1.00 0.00 C ATOM 1168 OH TYR A 73 0.623 16.801 -1.042 1.00 0.00 O ATOM 0 H TYR A 73 7.455 12.126 -0.649 1.00 0.00 H new ATOM 0 HA TYR A 73 5.999 14.652 -1.241 1.00 0.00 H new ATOM 0 HB2 TYR A 73 4.797 12.439 0.104 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.256 13.560 1.370 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.831 16.183 0.596 1.00 0.00 H new ATOM 0 HD2 TYR A 73 2.669 12.737 -0.782 1.00 0.00 H new ATOM 0 HE1 TYR A 73 2.904 17.627 0.010 1.00 0.00 H new ATOM 0 HE2 TYR A 73 0.738 14.181 -1.367 1.00 0.00 H new ATOM 0 HH TYR A 73 -0.096 16.250 -1.416 1.00 0.00 H new ATOM 1178 N GLU A 74 7.344 15.759 0.614 1.00 0.00 N ATOM 1179 CA GLU A 74 8.342 16.386 1.525 1.00 0.00 C ATOM 1180 C GLU A 74 7.668 17.517 2.302 1.00 0.00 C ATOM 1181 O GLU A 74 7.214 18.491 1.736 1.00 0.00 O ATOM 1182 CB GLU A 74 9.500 16.949 0.700 1.00 0.00 C ATOM 1183 CG GLU A 74 10.494 17.645 1.630 1.00 0.00 C ATOM 1184 CD GLU A 74 10.730 19.074 1.144 1.00 0.00 C ATOM 1185 OE1 GLU A 74 9.761 19.803 1.015 1.00 0.00 O ATOM 1186 OE2 GLU A 74 11.877 19.417 0.907 1.00 0.00 O ATOM 0 H GLU A 74 6.703 16.411 0.162 1.00 0.00 H new ATOM 0 HA GLU A 74 8.725 15.641 2.222 1.00 0.00 H new ATOM 0 HB2 GLU A 74 9.996 16.147 0.154 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.124 17.654 -0.042 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.109 17.655 2.650 1.00 0.00 H new ATOM 0 HG3 GLU A 74 11.435 17.096 1.650 1.00 0.00 H new ATOM 1193 N PHE A 75 7.593 17.389 3.597 1.00 0.00 N ATOM 1194 CA PHE A 75 6.946 18.445 4.417 1.00 0.00 C ATOM 1195 C PHE A 75 7.963 19.555 4.712 1.00 0.00 C ATOM 1196 O PHE A 75 9.127 19.422 4.389 1.00 0.00 O ATOM 1197 CB PHE A 75 6.464 17.814 5.723 1.00 0.00 C ATOM 1198 CG PHE A 75 4.964 17.644 5.682 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.366 16.985 4.601 1.00 0.00 C ATOM 1200 CD2 PHE A 75 4.169 18.139 6.725 1.00 0.00 C ATOM 1201 CE1 PHE A 75 2.976 16.823 4.559 1.00 0.00 C ATOM 1202 CE2 PHE A 75 2.779 17.976 6.684 1.00 0.00 C ATOM 1203 CZ PHE A 75 2.183 17.318 5.602 1.00 0.00 C ATOM 0 H PHE A 75 7.954 16.594 4.123 1.00 0.00 H new ATOM 0 HA PHE A 75 6.100 18.877 3.883 1.00 0.00 H new ATOM 0 HB2 PHE A 75 6.945 16.847 5.871 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.746 18.443 6.568 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.978 16.601 3.798 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.629 18.646 7.560 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.516 16.317 3.723 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.167 18.358 7.487 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.111 17.192 5.571 1.00 0.00 H new ATOM 1213 N PRO A 76 7.491 20.621 5.307 1.00 0.00 N ATOM 1214 CA PRO A 76 8.346 21.775 5.645 1.00 0.00 C ATOM 1215 C PRO A 76 9.485 21.353 6.575 1.00 0.00 C ATOM 1216 O PRO A 76 10.429 22.089 6.786 1.00 0.00 O ATOM 1217 CB PRO A 76 7.410 22.767 6.346 1.00 0.00 C ATOM 1218 CG PRO A 76 5.993 22.140 6.372 1.00 0.00 C ATOM 1219 CD PRO A 76 6.075 20.765 5.693 1.00 0.00 C ATOM 0 HA PRO A 76 8.816 22.209 4.763 1.00 0.00 H new ATOM 0 HB2 PRO A 76 7.757 22.970 7.359 1.00 0.00 H new ATOM 0 HB3 PRO A 76 7.397 23.720 5.817 1.00 0.00 H new ATOM 0 HG2 PRO A 76 5.639 22.039 7.398 1.00 0.00 H new ATOM 0 HG3 PRO A 76 5.282 22.781 5.851 1.00 0.00 H new ATOM 0 HD2 PRO A 76 5.767 19.969 6.371 1.00 0.00 H new ATOM 0 HD3 PRO A 76 5.420 20.713 4.823 1.00 0.00 H new ATOM 1227 N ASP A 77 9.404 20.180 7.129 1.00 0.00 N ATOM 1228 CA ASP A 77 10.483 19.718 8.044 1.00 0.00 C ATOM 1229 C ASP A 77 10.377 18.207 8.283 1.00 0.00 C ATOM 1230 O ASP A 77 10.957 17.683 9.212 1.00 0.00 O ATOM 1231 CB ASP A 77 10.359 20.450 9.382 1.00 0.00 C ATOM 1232 CG ASP A 77 9.141 19.921 10.141 1.00 0.00 C ATOM 1233 OD1 ASP A 77 8.099 19.774 9.523 1.00 0.00 O ATOM 1234 OD2 ASP A 77 9.271 19.669 11.329 1.00 0.00 O ATOM 0 H ASP A 77 8.639 19.520 6.989 1.00 0.00 H new ATOM 0 HA ASP A 77 11.448 19.935 7.586 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.262 20.303 9.974 1.00 0.00 H new ATOM 0 HB3 ASP A 77 10.259 21.522 9.214 1.00 0.00 H new ATOM 1239 N ARG A 78 9.642 17.495 7.470 1.00 0.00 N ATOM 1240 CA ARG A 78 9.510 16.046 7.677 1.00 0.00 C ATOM 1241 C ARG A 78 9.762 15.318 6.356 1.00 0.00 C ATOM 1242 O ARG A 78 10.146 15.914 5.370 1.00 0.00 O ATOM 1243 CB ARG A 78 8.095 15.776 8.150 1.00 0.00 C ATOM 1244 CG ARG A 78 7.954 16.225 9.603 1.00 0.00 C ATOM 1245 CD ARG A 78 7.803 15.004 10.512 1.00 0.00 C ATOM 1246 NE ARG A 78 6.361 14.631 10.620 1.00 0.00 N ATOM 1247 CZ ARG A 78 5.445 15.558 10.678 1.00 0.00 C ATOM 1248 NH1 ARG A 78 5.656 16.643 11.373 1.00 0.00 N ATOM 1249 NH2 ARG A 78 4.316 15.400 10.042 1.00 0.00 N ATOM 0 H ARG A 78 9.130 17.868 6.671 1.00 0.00 H new ATOM 0 HA ARG A 78 10.232 15.693 8.414 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.381 16.309 7.522 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.866 14.714 8.062 1.00 0.00 H new ATOM 0 HG2 ARG A 78 8.828 16.805 9.900 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.087 16.878 9.709 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.376 14.168 10.111 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.207 15.223 11.501 1.00 0.00 H new ATOM 0 HE ARG A 78 6.091 13.648 10.649 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.538 16.766 11.871 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.939 17.367 11.418 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.150 14.552 9.500 1.00 0.00 H new ATOM 0 HH22 ARG A 78 3.600 16.125 10.087 1.00 0.00 H new ATOM 1263 N HIS A 79 9.545 14.035 6.330 1.00 0.00 N ATOM 1264 CA HIS A 79 9.766 13.264 5.076 1.00 0.00 C ATOM 1265 C HIS A 79 8.745 12.131 5.002 1.00 0.00 C ATOM 1266 O HIS A 79 8.475 11.462 5.981 1.00 0.00 O ATOM 1267 CB HIS A 79 11.181 12.683 5.077 1.00 0.00 C ATOM 1268 CG HIS A 79 12.148 13.741 5.526 1.00 0.00 C ATOM 1269 ND1 HIS A 79 12.566 13.850 6.842 1.00 0.00 N ATOM 1270 CD2 HIS A 79 12.780 14.752 4.846 1.00 0.00 C ATOM 1271 CE1 HIS A 79 13.412 14.894 6.914 1.00 0.00 C ATOM 1272 NE2 HIS A 79 13.579 15.479 5.724 1.00 0.00 N ATOM 0 H HIS A 79 9.223 13.484 7.126 1.00 0.00 H new ATOM 0 HA HIS A 79 9.649 13.920 4.213 1.00 0.00 H new ATOM 0 HB2 HIS A 79 11.233 11.820 5.741 1.00 0.00 H new ATOM 0 HB3 HIS A 79 11.444 12.333 4.079 1.00 0.00 H new ATOM 0 HD2 HIS A 79 12.674 14.953 3.790 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.897 15.219 7.823 1.00 0.00 H new ATOM 0 HE2 HIS A 79 14.166 16.285 5.506 1.00 0.00 H new ATOM 1280 N ILE A 80 8.162 11.914 3.857 1.00 0.00 N ATOM 1281 CA ILE A 80 7.152 10.829 3.740 1.00 0.00 C ATOM 1282 C ILE A 80 7.319 10.094 2.408 1.00 0.00 C ATOM 1283 O ILE A 80 6.592 10.330 1.463 1.00 0.00 O ATOM 1284 CB ILE A 80 5.748 11.435 3.819 1.00 0.00 C ATOM 1285 CG1 ILE A 80 5.524 12.016 5.219 1.00 0.00 C ATOM 1286 CG2 ILE A 80 4.706 10.350 3.545 1.00 0.00 C ATOM 1287 CD1 ILE A 80 5.377 10.877 6.228 1.00 0.00 C ATOM 0 H ILE A 80 8.341 12.439 3.001 1.00 0.00 H new ATOM 0 HA ILE A 80 7.294 10.119 4.555 1.00 0.00 H new ATOM 0 HB ILE A 80 5.651 12.226 3.075 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.362 12.656 5.497 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.630 12.640 5.226 1.00 0.00 H new ATOM 0 HG21 ILE A 80 3.707 10.782 