USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1066 hydrogens (31 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -132:sc= 0.0657 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -116:sc=-0.00632 (180deg=-0.197) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -0.44 K(o=-0.44,f=-3!) USER MOD Single : A 13 ASN : amide:sc= -3.26! C(o=-3.3!,f=-4.4!) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 16 ASN : amide:sc= -6.97! C(o=-7!,f=-16!) USER MOD Single : A 21 THR OG1 : rot 150:sc= -1.46 USER MOD Single : A 28 HIS :FLIP no HD1:sc= -0.056 F(o=-0.87,f=-0.056) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.282 K(o=-0.28,f=-4.4!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -157:sc= -0.47 (180deg=-0.801) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN :FLIP amide:sc= -1.57 F(o=-3.8!,f=-1.6) USER MOD Single : A 61 THR OG1 : rot 22:sc= 1.25 USER MOD Single : A 63 GLN :FLIP amide:sc= -3.97! C(o=-6.1!,f=-4!) USER MOD Single : A 64 HIS : no HD1:sc= -0.401 X(o=-0.4,f=-0.093) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 165:sc= -0.225 (180deg=-0.716) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HE2:sc= -5.19! C(o=-5.2!,f=-8.2!) USER MOD Single : A 81 THR OG1 : rot -155:sc= -1.9! USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -1.6 X(o=-1.6,f=-1.7!) USER MOD Single : A 105 MET CE :methyl -147:sc= -0.0205 (180deg=-0.43) USER MOD Single : A 106 SER OG : rot 71:sc= 0.112 USER MOD Single : A 111 ASN :FLIP amide:sc= 1.01 F(o=-0.28,f=1) USER MOD Single : A 119 ASN : amide:sc= -6.87! C(o=-6.9!,f=-7.7!) USER MOD Single : A 125 LYS NZ :NH3+ -126:sc= -0.0528 (180deg=-0.373) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 APC O2' : rot 11:sc= 0.367 USER MOD Single : A 130 APC O3' : rot -62:sc= 0.273 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.092 16.708 7.441 1.00 0.00 N ATOM 2 CA MET A 1 14.340 15.744 8.551 1.00 0.00 C ATOM 3 C MET A 1 14.977 14.472 7.988 1.00 0.00 C ATOM 4 O MET A 1 15.986 14.004 8.474 1.00 0.00 O ATOM 5 CB MET A 1 13.015 15.396 9.229 1.00 0.00 C ATOM 6 CG MET A 1 13.292 14.678 10.551 1.00 0.00 C ATOM 7 SD MET A 1 12.108 15.235 11.801 1.00 0.00 S ATOM 8 CE MET A 1 13.266 15.315 13.191 1.00 0.00 C ATOM 0 H1 MET A 1 14.445 17.648 7.712 1.00 0.00 H new ATOM 0 H2 MET A 1 14.586 16.386 6.585 1.00 0.00 H new ATOM 0 H3 MET A 1 13.071 16.764 7.251 1.00 0.00 H new ATOM 0 HA MET A 1 15.013 16.194 9.281 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.437 16.303 9.409 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.416 14.761 8.576 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.213 13.599 10.415 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.310 14.883 10.882 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.738 15.644 14.086 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.695 14.328 13.365 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.064 16.021 12.960 1.00 0.00 H new ATOM 20 N LYS A 2 14.395 13.909 6.964 1.00 0.00 N ATOM 21 CA LYS A 2 14.967 12.669 6.370 1.00 0.00 C ATOM 22 C LYS A 2 14.081 12.206 5.212 1.00 0.00 C ATOM 23 O LYS A 2 13.225 12.933 4.746 1.00 0.00 O ATOM 24 CB LYS A 2 15.044 11.575 7.441 1.00 0.00 C ATOM 25 CG LYS A 2 13.813 11.644 8.354 1.00 0.00 C ATOM 26 CD LYS A 2 12.540 11.298 7.570 1.00 0.00 C ATOM 27 CE LYS A 2 12.645 9.887 6.983 1.00 0.00 C ATOM 28 NZ LYS A 2 12.618 8.885 8.087 1.00 0.00 N ATOM 0 H LYS A 2 13.548 14.255 6.514 1.00 0.00 H new ATOM 0 HA LYS A 2 15.971 12.871 5.996 1.00 0.00 H new ATOM 0 HB2 LYS A 2 15.101 10.595 6.967 1.00 0.00 H new ATOM 0 HB3 LYS A 2 15.952 11.697 8.032 1.00 0.00 H new ATOM 0 HG2 LYS A 2 13.933 10.952 9.188 1.00 0.00 H new ATOM 0 HG3 LYS A 2 13.724 12.644 8.779 1.00 0.00 H new ATOM 0 HD2 LYS A 2 11.672 11.363 8.226 1.00 0.00 H new ATOM 0 HD3 LYS A 2 12.390 12.022 6.769 1.00 0.00 H new ATOM 0 HE2 LYS A 2 11.820 9.706 6.294 1.00 0.00 H new ATOM 0 HE3 LYS A 2 13.567 9.788 6.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 13.524 8.375 8.