3.601 1.00 0.00 H new ATOM 0 HG22 ILE A 80 4.866 9.935 2.550 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.801 9.558 4.288 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.218 11.291 7.224 1.00 0.00 H new ATOM 0 HD12 ILE A 80 4.525 10.255 5.953 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.283 10.271 6.228 1.00 0.00 H new ATOM 1299 N THR A 81 8.260 9.192 2.330 1.00 0.00 N ATOM 1300 CA THR A 81 8.457 8.429 1.066 1.00 0.00 C ATOM 1301 C THR A 81 7.474 7.259 1.052 1.00 0.00 C ATOM 1302 O THR A 81 7.363 6.526 2.014 1.00 0.00 O ATOM 1303 CB THR A 81 9.893 7.901 1.006 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.709 8.657 1.888 1.00 0.00 O ATOM 1305 CG2 THR A 81 10.428 8.027 -0.421 1.00 0.00 C ATOM 0 H THR A 81 8.900 8.951 3.087 1.00 0.00 H new ATOM 0 HA THR A 81 8.282 9.073 0.204 1.00 0.00 H new ATOM 0 HB THR A 81 9.907 6.853 1.304 1.00 0.00 H new ATOM 0 HG1 THR A 81 11.629 8.320 1.853 1.00 0.00 H new ATOM 0 HG21 THR A 81 11.450 7.651 -0.461 1.00 0.00 H new ATOM 0 HG22 THR A 81 9.801 7.446 -1.097 1.00 0.00 H new ATOM 0 HG23 THR A 81 10.415 9.074 -0.723 1.00 0.00 H new ATOM 1313 N LEU A 82 6.749 7.078 -0.016 1.00 0.00 N ATOM 1314 CA LEU A 82 5.771 5.956 -0.053 1.00 0.00 C ATOM 1315 C LEU A 82 5.831 5.243 -1.402 1.00 0.00 C ATOM 1316 O LEU A 82 5.468 5.793 -2.422 1.00 0.00 O ATOM 1317 CB LEU A 82 4.358 6.506 0.159 1.00 0.00 C ATOM 1318 CG LEU A 82 3.575 5.575 1.088 1.00 0.00 C ATOM 1319 CD1 LEU A 82 3.377 4.219 0.408 1.00 0.00 C ATOM 1320 CD2 LEU A 82 4.356 5.383 2.390 1.00 0.00 C ATOM 0 H LEU A 82 6.790 7.653 -0.858 1.00 0.00 H new ATOM 0 HA LEU A 82 6.020 5.247 0.737 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.408 7.506 0.589 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.845 6.596 -0.799 1.00 0.00 H new ATOM 0 HG LEU A 82 2.602 6.015 1.307 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.819 3.557 1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.822 4.355 -0.520 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.349 3.777 0.188 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.800 4.720 3.053 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.329 4.943 2.169 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.496 6.349 2.876 1.00 0.00 H new ATOM 1332 N TRP A 83 6.263 4.014 -1.414 1.00 0.00 N ATOM 1333 CA TRP A 83 6.313 3.263 -2.697 1.00 0.00 C ATOM 1334 C TRP A 83 4.904 2.759 -3.003 1.00 0.00 C ATOM 1335 O TRP A 83 4.089 2.611 -2.114 1.00 0.00 O ATOM 1336 CB TRP A 83 7.272 2.080 -2.567 1.00 0.00 C ATOM 1337 CG TRP A 83 8.554 2.547 -1.961 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.086 2.074 -0.814 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.470 3.570 -2.448 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.273 2.740 -0.563 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.552 3.672 -1.543 1.00 0.00 C ATOM 1342 CE3 TRP A 83 9.467 4.410 -3.576 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.595 4.577 -1.749 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 10.516 5.321 -3.787 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.577 5.404 -2.876 1.00 0.00 C ATOM 0 H TRP A 83 6.583 3.499 -0.594 1.00 0.00 H new ATOM 0 HA TRP A 83 6.667 3.908 -3.501 1.00 0.00 H new ATOM 0 HB2 TRP A 83 6.826 1.302 -1.947 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.459 1.639 -3.546 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.656 1.302 -0.194 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.868 2.564 0.246 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.654 4.355 -4.284 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.410 4.638 -1.043 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 10.504 5.961 -4.657 1.00 0.00 H new ATOM 0 HH2 TRP A 83 12.380 6.106 -3.044 1.00 0.00 H new ATOM 1356 N PHE A 84 4.597 2.505 -4.240 1.00 0.00 N ATOM 1357 CA PHE A 84 3.228 2.028 -4.564 1.00 0.00 C ATOM 1358 C PHE A 84 3.304 0.871 -5.555 1.00 0.00 C ATOM 1359 O PHE A 84 2.943 1.008 -6.705 1.00 0.00 O ATOM 1360 CB PHE A 84 2.438 3.174 -5.194 1.00 0.00 C ATOM 1361 CG PHE A 84 1.511 3.780 -4.174 1.00 0.00 C ATOM 1362 CD1 PHE A 84 2.026 4.567 -3.137 1.00 0.00 C ATOM 1363 CD2 PHE A 84 0.135 3.565 -4.273 1.00 0.00 C ATOM 1364 CE1 PHE A 84 1.160 5.135 -2.198 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -0.731 4.134 -3.337 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.219 4.919 -2.299 1.00 0.00 C ATOM 0 H PHE A 84 5.228 2.606 -5.035 1.00 0.00 H new ATOM 0 HA PHE A 84 2.737 1.690 -3.652 1.00 0.00 H new ATOM 0 HB2 PHE A 84 3.122 3.933 -5.573 1.00 0.00 H new ATOM 0 HB3 PHE A 84 1.865 2.807 -6.046 1.00 0.00 H new ATOM 0 HD1 PHE A 84 3.090 4.735 -3.063 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.260 2.958 -5.074 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.555 5.740 -1.395 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.795 3.968 -3.415 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.888 5.359 -1.575 1.00 0.00 H new ATOM 1376 N TRP A 85 3.757 -0.272 -5.120 1.00 0.00 N ATOM 1377 CA TRP A 85 3.843 -1.429 -6.043 1.00 0.00 C ATOM 1378 C TRP A 85 2.474 -2.106 -6.083 1.00 0.00 C ATOM 1379 O TRP A 85 1.756 -2.127 -5.105 1.00 0.00 O ATOM 1380 CB TRP A 85 4.973 -2.360 -5.543 1.00 0.00 C ATOM 1381 CG TRP A 85 4.531 -3.783 -5.362 1.00 0.00 C ATOM 1382 CD1 TRP A 85 3.481 -4.192 -4.615 1.00 0.00 C ATOM 1383 CD2 TRP A 85 5.146 -4.990 -5.896 1.00 0.00 C ATOM 1384 NE1 TRP A 85 3.401 -5.571 -4.672 1.00 0.00 N ATOM 1385 CE2 TRP A 85 4.410 -6.109 -5.447 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.260 -5.218 -6.725 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 4.766 -7.410 -5.804 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 6.622 -6.526 -7.087 1.00 0.00 C ATOM 1389 CH2 TRP A 85 5.876 -7.620 -6.626 1.00 0.00 C ATOM 0 H TRP A 85 4.070 -0.451 -4.166 1.00 0.00 H new ATOM 0 HA TRP A 85 4.091 -1.136 -7.063 1.00 0.00 H new ATOM 0 HB2 TRP A 85 5.800 -2.331 -6.253 1.00 0.00 H new ATOM 0 HB3 TRP A 85 5.354 -1.981 -4.594 1.00 0.00 H new ATOM 0 HD1 TRP A 85 2.813 -3.547 -4.064 1.00 0.00 H new ATOM 0 HE1 TRP A 85 2.685 -6.123 -4.200 1.00 0.00 H new ATOM 0 HE3 TRP A 85 6.841 -4.382 -7.085 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 4.187 -8.249 -5.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 7.479 -6.690 -7.723 1.00 0.00 H new ATOM 0 HH2 TRP A 85 6.159 -8.624 -6.906 1.00 0.00 H new ATOM 1400 N LEU A 86 2.086 -2.627 -7.208 1.00 0.00 N ATOM 1401 CA LEU A 86 0.747 -3.268 -7.286 1.00 0.00 C ATOM 1402 C LEU A 86 0.846 -4.602 -8.013 1.00 0.00 C ATOM 1403 O LEU A 86 1.362 -4.688 -9.108 1.00 0.00 O ATOM 1404 CB LEU A 86 -0.215 -2.350 -8.036 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.639 -2.857 -7.836 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -1.944 -2.910 -6.341 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -2.623 -1.910 -8.526 1.00 0.00 C ATOM 0 H LEU A 86 2.631 -2.638 -8.070 1.00 0.00 H new ATOM 0 HA LEU A 86 0.377 -3.440 -6.275 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.124 -1.328 -7.669 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.033 -2.331 -9.097 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.738 -3.853 -8.267 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.961 -3.272 -6.190 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.242 -3.584 -5.850 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.847 -1.912 -5.914 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.640 -2.274 -8.382 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.530 -0.913 -8.096 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -2.400 -1.868 -9.592 1.00 0.00 H new ATOM 1419 N VAL A 87 0.352 -5.645 -7.410 1.00 0.00 N ATOM 1420 CA VAL A 87 0.417 -6.972 -8.058 1.00 0.00 C ATOM 1421 C VAL A 87 -0.916 -7.278 -8.743 1.00 0.00 C ATOM 1422 O VAL A 87 -1.810 -6.455 -8.785 1.00 0.00 O ATOM 1423 CB VAL A 87 0.689 -8.019 -6.991 1.00 0.00 C ATOM 1424 CG1 VAL A 87 2.032 -7.734 -6.321 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.422 -7.986 -5.944 1.00 0.00 C ATOM 0 H VAL A 87 -0.095 -5.631 -6.493 1.00 0.00 H new ATOM 0 HA VAL A 87 1.211 -6.981 -8.805 1.00 0.00 H new ATOM 0 HB VAL A 87 0.719 -9.005 -7.455 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.224 -8.487 -5.556 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.825 -7.765 -7.068 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.006 -6.747 -5.860 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.224 -8.738 -5.180 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.457 -6.999 -5.482 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.379 -8.197 -6.422 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.056 -8.460 -9.277 1.00 0.00 N ATOM 1436 CA GLU A 88 -2.331 -8.826 -9.956 1.00 0.00 C ATOM 1437 C GLU A 88 -2.868 -10.132 -9.362 1.00 0.00 C ATOM 1438 O GLU A 88 -4.061 -10.363 -9.326 1.00 0.00 O ATOM 1439 CB GLU A 88 -2.078 -9.011 -11.455 1.00 0.00 C ATOM 1440 CG GLU A 88 -1.617 -7.685 -12.065 1.00 0.00 C ATOM 1441 CD GLU A 88 -2.505 -7.338 -13.262 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -2.818 -8.239 -14.023 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -2.855 -6.177 -13.398 1.00 0.00 O ATOM 0 H GLU A 88 -0.342 -9.189 -9.272 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.063 -8.032 -9.808 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -1.321 -9.779 -11.614 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -2.988 -9.353 -11.948 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -1.668 -6.892 -11.319 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -0.576 -7.760 -12.380 1.00 0.00 H new ATOM 1450 N ARG A 89 -1.998 -10.990 -8.898 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.458 -12.276 -8.307 1.00 0.00 C ATOM 1452 C ARG A 89 -1.327 -12.883 -7.471 1.00 0.00 C ATOM 1453 O ARG A 89 -0.198 -12.439 -7.527 1.00 0.00 O ATOM 1454 CB ARG A 89 -2.851 -13.239 -9.429 1.00 0.00 C ATOM 1455 CG ARG A 89 -1.954 -13.001 -10.643 1.00 0.00 C ATOM 1456 CD ARG A 89 -2.754 -12.290 -11.736 1.00 0.00 C ATOM 1457 NE ARG A 89 -3.719 -13.245 -12.353 1.00 0.00 N ATOM 1458 CZ ARG A 89 -3.386 -14.496 -12.525 1.00 0.00 C ATOM 1459 NH1 ARG A 89 -3.584 -15.361 -11.569 1.00 0.00 N ATOM 1460 NH2 ARG A 89 -2.854 -14.881 -13.653 1.00 0.00 N ATOM 0 H ARG A 89 -0.987 -10.853 -8.904 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.323 -12.099 -7.667 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.754 -14.270 -9.088 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -3.896 -13.090 -9.701 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -1.091 -12.399 -10.359 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.571 -13.950 -11.017 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -3.289 -11.439 -11.314 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.080 -11.897 -12.497 1.00 0.00 H new ATOM 0 HE ARG A 89 -4.642 -12.920 -12.642 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -3.999 -15.060 -10.687 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -3.324 -16.338 -11.703 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.698 -14.205 -14.400 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -2.594 -15.858 -13.787 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.614 -13.900 -6.706 1.00 0.00 N ATOM 1475 CA TRP A 90 -0.540 -14.534 -5.886 1.00 0.00 C ATOM 1476 C TRP A 90 -1.004 -15.891 -5.380 1.00 0.00 C ATOM 1477 O TRP A 90 -2.015 -16.417 -5.798 1.00 0.00 O ATOM 1478 CB TRP A 90 -0.198 -13.662 -4.680 1.00 0.00 C ATOM 1479 CG TRP A 90 -1.415 -13.465 -3.836 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -1.743 -14.223 -2.764 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -2.468 -12.468 -3.968 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -2.922 -13.746 -2.220 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -3.409 -12.668 -2.928 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -2.695 -11.416 -4.875 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -4.533 -11.856 -2.792 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -3.831 -10.599 -4.739 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -4.745 -10.819 -3.700 1.00 0.00 C ATOM 0 H TRP A 90 -2.540 -14.318 -6.612 1.00 0.00 H new ATOM 0 HA TRP A 90 0.341 -14.648 -6.517 1.00 0.00 H new ATOM 0 HB2 TRP A 90 0.591 -14.131 -4.092 1.00 0.00 H new ATOM 0 HB3 TRP A 90 0.184 -12.697 -5.014 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -1.176 -15.064 -2.393 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -3.375 -14.143 -1.397 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -1.995 -11.236 -5.677 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -5.235 -12.028 -1.989 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -4.000 -9.796 -5.441 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -5.614 -10.185 -3.602 1.00 0.00 H new ATOM 1498 N GLU A 91 -0.254 -16.467 -4.487 1.00 0.00 N ATOM 1499 CA GLU A 91 -0.628 -17.798 -3.957 1.00 0.00 C ATOM 1500 C GLU A 91 -0.569 -17.815 -2.425 1.00 0.00 C ATOM 1501 O GLU A 91 0.482 -17.978 -1.839 1.00 0.00 O ATOM 1502 CB GLU A 91 0.357 -18.817 -4.499 1.00 0.00 C ATOM 1503 CG GLU A 91 -0.286 -20.192 -4.443 1.00 0.00 C ATOM 1504 CD GLU A 91 0.485 -21.165 -5.335 1.00 0.00 C ATOM 1505 OE1 GLU A 91 1.188 -20.698 -6.218 1.00 0.00 O ATOM 1506 OE2 GLU A 91 0.361 -22.359 -5.121 1.00 0.00 O ATOM 0 H GLU A 91 0.603 -16.070 -4.102 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.647 -18.032 -4.265 1.00 0.00 H new ATOM 0 HB2 GLU A 91 0.631 -18.569 -5.524 1.00 0.00 H new ATOM 0 HB3 GLU A 91 1.275 -18.805 -3.912 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.296 -20.557 -3.416 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.324 -20.131 -4.769 1.00 0.00 H new ATOM 1513 N GLY A 92 -1.685 -17.673 -1.769 1.00 0.00 N ATOM 1514 CA GLY A 92 -1.673 -17.705 -0.279 1.00 0.00 C ATOM 1515 C GLY A 92 -2.407 -16.486 0.274 1.00 0.00 C ATOM 1516 O GLY A 92 -3.297 -15.945 -0.353 1.00 0.00 O ATOM 0 H GLY A 92 -2.601 -17.537 -2.196 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -2.148 -18.619 0.077 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -0.646 -17.717 0.085 1.00 0.00 H new ATOM 1520 N GLU A 93 -2.042 -16.049 1.450 1.00 0.00 N ATOM 1521 CA GLU A 93 -2.714 -14.868 2.051 1.00 0.00 C ATOM 1522 C GLU A 93 -1.835 -13.625 1.840 1.00 0.00 C ATOM 1523 O GLU A 93 -0.678 -13.636 2.185 1.00 0.00 O ATOM 1524 CB GLU A 93 -2.904 -15.113 3.552 1.00 0.00 C ATOM 1525 CG