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 12.466 9.371 8.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 11.845 8.209 7.923 1.00 0.00 H new ATOM 42 N LYS A 3 14.272 11.004 4.743 1.00 0.00 N ATOM 43 CA LYS A 3 13.436 10.502 3.617 1.00 0.00 C ATOM 44 C LYS A 3 13.097 9.026 3.855 1.00 0.00 C ATOM 45 O LYS A 3 13.927 8.250 4.282 1.00 0.00 O ATOM 46 CB LYS A 3 14.215 10.651 2.299 1.00 0.00 C ATOM 47 CG LYS A 3 13.685 9.661 1.253 1.00 0.00 C ATOM 48 CD LYS A 3 13.929 10.208 -0.155 1.00 0.00 C ATOM 49 CE LYS A 3 14.036 9.042 -1.142 1.00 0.00 C ATOM 50 NZ LYS A 3 14.638 9.520 -2.419 1.00 0.00 N ATOM 0 H LYS A 3 14.971 10.348 5.091 1.00 0.00 H new ATOM 0 HA LYS A 3 12.513 11.079 3.558 1.00 0.00 H new ATOM 0 HB2 LYS A 3 14.120 11.671 1.926 1.00 0.00 H new ATOM 0 HB3 LYS A 3 15.276 10.473 2.474 1.00 0.00 H new ATOM 0 HG2 LYS A 3 14.180 8.697 1.369 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.619 9.492 1.407 1.00 0.00 H new ATOM 0 HD2 LYS A 3 13.114 10.871 -0.446 1.00 0.00 H new ATOM 0 HD3 LYS A 3 14.844 10.800 -0.174 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.647 8.247 -0.716 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.049 8.620 -1.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 14.710 8.727 -3.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.038 10.264 -2.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.587 9.903 -2.233 1.00 0.00 H new ATOM 64 N LEU A 4 11.892 8.632 3.551 1.00 0.00 N ATOM 65 CA LEU A 4 11.516 7.201 3.728 1.00 0.00 C ATOM 66 C LEU A 4 10.521 6.803 2.648 1.00 0.00 C ATOM 67 O LEU A 4 9.549 7.485 2.390 1.00 0.00 O ATOM 68 CB LEU A 4 10.944 6.946 5.144 1.00 0.00 C ATOM 69 CG LEU A 4 9.418 7.096 5.234 1.00 0.00 C ATOM 70 CD1 LEU A 4 8.954 8.430 4.654 1.00 0.00 C ATOM 71 CD2 LEU A 4 8.704 5.939 4.526 1.00 0.00 C ATOM 0 H LEU A 4 11.154 9.236 3.189 1.00 0.00 H new ATOM 0 HA LEU A 4 12.408 6.583 3.629 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.220 5.940 5.461 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.410 7.640 5.844 1.00 0.00 H new ATOM 0 HG LEU A 4 9.155 7.071 6.292 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.869 8.504 4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 4 9.415 9.248 5.208 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.246 8.492 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 4 7.625 6.073 4.607 1.00 0.00 H new ATOM 0 HD22 LEU A 4 8.990 5.924 3.474 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.988 4.996 4.993 1.00 0.00 H new ATOM 83 N GLN A 5 10.759 5.697 2.009 1.00 0.00 N ATOM 84 CA GLN A 5 9.826 5.246 0.953 1.00 0.00 C ATOM 85 C GLN A 5 8.899 4.206 1.557 1.00 0.00 C ATOM 86 O GLN A 5 9.174 3.645 2.599 1.00 0.00 O ATOM 87 CB GLN A 5 10.605 4.633 -0.211 1.00 0.00 C ATOM 88 CG GLN A 5 11.491 5.711 -0.835 1.00 0.00 C ATOM 89 CD GLN A 5 12.914 5.589 -0.281 1.00 0.00 C ATOM 90 OE1 GLN A 5 13.205 6.079 0.792 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.819 4.953 -0.975 1.00 0.00 N ATOM 0 H GLN A 5 11.560 5.087 2.174 1.00 0.00 H new ATOM 0 HA GLN A 5 9.252 6.092 0.574 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.215 3.800 0.140 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.917 4.233 -0.956 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.502 5.605 -1.920 1.00 0.00 H new ATOM 0 HG3 GLN A 5 11.088 6.700 -0.616 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.575 4.542 -1.876 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.770 4.868 -0.616 1.00 0.00 H new ATOM 100 N ILE A 6 7.806 3.950 0.924 1.00 0.00 N ATOM 101 CA ILE A 6 6.862 2.955 1.472 1.00 0.00 C ATOM 102 C ILE A 6 6.579 1.918 0.395 1.00 0.00 C ATOM 103 O ILE A 6 5.985 2.211 -0.623 1.00 0.00 O ATOM 104 CB ILE A 6 5.582 3.678 1.883 1.00 0.00 C ATOM 105 CG1 ILE A 6 5.815 4.357 3.246 1.00 0.00 C ATOM 106 CG2 ILE A 6 4.410 2.693 1.964 1.00 0.00 C ATOM 107 CD1 ILE A 6 5.221 3.523 4.392 1.00 0.00 C ATOM 0 H ILE A 6 7.521 4.387 0.047 1.00 0.00 H new ATOM 0 HA ILE A 6 7.278 2.452 2.345 1.00 0.00 H new ATOM 0 HB ILE A 6 5.330 4.432 1.137 1.00 0.00 H