GLU A 93 -3.292 -13.807 4.250 1.00 0.00 C ATOM 1526 CD GLU A 93 -4.749 -13.468 3.932 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -5.570 -14.369 3.977 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -5.021 -12.312 3.649 1.00 0.00 O ATOM 0 H GLU A 93 -1.304 -16.463 2.020 1.00 0.00 H new ATOM 0 HA GLU A 93 -3.684 -14.711 1.580 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.678 -15.864 3.711 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.984 -15.507 3.984 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -3.158 -13.905 5.327 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.640 -12.999 3.920 1.00 0.00 H new ATOM 1535 N PRO A 94 -2.416 -12.591 1.283 1.00 0.00 N ATOM 1536 CA PRO A 94 -1.703 -11.319 1.019 1.00 0.00 C ATOM 1537 C PRO A 94 -1.000 -10.786 2.284 1.00 0.00 C ATOM 1538 O PRO A 94 -1.497 -10.922 3.384 1.00 0.00 O ATOM 1539 CB PRO A 94 -2.809 -10.354 0.564 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.146 -11.134 0.564 1.00 0.00 C ATOM 1541 CD PRO A 94 -3.829 -12.598 0.872 1.00 0.00 C ATOM 0 HA PRO A 94 -0.915 -11.441 0.276 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.867 -9.496 1.234 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -2.592 -9.967 -0.432 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -4.828 -10.725 1.310 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -4.641 -11.045 -0.403 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -4.471 -12.985 1.664 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.985 -13.230 -0.002 1.00 0.00 H new ATOM 1549 N TRP A 95 0.153 -10.167 2.120 1.00 0.00 N ATOM 1550 CA TRP A 95 0.907 -9.608 3.277 1.00 0.00 C ATOM 1551 C TRP A 95 0.926 -8.089 3.172 1.00 0.00 C ATOM 1552 O TRP A 95 0.333 -7.510 2.282 1.00 0.00 O ATOM 1553 CB TRP A 95 2.359 -10.105 3.237 1.00 0.00 C ATOM 1554 CG TRP A 95 2.902 -9.981 1.848 1.00 0.00 C ATOM 1555 CD1 TRP A 95 3.066 -11.004 0.982 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.363 -8.788 1.152 1.00 0.00 C ATOM 1557 NE1 TRP A 95 3.587 -10.520 -0.196 1.00 0.00 N ATOM 1558 CE2 TRP A 95 3.786 -9.158 -0.144 1.00 0.00 C ATOM 1559 CE3 TRP A 95 3.446 -7.437 1.515 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 4.278 -8.218 -1.047 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 3.942 -6.486 0.608 1.00 0.00 C ATOM 1562 CH2 TRP A 95 4.354 -6.878 -0.671 1.00 0.00 C ATOM 0 H TRP A 95 0.603 -10.028 1.215 1.00 0.00 H new ATOM 0 HA TRP A 95 0.427 -9.925 4.203 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.970 -9.525 3.929 1.00 0.00 H new ATOM 0 HB3 TRP A 95 2.406 -11.144 3.564 1.00 0.00 H new ATOM 0 HD1 TRP A 95 2.826 -12.038 1.182 1.00 0.00 H new ATOM 0 HE1 TRP A 95 3.800 -11.099 -1.008 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.127 -7.125 2.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.598 -8.525 -2.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 4.006 -5.448 0.899 1.00 0.00 H new ATOM 0 HH2 TRP A 95 4.731 -6.142 -1.366 1.00 0.00 H new ATOM 1573 N GLY A 96 1.621 -7.436 4.057 1.00 0.00 N ATOM 1574 CA GLY A 96 1.694 -5.956 3.983 1.00 0.00 C ATOM 1575 C GLY A 96 2.066 -5.375 5.346 1.00 0.00 C ATOM 1576 O GLY A 96 3.090 -4.740 5.506 1.00 0.00 O ATOM 0 H GLY A 96 2.139 -7.862 4.825 1.00 0.00 H new ATOM 0 HA2 GLY A 96 2.433 -5.658 3.239 1.00 0.00 H new ATOM 0 HA3 GLY A 96 0.735 -5.554 3.658 1.00 0.00 H new ATOM 1580 N LYS A 97 1.241 -5.582 6.324 1.00 0.00 N ATOM 1581 CA LYS A 97 1.536 -5.038 7.683 1.00 0.00 C ATOM 1582 C LYS A 97 1.989 -6.172 8.603 1.00 0.00 C ATOM 1583 O LYS A 97 1.916 -7.330 8.247 1.00 0.00 O ATOM 1584 CB LYS A 97 0.273 -4.395 8.262 1.00 0.00 C ATOM 1585 CG LYS A 97 0.631 -3.053 8.905 1.00 0.00 C ATOM 1586 CD LYS A 97 0.320 -3.105 10.402 1.00 0.00 C ATOM 1587 CE LYS A 97 1.414 -2.366 11.175 1.00 0.00 C ATOM 1588 NZ LYS A 97 1.292 -2.672 12.628 1.00 0.00 N ATOM 0 H LYS A 97 0.369 -6.106 6.247 1.00 0.00 H new ATOM 0 HA LYS A 97 2.326 -4.291 7.607 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.466 -4.247 7.475 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -0.178 -5.056 9.002 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.687 -2.834 8.750 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.066 -2.249 8.433 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.651 -2.650 10.599 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.260 -4.141 10.736 1.00 0.00 H new ATOM 0 HE2 LYS A 97 2.397 -2.666 10.811 1.00 0.00 H new ATOM 0 HE3 LYS A 97 1.327 -1.292 11.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 2.036 -2.169 13.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 0.359 -2.365 12.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 1.395 -3.696 12.777 1.00 0.00 H new ATOM 1602 N GLU A 98 2.451 -5.844 9.783 1.00 0.00 N ATOM 1603 CA GLU A 98 2.908 -6.897 10.739 1.00 0.00 C ATOM 1604 C GLU A 98 1.965 -8.098 10.662 1.00 0.00 C ATOM 1605 O GLU A 98 2.381 -9.236 10.742 1.00 0.00 O ATOM 1606 CB GLU A 98 2.897 -6.329 12.161 1.00 0.00 C ATOM 1607 CG GLU A 98 3.888 -7.107 13.029 1.00 0.00 C ATOM 1608 CD GLU A 98 5.282 -6.494 12.883 1.00 0.00 C ATOM 1609 OE1 GLU A 98 5.513 -5.834 11.884 1.00 0.00 O ATOM 1610 OE2 GLU A 98 6.094 -6.696 13.770 1.00 0.00 O ATOM 0 H GLU A 98 2.532 -4.887 10.127 1.00 0.00 H new ATOM 0 HA GLU A 98 3.919 -7.213 10.480 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.164 -5.272 12.144 1.00 0.00 H new ATOM 0 HB3 GLU A 98 1.895 -6.398 12.584 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.574 -7.079 14.072 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.906 -8.155 12.729 1.00 0.00 H new ATOM 1617 N GLY A 99 0.698 -7.848 10.495 1.00 0.00 N ATOM 1618 CA GLY A 99 -0.280 -8.966 10.398 1.00 0.00 C ATOM 1619 C GLY A 99 -1.091 -8.800 9.113 1.00 0.00 C ATOM 1620 O GLY A 99 -0.684 -8.110 8.200 1.00 0.00 O ATOM 0 H GLY A 99 0.296 -6.914 10.421 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.240 -9.924 10.395 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -0.941 -8.965 11.265 1.00 0.00 H new ATOM 1624 N GLN A 100 -2.233 -9.425 9.029 1.00 0.00 N ATOM 1625 CA GLN A 100 -3.054 -9.297 7.809 1.00 0.00 C ATOM 1626 C GLN A 100 -4.420 -8.645 8.111 1.00 0.00 C ATOM 1627 O GLN A 100 -5.416 -9.062 7.555 1.00 0.00 O ATOM 1628 CB GLN A 100 -3.290 -10.695 7.247 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.397 -11.709 8.391 1.00 0.00 C ATOM 1630 CD GLN A 100 -2.001 -12.192 8.791 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -1.487 -11.812 9.825 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -1.360 -13.021 8.013 1.00 0.00 N ATOM 0 H GLN A 100 -2.628 -10.019 9.759 1.00 0.00 H new ATOM 0 HA GLN A 100 -2.527 -8.663 7.096 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -4.204 -10.707 6.653 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -2.472 -10.971 6.581 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -3.893 -11.253 9.248 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.010 -12.556 8.082 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -1.789 -13.341 7.145 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -0.430 -13.349 8.273 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.449 -7.639 8.965 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.712 -6.949 9.296 1.00 0.00 C ATOM 1643 C PRO A 101 -6.221 -6.173 8.081 1.00 0.00 C ATOM 1644 O PRO A 101 -7.301 -5.617 8.095 1.00 0.00 O ATOM 1645 CB PRO A 101 -5.344 -5.971 10.418 1.00 0.00 C ATOM 1646 CG PRO A 101 -3.802 -5.963 10.537 1.00 0.00 C ATOM 1647 CD PRO A 101 -3.264 -7.109 9.667 1.00 0.00 C ATOM 0 HA PRO A 101 -6.496 -7.646 9.591 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -5.717 -4.972 10.194 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -5.800 -6.278 11.359 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -3.397 -5.007 10.205 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -3.497 -6.095 11.575 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -2.514 -6.751 8.962 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -2.788 -7.878 10.276 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.442 -6.118 7.038 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.864 -5.363 5.825 1.00 0.00 C ATOM 1657 C GLY A 102 -7.340 -5.623 5.531 1.00 0.00 C ATOM 1658 O GLY A 102 -7.930 -6.558 6.036 1.00 0.00 O ATOM 0 H GLY A 102 -4.528 -6.565 6.973 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.698 -4.296 5.975 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -5.257 -5.663 4.971 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.942 -4.798 4.718 1.00 0.00 N ATOM 1663 CA GLU A 103 -9.380 -4.996 4.393 1.00 0.00 C ATOM 1664 C GLU A 103 -9.528 -5.225 2.888 1.00 0.00 C ATOM 1665 O GLU A 103 -8.994 -4.489 2.084 1.00 0.00 O ATOM 1666 CB GLU A 103 -10.170 -3.750 4.802 1.00 0.00 C ATOM 1667 CG GLU A 103 -9.486 -2.504 4.237 1.00 0.00 C ATOM 1668 CD GLU A 103 -8.827 -1.721 5.375 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -8.328 -2.352 6.292 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -8.829 -0.502 5.307 1.00 0.00 O ATOM 0 H GLU A 103 -7.500 -3.997 4.266 1.00 0.00 H new ATOM 0 HA GLU A 103 -9.764 -5.861 4.934 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -11.193 -3.817 4.430 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -10.229 -3.684 5.888 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -8.738 -2.791 3.498 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.216 -1.877 3.725 1.00 0.00 H new ATOM 1677 N TRP A 104 -10.247 -6.240 2.501 1.00 0.00 N ATOM 1678 CA TRP A 104 -10.423 -6.516 1.048 1.00 0.00 C ATOM 1679 C TRP A 104 -11.465 -5.554 0.476 1.00 0.00 C ATOM 1680 O TRP A 104 -12.654 -5.789 0.557 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.899 -7.956 0.862 1.00 0.00 C ATOM 1682 CG TRP A 104 -10.073 -8.862 1.716 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -8.802 -8.611 2.109 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -10.432 -10.152 2.290 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -8.358 -9.666 2.884 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -9.326 -10.640 3.026 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -11.597 -10.939 2.244 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -9.374 -11.864 3.692 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -11.649 -12.173 2.914 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -10.539 -12.634 3.636 1.00 0.00 C ATOM 0 H TRP A 104 -10.721 -6.891 3.127 1.00 0.00 H new ATOM 0 HA TRP A 104 -9.475 -6.377 0.528 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.951 -8.041 1.133 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.815 -8.247 -0.185 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -8.229 -7.731 1.858 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -7.428 -9.718 3.300 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -12.457 -10.593 1.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -8.517 -12.215 4.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -12.548 -12.769 2.873 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -10.584 -13.584 4.149 1.00 0.00 H new ATOM 1701 N MET A 105 -11.024 -4.468 -0.098 1.00 0.00 N ATOM 1702 CA MET A 105 -11.981 -3.485 -0.671 1.00 0.00 C ATOM 1703 C MET A 105 -12.429 -3.951 -2.056 1.00 0.00 C ATOM 1704 O MET A 105 -12.267 -5.099 -2.420 1.00 0.00 O ATOM 1705 CB MET A 105 -11.302 -2.120 -0.791 1.00 0.00 C ATOM 1706 CG MET A 105 -12.206 -1.046 -0.186 1.00 0.00 C ATOM 1707 SD MET A 105 -11.212 0.082 0.822 1.00 0.00 S ATOM 1708 CE MET A 105 -10.118 0.658 -0.499 1.00 0.00 C ATOM 0 H MET A 105 -10.039 -4.220 -0.194 1.00 0.00 H new ATOM 0 HA MET A 105 -12.849 -3.405 -0.016 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.341 -2.134 -0.277 1.00 0.00 H new ATOM 0 HB3 MET A 105 -11.100 -1.893 -1.838 1.00 0.00 H new ATOM 0 HG2 MET A 105 -12.712 -0.493 -0.978 1.00 0.00 H new ATOM 0 HG3 MET A 105 -12.981 -1.509 0.425 1.00 0.00 H new ATOM 0 HE1 MET A 105 -9.688 1.620 -0.222 1.00 0.00 H new ATOM 0 HE2 MET A 105 -9.318 -0.067 -0.651 1.00 0.00 H new ATOM 0 HE3 MET A 105 -10.688 0.768 -1.422 1.00 0.00 H new ATOM 1718 N SER A 106 -12.994 -3.066 -2.829 1.00 0.00 N ATOM 1719 CA SER A 106 -13.456 -3.452 -4.190 1.00 0.00 C ATOM 1720 C SER A 106 -13.171 -2.313 -5.172 1.00 0.00 C ATOM 1721 O SER A 106 -13.027 -1.170 -4.787 1.00 0.00 O ATOM 1722 CB SER A 106 -14.959 -3.730 -4.152 1.00 0.00 C ATOM 1723 OG SER A 106 -15.290 -4.666 -5.170 1.00 0.00 O ATOM 0 H SER A 106 -13.156 -2.091 -2.576 1.00 0.00 H new ATOM 0 HA SER A 106 -12.926 -4.347 -4.515 1.00 0.00 H new ATOM 0 HB2 SER A 106 -15.243 -4.122 -3.175 1.00 0.00 H new ATOM 0 HB3 SER A 106 -15.515 -2.804 -4.298 1.00 0.00 H new ATOM 0 HG SER A 106 -16.253 -4.848 -5.147 1.00 0.00 H new ATOM 1729 N LEU A 107 -13.096 -2.617 -6.438 1.00 0.00 N ATOM 1730 CA LEU A 107 -12.828 -1.555 -7.447 1.00 0.00 C ATOM 1731 C LEU A 107 -14.062 -1.385 -8.328 1.00 0.00 C ATOM 1732 O LEU A 107 -14.025 -1.619 -9.520 1.00 0.00 O ATOM 1733 CB LEU A 107 -11.637 -1.960 -8.316 1.00 0.00 C ATOM 1734 CG LEU A 107 -10.361 -1.324 -7.767 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -9.289 -2.403 -7.599 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -9.863 -0.258 -8.746 1.00 0.00 C ATOM 0 H LEU A 107 -13.209 -3.557 -6.818 1.00 0.00 H new ATOM 0 HA LEU A 107 -12.601 -0.617 -6.940 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -11.537 -3.045 -8.330 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -11.800 -1.641 -9.345 1.00 0.00 H new ATOM 0 HG LEU A 107 -10.568 -0.863 -6.801 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.377 -1.952 -7.207 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -9.645 -3.164 -6.905 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -9.081 -2.862 -8.565 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -8.953 0.197 -8.356 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -9.653 -0.720 -9.711 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.628 0.509 -8.869 1.00 0.00 H new ATOM 1748 N VAL A 108 -15.157 -0.984 -7.750 1.00 0.00 N ATOM 1749 CA VAL A 108 -16.399 -0.801 -8.552 1.00 0.00 C ATOM 1750 C VAL A 108 -16.637 0.690 -8.776 1.00 0.00 C ATOM 1751 O VAL A 108 -17.254 1.094 -9.742 1.00 0.00 O ATOM 1752 CB VAL A 108 -17.586 -1.401 -7.798 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -17.880 -0.562 -6.554 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -18.812 -1.405 -8.709 1.00 0.00 C ATOM 0 H VAL A 108 -15.247 -0.774 -6.756 1.00 0.00 H new ATOM 0 HA