new ATOM 0 HG12 ILE A 6 6.884 4.494 3.409 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.363 5.349 3.243 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.506 3.226 2.258 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.257 2.229 0.990 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.633 1.922 2.702 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.401 4.028 5.341 1.00 0.00 H new ATOM 0 HD12 ILE A 6 4.148 3.408 4.240 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.692 2.540 4.409 1.00 0.00 H new ATOM 119 N ALA A 7 7.015 0.713 0.608 1.00 0.00 N ATOM 120 CA ALA A 7 6.782 -0.348 -0.404 1.00 0.00 C ATOM 121 C ALA A 7 5.399 -0.935 -0.169 1.00 0.00 C ATOM 122 O ALA A 7 5.249 -2.081 0.204 1.00 0.00 O ATOM 123 CB ALA A 7 7.842 -1.443 -0.263 1.00 0.00 C ATOM 0 H ALA A 7 7.524 0.416 1.441 1.00 0.00 H new ATOM 0 HA ALA A 7 6.847 0.070 -1.408 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.665 -2.218 -1.008 1.00 0.00 H new ATOM 0 HB2 ALA A 7 8.832 -1.013 -0.415 1.00 0.00 H new ATOM 0 HB3 ALA A 7 7.785 -1.879 0.734 1.00 0.00 H new ATOM 129 N VAL A 8 4.384 -0.146 -0.369 1.00 0.00 N ATOM 130 CA VAL A 8 3.005 -0.646 -0.140 1.00 0.00 C ATOM 131 C VAL A 8 2.554 -1.492 -1.323 1.00 0.00 C ATOM 132 O VAL A 8 2.404 -2.687 -1.212 1.00 0.00 O ATOM 133 CB VAL A 8 2.036 0.532 0.074 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.366 1.682 -0.886 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.595 0.066 -0.170 1.00 0.00 C ATOM 0 H VAL A 8 4.450 0.823 -0.681 1.00 0.00 H new ATOM 0 HA VAL A 8 3.001 -1.265 0.757 1.00 0.00 H new ATOM 0 HB VAL A 8 2.142 0.886 1.100 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.671 2.505 -0.720 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.385 2.025 -0.706 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.277 1.334 -1.915 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.088 0.902 -0.018 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.499 -0.300 -1.192 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.349 -0.735 0.527 1.00 0.00 H new ATOM 145 N GLY A 9 2.311 -0.906 -2.448 1.00 0.00 N ATOM 146 CA GLY A 9 1.841 -1.737 -3.570 1.00 0.00 C ATOM 147 C GLY A 9 0.579 -2.432 -3.109 1.00 0.00 C ATOM 148 O GLY A 9 0.596 -3.559 -2.655 1.00 0.00 O ATOM 0 H GLY A 9 2.414 0.091 -2.638 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.644 -1.123 -4.448 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.600 -2.465 -3.855 1.00 0.00 H new ATOM 152 N ILE A 10 -0.520 -1.751 -3.207 1.00 0.00 N ATOM 153 CA ILE A 10 -1.801 -2.352 -2.756 1.00 0.00 C ATOM 154 C ILE A 10 -1.876 -3.745 -3.347 1.00 0.00 C ATOM 155 O ILE A 10 -1.077 -4.113 -4.183 1.00 0.00 O ATOM 156 CB ILE A 10 -3.016 -1.522 -3.204 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.584 -0.094 -3.551 1.00 0.00 C ATOM 158 CG2 ILE A 10 -4.036 -1.471 -2.062 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.811 0.737 -3.926 1.00 0.00 C ATOM 0 H ILE A 10 -0.589 -0.804 -3.580 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.827 -2.379 -1.667 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.458 -1.986 -4.086 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.072 0.358 -2.702 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.876 -0.109 -4.379 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.900 -0.884 -2.372 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.355 -2.483 -1.814 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.579 -1.009 -1.187 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.501 1.753 -4.172 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.304 0.289 -4.788 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.504 0.763 -3.085 1.00 0.00 H new ATOM 171 N ILE A 11 -2.798 -4.533 -2.915 1.00 0.00 N ATOM 172 CA ILE A 11 -2.879 -5.904 -3.451 1.00 0.00 C ATOM 173 C ILE A 11 -4.329 -6.220 -3.816 1.00 0.00 C ATOM 174 O ILE A 11 -5.115 -6.630 -2.989 1.00 0.00 O ATOM 175 CB ILE A 11 -2.356 -6.862 -2.381 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.875 -6.407 -1.018 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.824 -6.821 -2.372 1.00 0.00 C ATOM 178 CD1 ILE A 11 -2.283 -7.292 0.079 1.00 0.00 C ATOM 0 H ILE A 11 -3.499 -4.291 -2.215 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.276 -6.009 -4.353 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.695 -7.876 -2.592 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.605 -5.365 -0.844 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.963 -6.462 -0.995 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.446 -7.503 -1.610 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.446 -7.123 -3.349 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.488 -5.808 -2.151 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.655 -6.965 1.050 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.576 -8.328 -0.092 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.196 -7.215 0.062 1.00 0.00 H new ATOM 190 N ARG A 12 -4.677 -6.028 -5.062 1.00 0.00 N ATOM 191 CA ARG A 12 -6.072 -6.306 -5.515 1.00 0.00 C ATOM 192 C ARG A 12 -6.214 -7.813 -5.652 1.00 0.00 C ATOM 193 O ARG A 12 -5.288 -8.541 -5.354 1.00 0.00 O ATOM 194 CB ARG A 12 -6.310 -5.609 -6.858 1.00 0.00 C ATOM 195 CG ARG A 12 -5.608 -4.257 -6.815 1.00 0.00 C ATOM 196 CD ARG A 12 -6.279 -3.261 -7.770 1.00 0.00 C ATOM 197 NE ARG A 12 -6.316 -3.850 -9.139 1.00 0.00 N ATOM 198 CZ ARG A 12 -7.014 -3.281 -10.086 1.00 0.00 C ATOM 199 NH1 ARG A 12 -8.312 -3.209 -9.992 1.00 0.00 N ATOM 200 NH2 ARG A 12 -6.408 -2.777 -11.127 1.00 0.00 N ATOM 0 H ARG A 12 -4.049 -5.688 -5.790 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.807 -5.930 -4.803 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.921 -6.215 -7.676 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.377 -5.479 -7.037 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.630 -3.864 -5.799 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.560 -4.378 -7.087 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -7.290 -3.036 -7.430 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.729 -2.320 -7.780 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.793 -4.703 -9.338 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -8.787 -3.598 -9.177 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -8.853 -2.764 -10.733 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -5.392 -2.828 -11.200 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.951 -2.332 -11.867 1.00 0.00 H new ATOM 214 N ASN A 13 -7.350 -8.325 -6.035 1.00 0.00 N ATOM 215 CA ASN A 13 -7.426 -9.808 -6.080 1.00 0.00 C ATOM 216 C ASN A 13 -8.537 -10.380 -6.992 1.00 0.00 C ATOM 217 O ASN A 13 -8.249 -11.124 -7.880 1.00 0.00 O ATOM 218 CB ASN A 13 -7.598 -10.279 -4.627 1.00 0.00 C ATOM 219 CG ASN A 13 -8.730 -11.309 -4.489 1.00 0.00 C ATOM 220 OD1 ASN A 13 -8.811 -12.248 -5.257 1.00 0.00 O ATOM 221 ND2 ASN A 13 -9.609 -11.173 -3.534 1.00 0.00 N ATOM 0 H ASN A 13 -8.189 -7.812 -6.306 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.510 -10.187 -6.534 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.664 -10.716 -4.274 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -7.809 -9.420 -3.989 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -10.362 -11.854 -3.433 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -9.543 -10.386 -2.888 1.00 0.00 H new ATOM 228 N GLU A 14 -9.789 -10.113 -6.768 1.00 0.00 N ATOM 229 CA GLU A 14 -10.834 -10.785 -7.625 1.00 0.00 C ATOM 230 C GLU A 14 -11.209 -9.932 -8.831 1.00 0.00 C ATOM 231 O GLU A 14 -11.621 -10.426 -9.863 1.00 0.00 O ATOM 232 CB GLU A 14 -12.079 -11.008 -6.764 1.00 0.00 C ATOM 233 CG GLU A 14 -13.069 -11.913 -7.501 1.00 0.00 C ATOM 234 CD GLU A 14 -12.712 -13.379 -7.240 1.00 0.00 C ATOM 235 OE1 GLU A 14 -12.598 -13.742 -6.081 1.00 0.00 O ATOM 236 OE2 GLU A 14 -12.557 -14.110 -8.205 1.00 0.00 O ATOM 0 H GLU A 14 -10.141 -9.478 -6.052 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.431 -11.727 -7.997 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.798 -11.461 -5.813 