VAL A 108 -16.292 -1.303 -9.514 1.00 0.00 H new ATOM 0 HB VAL A 108 -17.348 -2.422 -7.498 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.726 -0.991 -6.018 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -17.005 -0.555 -5.905 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -18.119 0.459 -6.852 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.661 -1.832 -8.175 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -19.048 -0.383 -9.007 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -18.604 -2.002 -9.597 1.00 0.00 H new ATOM 1764 N GLY A 109 -16.150 1.510 -7.890 1.00 0.00 N ATOM 1765 CA GLY A 109 -16.342 2.976 -8.045 1.00 0.00 C ATOM 1766 C GLY A 109 -15.440 3.702 -7.054 1.00 0.00 C ATOM 1767 O GLY A 109 -15.847 4.643 -6.401 1.00 0.00 O ATOM 0 H GLY A 109 -15.625 1.227 -7.062 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -16.104 3.281 -9.064 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -17.385 3.240 -7.868 1.00 0.00 H new ATOM 1771 N LEU A 110 -14.212 3.274 -6.932 1.00 0.00 N ATOM 1772 CA LEU A 110 -13.289 3.940 -5.984 1.00 0.00 C ATOM 1773 C LEU A 110 -13.422 5.454 -6.153 1.00 0.00 C ATOM 1774 O LEU A 110 -13.661 5.946 -7.238 1.00 0.00 O ATOM 1775 CB LEU A 110 -11.856 3.503 -6.282 1.00 0.00 C ATOM 1776 CG LEU A 110 -11.295 2.752 -5.074 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -9.897 2.222 -5.399 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -11.217 3.700 -3.877 1.00 0.00 C ATOM 0 H LEU A 110 -13.813 2.491 -7.450 1.00 0.00 H new ATOM 0 HA LEU A 110 -13.536 3.664 -4.959 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -11.835 2.863 -7.164 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -11.237 4.372 -6.504 1.00 0.00 H new ATOM 0 HG LEU A 110 -11.950 1.914 -4.834 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -9.501 1.688 -4.536 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -9.954 1.544 -6.251 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -9.239 3.056 -5.643 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -10.817 3.166 -3.015 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -10.564 4.539 -4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -12.214 4.073 -3.642 1.00 0.00 H new ATOM 1790 N ASN A 111 -13.287 6.195 -5.091 1.00 0.00 N ATOM 1791 CA ASN A 111 -13.428 7.675 -5.203 1.00 0.00 C ATOM 1792 C ASN A 111 -12.186 8.367 -4.642 1.00 0.00 C ATOM 1793 O ASN A 111 -12.170 9.567 -4.462 1.00 0.00 O ATOM 1794 CB ASN A 111 -14.656 8.121 -4.406 1.00 0.00 C ATOM 1795 CG ASN A 111 -15.464 9.130 -5.224 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -15.187 9.350 -6.387 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -16.460 9.758 -4.660 1.00 0.00 N ATOM 0 H ASN A 111 -13.086 5.844 -4.154 1.00 0.00 H new ATOM 0 HA ASN A 111 -13.542 7.946 -6.253 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -15.275 7.258 -4.161 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -14.346 8.569 -3.462 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -17.006 10.433 -5.195 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -16.692 9.573 -3.684 1.00 0.00 H new ATOM 1804 N ALA A 112 -11.146 7.631 -4.352 1.00 0.00 N ATOM 1805 CA ALA A 112 -9.929 8.285 -3.793 1.00 0.00 C ATOM 1806 C ALA A 112 -10.346 9.128 -2.581 1.00 0.00 C ATOM 1807 O ALA A 112 -9.647 10.034 -2.172 1.00 0.00 O ATOM 1808 CB ALA A 112 -9.321 9.200 -4.856 1.00 0.00 C ATOM 0 H ALA A 112 -11.087 6.620 -4.476 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.197 7.534 -3.496 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -8.430 9.682 -4.454 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.051 8.611 -5.732 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -10.048 9.961 -5.140 1.00 0.00 H new ATOM 1814 N ASP A 113 -11.495 8.844 -2.016 1.00 0.00 N ATOM 1815 CA ASP A 113 -11.977 9.631 -0.851 1.00 0.00 C ATOM 1816 C ASP A 113 -11.716 8.858 0.436 1.00 0.00 C ATOM 1817 O ASP A 113 -11.416 9.431 1.465 1.00 0.00 O ATOM 1818 CB ASP A 113 -13.475 9.877 -0.993 1.00 0.00 C ATOM 1819 CG ASP A 113 -13.861 11.150 -0.236 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -13.065 12.076 -0.231 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -14.942 11.176 0.326 1.00 0.00 O ATOM 0 H ASP A 113 -12.119 8.096 -2.318 1.00 0.00 H new ATOM 0 HA ASP A 113 -11.447 10.583 -0.816 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.740 9.974 -2.046 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.032 9.026 -0.601 1.00 0.00 H new ATOM 1826 N ASP A 114 -11.812 7.561 0.388 1.00 0.00 N ATOM 1827 CA ASP A 114 -11.555 6.765 1.599 1.00 0.00 C ATOM 1828 C ASP A 114 -10.046 6.704 1.807 1.00 0.00 C ATOM 1829 O ASP A 114 -9.561 6.180 2.789 1.00 0.00 O ATOM 1830 CB ASP A 114 -12.107 5.358 1.392 1.00 0.00 C ATOM 1831 CG ASP A 114 -13.369 5.419 0.526 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -14.025 6.447 0.544 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -13.657 4.437 -0.138 1.00 0.00 O ATOM 0 H ASP A 114 -12.058 7.024 -0.443 1.00 0.00 H new ATOM 0 HA ASP A 114 -12.035 7.211 2.470 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -11.356 4.729 0.913 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.337 4.902 2.355 1.00 0.00 H new ATOM 1838 N PHE A 115 -9.299 7.265 0.891 1.00 0.00 N ATOM 1839 CA PHE A 115 -7.821 7.270 1.031 1.00 0.00 C ATOM 1840 C PHE A 115 -7.398 8.610 1.647 1.00 0.00 C ATOM 1841 O PHE A 115 -7.498 9.636 1.004 1.00 0.00 O ATOM 1842 CB PHE A 115 -7.181 7.114 -0.349 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.099 5.648 -0.699 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -6.194 4.818 -0.026 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -7.929 5.118 -1.694 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -6.120 3.458 -0.347 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -7.854 3.757 -2.015 1.00 0.00 C ATOM 1848 CZ PHE A 115 -6.950 2.928 -1.342 1.00 0.00 C ATOM 0 H PHE A 115 -9.655 7.720 0.051 1.00 0.00 H new ATOM 0 HA PHE A 115 -7.498 6.447 1.669 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -7.769 7.646 -1.097 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -6.185 7.557 -0.353 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -5.553 5.227 0.741 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -8.627 5.758 -2.214 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -5.423 2.817 0.173 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -8.494 3.347 -2.782 1.00 0.00 H new ATOM 0 HZ PHE A 115 -6.892 1.878 -1.590 1.00 0.00 H new ATOM 1858 N PRO A 116 -6.948 8.567 2.876 1.00 0.00 N ATOM 1859 CA PRO A 116 -6.518 9.777 3.596 1.00 0.00 C ATOM 1860 C PRO A 116 -5.539 10.593 2.740 1.00 0.00 C ATOM 1861 O PRO A 116 -4.888 10.057 1.865 1.00 0.00 O ATOM 1862 CB PRO A 116 -5.853 9.249 4.875 1.00 0.00 C ATOM 1863 CG PRO A 116 -6.117 7.724 4.943 1.00 0.00 C ATOM 1864 CD PRO A 116 -6.824 7.317 3.642 1.00 0.00 C ATOM 0 HA PRO A 116 -7.345 10.450 3.823 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -4.782 9.452 4.862 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -6.262 9.748 5.754 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.181 7.178 5.057 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -6.735 7.480 5.807 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -6.246 6.573 3.094 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -7.801 6.878 3.843 1.00 0.00 H new ATOM 1872 N PRO A 117 -5.483 11.875 3.010 1.00 0.00 N ATOM 1873 CA PRO A 117 -4.610 12.807 2.266 1.00 0.00 C ATOM 1874 C PRO A 117 -3.144 12.379 2.361 1.00 0.00 C ATOM 1875 O PRO A 117 -2.582 12.285 3.434 1.00 0.00 O ATOM 1876 CB PRO A 117 -4.820 14.169 2.943 1.00 0.00 C ATOM 1877 CG PRO A 117 -5.875 13.980 4.063 1.00 0.00 C ATOM 1878 CD PRO A 117 -6.279 12.498 4.082 1.00 0.00 C ATOM 0 HA PRO A 117 -4.853 12.832 1.204 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -3.882 14.538 3.359 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.160 14.908 2.218 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -5.465 14.277 5.028 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -6.745 14.611 3.879 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -6.065 12.042 5.049 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -7.347 12.377 3.902 1.00 0.00 H new ATOM 1886 N ALA A 118 -2.522 12.131 1.237 1.00 0.00 N ATOM 1887 CA ALA A 118 -1.087 11.715 1.237 1.00 0.00 C ATOM 1888 C ALA A 118 -0.776 10.994 -0.076 1.00 0.00 C ATOM 1889 O ALA A 118 0.297 11.121 -0.631 1.00 0.00 O ATOM 1890 CB ALA A 118 -0.822 10.765 2.408 1.00 0.00 C ATOM 0 H ALA A 118 -2.949 12.199 0.313 1.00 0.00 H new ATOM 0 HA ALA A 118 -0.454 12.597 1.338 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.226 10.465 2.403 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -1.050 11.271 3.346 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -1.453 9.882 2.310 1.00 0.00 H new ATOM 1896 N ASN A 119 -1.709 10.224 -0.564 1.00 0.00 N ATOM 1897 CA ASN A 119 -1.495 9.474 -1.814 1.00 0.00 C ATOM 1898 C ASN A 119 -2.461 9.982 -2.885 1.00 0.00 C ATOM 1899 O ASN A 119 -3.037 9.220 -3.620 1.00 0.00 O ATOM 1900 CB ASN A 119 -1.784 8.011 -1.520 1.00 0.00 C ATOM 1901 CG ASN A 119 -0.693 7.442 -0.610 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.978 6.683 0.295 1.00 0.00 O ATOM 1903 ND2 ASN A 119 0.552 7.775 -0.813 1.00 0.00 N ATOM 0 H ASN A 119 -2.624 10.086 -0.135 1.00 0.00 H new ATOM 0 HA ASN A 119 -0.474 9.602 -2.174 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.758 7.912 -1.041 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.827 7.445 -2.450 1.00 0.00 H new ATOM 0 HD21 ASN A 119 1.285 7.398 -0.212 1.00 0.00 H new ATOM 0 HD22 ASN A 119 0.792 8.412 -1.572 1.00 0.00 H new ATOM 1910 N GLU A 120 -2.656 11.261 -2.965 1.00 0.00 N ATOM 1911 CA GLU A 120 -3.602 11.817 -3.980 1.00 0.00 C ATOM 1912 C GLU A 120 -3.103 11.605 -5.432 1.00 0.00 C ATOM 1913 O GLU A 120 -3.895 11.310 -6.304 1.00 0.00 O ATOM 1914 CB GLU A 120 -3.779 13.315 -3.724 1.00 0.00 C ATOM 1915 CG GLU A 120 -4.036 13.554 -2.234 1.00 0.00 C ATOM 1916 CD GLU A 120 -4.774 14.880 -2.047 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -4.946 15.583 -3.029 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -5.155 15.171 -0.924 1.00 0.00 O ATOM 0 H GLU A 120 -2.202 11.955 -2.371 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.549 11.286 -3.878 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -2.888 13.856 -4.041 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.612 13.699 -4.313 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -4.626 12.736 -1.821 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.092 13.572 -1.690 1.00 0.00 H new ATOM 1925 N PRO A 121 -1.824 11.801 -5.661 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.228 11.680 -7.011 1.00 0.00 C ATOM 1927 C PRO A 121 -1.244 10.235 -7.525 1.00 0.00 C ATOM 1928 O PRO A 121 -1.327 10.002 -8.715 1.00 0.00 O ATOM 1929 CB PRO A 121 0.221 12.156 -6.843 1.00 0.00 C ATOM 1930 CG PRO A 121 0.442 12.468 -5.343 1.00 0.00 C ATOM 1931 CD PRO A 121 -0.870 12.155 -4.607 1.00 0.00 C ATOM 0 HA PRO A 121 -1.792 12.264 -7.739 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.917 11.389 -7.181 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.405 13.043 -7.449 1.00 0.00 H new ATOM 0 HG2 PRO A 121 1.259 11.867 -4.943 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.718 13.513 -5.206 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -0.740 11.335 -3.901 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.216 13.016 -4.035 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.154 9.259 -6.661 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.156 7.863 -7.134 1.00 0.00 C ATOM 1941 C VAL A 122 -2.596 7.348 -7.043 1.00 0.00 C ATOM 1942 O VAL A 122 -3.113 6.728 -7.950 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.200 7.076 -6.232 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -0.660 5.637 -6.096 1.00 0.00 C ATOM 1945 CG2 VAL A 122 1.208 7.106 -6.838 1.00 0.00 C ATOM 0 H VAL A 122 -1.080 9.378 -5.651 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.821 7.759 -8.166 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.190 7.535 -5.243 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.031 5.093 -5.452 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.658 5.614 -5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.684 5.168 -7.080 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.891 6.547 -6.199 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.187 6.654 -7.830 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.548 8.139 -6.917 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.245 7.647 -5.957 1.00 0.00 N ATOM 1956 CA ILE A 123 -4.661 7.240 -5.767 1.00 0.00 C ATOM 1957 C ILE A 123 -5.498 7.788 -6.914 1.00 0.00 C ATOM 1958 O ILE A 123 -6.508 7.229 -7.274 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.160 7.839 -4.460 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -4.444 7.150 -3.298 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -6.669 7.638 -4.350 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -5.049 5.761 -3.067 1.00 0.00 C ATOM 0 H ILE A 123 -2.845 8.168 -5.176 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.741 6.153 -5.743 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.949 8.908 -4.431 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.380 7.062 -3.516 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.536 7.752 -2.394 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.026 8.067 -3.414 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.164 8.131 -5.187 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -6.897 6.572 -4.371 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -4.536 5.274 -2.238 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.108 5.860 -2.830 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -4.934 5.160 -3.969 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.094 8.894 -7.475 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.882 9.488 -8.590 1.00 0.00 C ATOM 1976 C ALA A 124 -5.689 8.680 -9.882 1.00 0.00 C ATOM 1977 O ALA A 124 -6.597 8.551 -10.679 1.00 0.00 O ATOM 1978 CB ALA A 124 -5.429 10.932 -8.817 1.00 0.00 C ATOM 0 H ALA A 124 -4.255 9.410 -7.210 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.939 9.467 -8.323 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -6.004 11.370 -9.633 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.590 