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.549 -10.052 -6.535 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -14.085 -11.709 -7.163 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -13.041 -11.706 -8.571 1.00 0.00 H new ATOM 243 N ASN A 15 -11.045 -8.673 -8.705 1.00 0.00 N ATOM 244 CA ASN A 15 -11.345 -7.734 -9.815 1.00 0.00 C ATOM 245 C ASN A 15 -10.614 -6.471 -9.444 1.00 0.00 C ATOM 246 O ASN A 15 -9.905 -5.858 -10.218 1.00 0.00 O ATOM 247 CB ASN A 15 -12.852 -7.473 -9.890 1.00 0.00 C ATOM 248 CG ASN A 15 -13.255 -7.209 -11.340 1.00 0.00 C ATOM 249 OD1 ASN A 15 -12.575 -6.498 -12.053 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.341 -7.756 -11.812 1.00 0.00 N ATOM 0 H ASN A 15 -10.704 -8.225 -7.854 1.00 0.00 H new ATOM 0 HA ASN A 15 -11.040 -8.121 -10.787 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -13.400 -8.331 -9.500 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -13.115 -6.618 -9.267 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -14.619 -7.587 -12.779 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -14.913 -8.353 -11.214 1.00 0.00 H new ATOM 257 N ASN A 16 -10.767 -6.137 -8.208 1.00 0.00 N ATOM 258 CA ASN A 16 -10.094 -4.981 -7.620 1.00 0.00 C ATOM 259 C ASN A 16 -10.128 -5.221 -6.123 1.00 0.00 C ATOM 260 O ASN A 16 -10.290 -4.305 -5.343 1.00 0.00 O ATOM 261 CB ASN A 16 -10.843 -3.691 -7.963 1.00 0.00 C ATOM 262 CG ASN A 16 -10.124 -2.501 -7.325 1.00 0.00 C ATOM 263 OD1 ASN A 16 -9.142 -2.017 -7.852 1.00 0.00 O ATOM 264 ND2 ASN A 16 -10.571 -2.008 -6.203 1.00 0.00 N ATOM 0 H ASN A 16 -11.362 -6.648 -7.556 1.00 0.00 H new ATOM 0 HA ASN A 16 -9.077 -4.870 -7.997 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -10.893 -3.563 -9.044 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -11.870 -3.746 -7.601 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -10.096 -1.217 -5.769 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -11.395 -2.414 -5.760 1.00 0.00 H new ATOM 271 N GLU A 17 -10.001 -6.466 -5.702 1.00 0.00 N ATOM 272 CA GLU A 17 -10.064 -6.717 -4.243 1.00 0.00 C ATOM 273 C GLU A 17 -8.736 -6.347 -3.619 1.00 0.00 C ATOM 274 O GLU A 17 -7.861 -7.172 -3.438 1.00 0.00 O ATOM 275 CB GLU A 17 -10.387 -8.174 -3.940 1.00 0.00 C ATOM 276 CG GLU A 17 -11.691 -8.569 -4.627 1.00 0.00 C ATOM 277 CD GLU A 17 -12.826 -8.550 -3.601 1.00 0.00 C ATOM 278 OE1 GLU A 17 -12.831 -7.656 -2.770 1.00 0.00 O ATOM 279 OE2 GLU A 17 -13.668 -9.430 -3.661 1.00 0.00 O ATOM 0 H GLU A 17 -9.861 -7.285 -6.294 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.862 -6.105 -3.822 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.575 -8.815 -4.284 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.474 -8.320 -2.863 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.910 -7.879 -5.442 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.598 -9.562 -5.066 1.00 0.00 H new ATOM 286 N ILE A 18 -8.582 -5.102 -3.287 1.00 0.00 N ATOM 287 CA ILE A 18 -7.319 -4.655 -2.668 1.00 0.00 C ATOM 288 C ILE A 18 -7.337 -5.037 -1.196 1.00 0.00 C ATOM 289 O ILE A 18 -8.355 -4.952 -0.539 1.00 0.00 O ATOM 290 CB ILE A 18 -7.186 -3.132 -2.782 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.452 -2.458 -2.200 1.00 0.00 C ATOM 292 CG2 ILE A 18 -6.958 -2.738 -4.246 1.00 0.00 C ATOM 293 CD1 ILE A 18 -9.381 -1.938 -3.308 1.00 0.00 C ATOM 0 H ILE A 18 -9.283 -4.373 -3.420 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.479 -5.127 -3.178 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.325 -2.789 -2.208 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.992 -3.173 -1.579 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.159 -1.631 -1.553 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -6.864 -1.655 -4.321 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -6.044 -3.207 -4.611 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -7.803 -3.072 -4.848 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -10.258 -1.472 -2.859 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -8.850 -1.203 -3.913 