11.511 -7.908 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -4.369 10.945 -9.072 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.516 8.148 -10.108 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.281 7.372 -11.359 1.00 0.00 C ATOM 1986 C LYS A 125 -4.828 5.950 -11.231 1.00 0.00 C ATOM 1987 O LYS A 125 -5.701 5.546 -11.974 1.00 0.00 O ATOM 1988 CB LYS A 125 -2.781 7.310 -11.654 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.472 8.161 -12.885 1.00 0.00 C ATOM 1990 CD LYS A 125 -2.402 9.634 -12.481 1.00 0.00 C ATOM 1991 CE LYS A 125 -1.806 10.448 -13.628 1.00 0.00 C ATOM 1992 NZ LYS A 125 -2.825 10.606 -14.704 1.00 0.00 N ATOM 0 H LYS A 125 -3.714 8.218 -9.482 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.801 7.875 -12.175 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.215 7.672 -10.796 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.475 6.278 -11.825 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -1.526 7.849 -13.328 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -3.242 8.017 -13.643 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.398 10.003 -12.238 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -1.792 9.748 -11.585 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -1.487 11.426 -13.267 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -0.920 9.949 -14.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.421 11.160 -15.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -3.108 9.669 -15.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -3.658 11.100 -14.324 1.00 0.00 H new ATOM 2006 N LEU A 126 -4.320 5.177 -10.311 1.00 0.00 N ATOM 2007 CA LEU A 126 -4.810 3.784 -10.162 1.00 0.00 C ATOM 2008 C LEU A 126 -6.116 3.757 -9.364 1.00 0.00 C ATOM 2009 O LEU A 126 -6.436 2.777 -8.724 1.00 0.00 O ATOM 2010 CB LEU A 126 -3.756 2.941 -9.445 1.00 0.00 C ATOM 2011 CG LEU A 126 -3.072 3.751 -8.341 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.122 4.423 -7.460 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -2.228 2.814 -7.484 1.00 0.00 C ATOM 0 H LEU A 126 -3.587 5.453 -9.658 1.00 0.00 H new ATOM 0 HA LEU A 126 -4.996 3.372 -11.154 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -4.223 2.055 -9.016 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.012 2.594 -10.162 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.441 4.515 -8.795 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.627 4.997 -6.677 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.734 5.090 -8.067 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.757 3.662 -7.006 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.738 3.385 -6.695 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.869 2.054 -7.037 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.473 2.333 -8.106 1.00 0.00 H new ATOM 2025 N LYS A 127 -6.881 4.811 -9.403 1.00 0.00 N ATOM 2026 CA LYS A 127 -8.153 4.827 -8.667 1.00 0.00 C ATOM 2027 C LYS A 127 -9.121 3.892 -9.384 1.00 0.00 C ATOM 2028 O LYS A 127 -9.974 3.268 -8.785 1.00 0.00 O ATOM 2029 CB LYS A 127 -8.643 6.275 -8.665 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.626 6.543 -9.800 1.00 0.00 C ATOM 2031 CD LYS A 127 -11.060 6.403 -9.285 1.00 0.00 C ATOM 2032 CE LYS A 127 -11.260 7.323 -8.077 1.00 0.00 C ATOM 2033 NZ LYS A 127 -12.355 8.291 -8.367 1.00 0.00 N ATOM 0 H LYS A 127 -6.669 5.664 -9.920 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.058 4.484 -7.637 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.121 6.495 -7.711 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -7.790 6.947 -8.757 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.469 7.545 -10.200 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -9.453 5.842 -10.617 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -11.768 6.661 -10.073 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -11.258 5.368 -9.005 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -11.506 6.733 -7.194 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.336 7.858 -7.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -12.326 9.066 -7.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -12.231 8.678 -9.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -13.273 7.806 -8.306 1.00 0.00 H new ATOM 2047 N ARG A 128 -8.975 3.798 -10.673 1.00 0.00 N ATOM 2048 CA ARG A 128 -9.849 2.918 -11.465 1.00 0.00 C ATOM 2049 C ARG A 128 -9.004 1.858 -12.175 1.00 0.00 C ATOM 2050 O ARG A 128 -9.196 1.583 -13.343 1.00 0.00 O ATOM 2051 CB ARG A 128 -10.600 3.743 -12.508 1.00 0.00 C ATOM 2052 CG ARG A 128 -9.696 4.824 -13.106 1.00 0.00 C ATOM 2053 CD ARG A 128 -10.561 5.866 -13.819 1.00 0.00 C ATOM 2054 NE ARG A 128 -9.895 6.291 -15.085 1.00 0.00 N ATOM 2055 CZ ARG A 128 -10.561 6.977 -15.977 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -11.797 7.331 -15.743 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -9.990 7.312 -17.102 1.00 0.00 N ATOM 0 H ARG A 128 -8.274 4.305 -11.213 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.563 2.432 -10.801 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -10.965 3.089 -13.300 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -11.474 4.207 -12.050 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -9.108 5.298 -12.320 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -8.991 4.378 -13.807 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -11.544 5.449 -14.036 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -10.716 6.729 -13.171 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.919 6.046 -15.255 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -12.244 7.072 -14.863 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -12.315 7.866 -16.440 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -9.025 7.039 -17.285 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -10.509 7.847 -17.798 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.070 1.260 -11.482 1.00 0.00 N ATOM 2072 CA LEU A 129 -7.218 0.225 -12.111 1.00 0.00 C ATOM 2073 C LEU A 129 -8.070 -0.684 -13.000 1.00 0.00 C ATOM 2074 O LEU A 129 -7.787 -0.755 -14.184 1.00 0.00 O ATOM 2075 CB LEU A 129 -6.577 -0.602 -11.004 1.00 0.00 C ATOM 2076 CG LEU A 129 -5.770 0.309 -10.081 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -6.327 0.218 -8.659 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -4.306 -0.138 -10.084 1.00 0.00 C ATOM 2079 OXT LEU A 129 -8.991 -1.293 -12.481 1.00 0.00 O ATOM 0 H LEU A 129 -7.865 1.450 -10.501 1.00 0.00 H new ATOM 0 HA LEU A 129 -6.452 0.697 -12.726 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.346 -1.123 -10.434 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -5.929 -1.365 -11.436 1.00 0.00 H new ATOM 0 HG LEU A 129 -5.840 1.339 -10.432 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.751 0.868 -8.000 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -7.371 0.532 -8.656 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.256 -0.811 -8.306 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -3.726 0.510 -9.426 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -4.239 -1.167 -9.731 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -3.909 -0.076 -11.097 1.00 0.00 H new TER 2091 LEU A 129