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -9.695 -2.769 -3.939 1.00 0.00 H new ATOM 305 N PHE A 19 -6.218 -5.434 -0.671 1.00 0.00 N ATOM 306 CA PHE A 19 -6.152 -5.784 0.780 1.00 0.00 C ATOM 307 C PHE A 19 -5.992 -4.477 1.567 1.00 0.00 C ATOM 308 O PHE A 19 -5.156 -4.356 2.441 1.00 0.00 O ATOM 309 CB PHE A 19 -4.949 -6.692 1.034 1.00 0.00 C ATOM 310 CG PHE A 19 -5.092 -7.378 2.369 1.00 0.00 C ATOM 311 CD1 PHE A 19 -6.245 -8.115 2.659 1.00 0.00 C ATOM 312 CD2 PHE A 19 -4.064 -7.286 3.311 1.00 0.00 C ATOM 313 CE1 PHE A 19 -6.367 -8.761 3.894 1.00 0.00 C ATOM 314 CE2 PHE A 19 -4.187 -7.930 4.544 1.00 0.00 C ATOM 315 CZ PHE A 19 -5.336 -8.668 4.836 1.00 0.00 C ATOM 0 H PHE A 19 -5.340 -5.533 -1.181 1.00 0.00 H new ATOM 0 HA PHE A 19 -7.055 -6.309 1.091 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.870 -7.435 0.241 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.030 -6.106 1.014 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -7.040 -8.185 1.931 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -3.174 -6.717 3.085 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.256 -9.331 4.120 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.393 -7.857 5.272 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.429 -9.167 5.789 1.00 0.00 H new ATOM 325 N ILE A 20 -6.777 -3.489 1.228 1.00 0.00 N ATOM 326 CA ILE A 20 -6.698 -2.167 1.887 1.00 0.00 C ATOM 327 C ILE A 20 -7.404 -2.200 3.226 1.00 0.00 C ATOM 328 O ILE A 20 -8.338 -2.941 3.438 1.00 0.00 O ATOM 329 CB ILE A 20 -7.405 -1.161 0.990 1.00 0.00 C ATOM 330 CG1 ILE A 20 -7.289 0.250 1.560 1.00 0.00 C ATOM 331 CG2 ILE A 20 -8.882 -1.534 0.883 1.00 0.00 C ATOM 332 CD1 ILE A 20 -7.498 1.250 0.428 1.00 0.00 C ATOM 0 H ILE A 20 -7.488 -3.553 0.499 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.654 -1.897 2.047 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.935 -1.182 0.007 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.032 0.404 2.343 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -6.310 0.394 2.017 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -9.393 -0.816 0.241 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.975 -2.533 0.456 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -9.334 -1.520 1.875 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -7.418 2.264 0.819 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -6.739 1.096 -0.339 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -8.487 1.106 -0.007 1.00 0.00 H new ATOM 344 N THR A 21 -6.984 -1.364 4.114 1.00 0.00 N ATOM 345 CA THR A 21 -7.647 -1.303 5.442 1.00 0.00 C ATOM 346 C THR A 21 -9.065 -0.785 5.233 1.00 0.00 C ATOM 347 O THR A 21 -9.311 0.405 5.242 1.00 0.00 O ATOM 348 CB THR A 21 -6.877 -0.354 6.350 1.00 0.00 C ATOM 349 OG1 THR A 21 -7.712 0.058 7.424 1.00 0.00 O ATOM 350 CG2 THR A 21 -6.423 0.871 5.554 1.00 0.00 C ATOM 0 H THR A 21 -6.208 -0.715 3.984 1.00 0.00 H new ATOM 0 HA THR A 21 -7.670 -2.289 5.907 1.00 0.00 H new ATOM 0 HB THR A 21 -6.001 -0.868 6.747 1.00 0.00 H new ATOM 0 HG1 THR A 21 -7.162 0.239 8.215 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.873 1.547 6.209 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.778 0.554 4.735 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.295 1.386 5.151 1.00 0.00 H new ATOM 358 N ARG A 22 -9.999 -1.665 5.011 1.00 0.00 N ATOM 359 CA ARG A 22 -11.395 -1.217 4.763 1.00 0.00 C ATOM 360 C ARG A 22 -12.145 -1.061 6.080 1.00 0.00 C ATOM 361 O ARG A 22 -12.890 -1.931 6.484 1.00 0.00 O ATOM 362 CB ARG A 22 -12.105 -2.246 3.888 1.00 0.00 C ATOM 363 CG ARG A 22 -13.466 -1.691 3.476 1.00 0.00 C ATOM 364 CD ARG A 22 -13.264 -0.455 2.600 1.00 0.00 C ATOM 365 NE ARG A 22 -14.562 -0.075 1.981 1.00 0.00 N ATOM 366 CZ ARG A 22 -14.711 1.107 1.453 1.00 0.00 C ATOM 367 NH1 ARG A 22 -14.776 2.157 2.224 1.00 0.00 N ATOM 368 NH2 ARG A 22 -14.796 1.239 0.158 1.00 0.00 N ATOM 0 H ARG A 22 -9.856 -2.675 4.991 1.00 0.00 H new ATOM 0 HA ARG A 22 -11.374 -0.252 4.257 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.505 -2.468 3.005 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.229 -3.182 4.432 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -14.031 -2.448 2.932 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.049 -1.433 4.360 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.878 0.370 3.198 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.525 -0.660 1.826 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.336 -0.740 1.970 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.710 2.051 3.236 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -14.893 3.084 1.815 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -14.746 0.416 -0.443 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -14.913 2.165 -0.254 1.00 0.00 H new ATOM 382 N ARG A 23 -11.959 0.054 6.742 1.00 0.00 N ATOM 383 CA ARG A 23 -12.660 0.306 8.038 1.00 0.00 C ATOM 384 C ARG A 23 -12.862 -1.007 8.795 1.00 0.00 C ATOM 385 O ARG A 23 -13.962 -1.517 8.878 1.00 0.00 O ATOM 386 CB ARG A 23 -14.023 0.958 7.774 1.00 0.00 C ATOM 387 CG ARG A 23 -14.552 0.548 6.394 1.00 0.00 C ATOM 388 CD ARG A 23 -16.048 0.867 6.305 1.00 0.00 C ATOM 389 NE ARG A 23 -16.698 -0.058 5.331 1.00 0.00 N ATOM 390 CZ ARG A 23 -17.998 -0.183 5.314 1.00 0.00 C ATOM 391 NH1 ARG A 23 -18.755 0.789 5.747 1.00 0.00 N ATOM 392 NH2 ARG A 23 -18.542 -1.283 4.864 1.00 0.00 N ATOM 0 H ARG A 23 -11.344 0.808 6.436 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.047 0.975 8.642 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.732 0.659 8.546 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -13.931 2.043 7.828 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.009 1.079 5.612 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.386 -0.517 6.231 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.512 0.763 7.286 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -16.192 1.901 5.992 1.00 0.00 H new ATOM 0 HE ARG A 23 -16.126 -0.593 4.678 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -18.331 1.647 6.099 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.770 0.690 5.733 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -17.951 -2.043 4.526 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -19.557 -1.381 4.850 1.00 0.00 H new ATOM 406 N ALA A 24 -11.813 -1.561 9.343 1.00 0.00 N ATOM 407 CA ALA A 24 -11.955 -2.843 10.088 1.00 0.00 C ATOM 408 C ALA A 24 -13.219 -2.790 10.950 1.00 0.00 C ATOM 409 O ALA A 24 -14.071 -3.653 10.876 1.00 0.00 O ATOM 410 CB ALA A 24 -10.736 -3.052 10.989 1.00 0.00 C ATOM 0 H ALA A 24 -10.867 -1.181 9.306 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.027 -3.668 9.379 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -10.842 -3.991 11.533 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.834 -3.087 10.378 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -10.662 -2.228 11.698 1.00 0.00 H new ATOM 416 N ALA A 25 -13.351 -1.774 11.762 1.00 0.00 N ATOM 417 CA ALA A 25 -14.563 -1.657 12.621 1.00 0.00 C ATOM 418 C ALA A 25 -15.716 -1.090 11.791 1.00 0.00 C ATOM 419 O ALA A 25 -15.615 -0.947 10.589 1.00 0.00 O ATOM 420 CB ALA A 25 -14.272 -0.718 13.795 1.00 0.00 C ATOM 0 H ALA A 25 -12.671 -1.021 11.866 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.834 -2.641 13.004 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -15.160 -0.634 14.422 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.447 -1.118 14.385 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.002 0.267 13.415 1.00 0.00 H new ATOM 426 N ASP A 26 -16.810 -0.761 12.422 1.00 0.00 N ATOM 427 CA ASP A 26 -17.963 -0.201 11.662 1.00 0.00 C ATOM 428 C ASP A 26 -17.718 1.283 11.384 1.00 0.00 C ATOM 429 O ASP A 26 -18.227 2.147 12.070 1.00 0.00 O ATOM 430 CB ASP A 26 -19.245 -0.365 12.484 1.00 0.00 C ATOM 431 CG ASP A 26 -19.437 -1.838 12.844 1.00 0.00 C ATOM 432 OD1 ASP A 26 -19.482 -2.650 11.934 1.00 0.00 O ATOM 433 OD2 ASP A 26 -19.538 -2.130 14.025 1.00 0.00 O ATOM 0 H ASP A 26 -16.955 -0.855 13.427 1.00 0.00 H new ATOM 0 HA ASP A 26 -18.069 -0.734 10.717 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -19.187 0.237 13.391 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -20.102 -0.004 11.916 1.00 0.00 H new ATOM 438 N ALA A 27 -16.940 1.585 10.381 1.00 0.00 N ATOM 439 CA ALA A 27 -16.660 3.012 10.057 1.00 0.00 C ATOM 440 C ALA A 27 -17.961 3.727 9.702 1.00 0.00 C ATOM 441 O ALA A 27 -18.109 4.912 9.930 1.00 0.00 O ATOM 442 CB ALA A 27 -15.715 3.090 8.855 1.00 0.00 C ATOM 0 H ALA A 27 -16.486 0.905 9.772 1.00 0.00 H new ATOM 0 HA ALA A 27 -16.202 3.487 10.924 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -15.511 4.135 8.619 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -14.780 2.583 9.094 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -16.180 2.608 7.995 1.00 0.00 H new ATOM 448 N HIS A 28 -18.898 3.030 9.121 1.00 0.00 N ATOM 449 CA HIS A 28 -20.167 3.696 8.730 1.00 0.00 C ATOM 450 C HIS A 28 -19.811 4.884 7.836 1.00 0.00 C ATOM 451 O HIS A 28 -20.575 5.816 7.678 1.00 0.00 O ATOM 452 CB HIS A 28 -20.903 4.181 9.982 1.00 0.00 C ATOM 453 CG HIS A 28 -21.851 3.108 10.454 1.00 0.00 C ATOM 454 ND1 HIS A 28 -21.666 1.775 10.731 1.00 0.00 N flip ATOM 455 CD2 HIS A 28 -23.193 3.360 10.694 1.00 0.00 C flip ATOM 456 CE1 HIS A 28 -22.871 1.208 11.135 1.00 0.00 C flip ATOM 457 NE2 HIS A 28 -23.758 2.206 11.096 1.00 0.00 N flip ATOM 0 H HIS A 28 -18.839 2.035 8.902 1.00 0.00 H new ATOM 0 HA HIS A 28 -20.818 3.003 8.197 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -20.187 4.420 10.768 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -21.453 5.096 9.762 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -23.694 4.310 10.579 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -23.050 0.182 11.419 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -24.743 2.106 11.341 1.00 0.00 H new ATOM 465 N MET A 29 -18.640 4.848 7.251 1.00 0.00 N ATOM 466 CA MET A 29 -18.199 5.958 6.363 1.00 0.00 C ATOM 467 C MET A 29 -17.759 5.374 5.014 1.00 0.00 C ATOM 468 O MET A 29 -18.570 4.848 4.279 1.00 0.00 O ATOM 469 CB MET A 29 -17.032 6.695 7.025 1.00 0.00 C ATOM 470 CG MET A 29 -17.560 7.562 8.170 1.00 0.00 C ATOM 471 SD MET A 29 -18.561 8.911 7.496 1.00 0.00 S ATOM 472 CE MET A 29 -17.568 10.275 8.149 1.00 0.00 C ATOM 0 H MET A 29 -17.967 4.088 7.354 1.00 0.00 H new ATOM 0 HA MET A 29 -19.017 6.659 6.200 1.00 0.00 H new ATOM 0 HB2 MET A 29 -16.303 5.978 7.404 1.00 0.00 H new ATOM 0 HB3 MET A 29 -16.517 7.316 6.292 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.158 6.957 8.852 1.00 0.00 H new ATOM 0 HG3 MET A 29 -16.728 7.966 8.748 1.00 0.00 H new ATOM 0 HE1 MET A 29 -18.011 11.224 7.848 1.00 0.00 H new ATOM 0 HE2 MET A 29 -17.540 10.216 9.237 1.00 0.00 H new ATOM 0 HE3 MET A 29 -16.554 10.208 7.756 1.00 0.00 H new ATOM 482 N ALA A 30 -16.486 5.441 4.684 1.00 0.00 N ATOM 483 CA ALA A 30 -16.022 4.869 3.381 1.00 0.00 C ATOM 484 C ALA A 30 -14.670 5.464 2.968 1.00 0.00 C ATOM 485 O ALA A 30 -14.007 4.954 2.089 1.00 0.00 O ATOM 486 CB ALA A 30 -17.050 5.170 2.294 1.00 0.00 C ATOM 0 H ALA A 30 -15.757 5.864 5.258 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.908 3.792 3.505 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.710 4.753 1.346 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -18.007 4.724 2.565 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.168 6.249 2.194 1.00 0.00 H new ATOM 492 N ASN A 31 -14.252 6.530 3.588 1.00 0.00 N ATOM 493 CA ASN A 31 -12.939 7.140 3.215 1.00 0.00 C ATOM 494 C ASN A 31 -11.799 6.381 3.906 1.00 0.00 C ATOM 495 O ASN A 31 -10.673 6.834 3.943 1.00 0.00 O ATOM 496 CB ASN A 31 -12.915 8.605 3.656 1.00 0.00 C ATOM 497 CG ASN A 31 -12.100 9.427 2.655 1.00 0.00 C ATOM 498 OD1 ASN A 31 -11.622 8.906 1.667 1.00 0.00 O ATOM 499 ND2 ASN A 31 -11.923 10.702 2.868 1.00 0.00 N ATOM 0 H ASN A 31 -14.758 7.007 4.335 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.808 7.080 2.134 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -13.932 8.993 3.719 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -12.479 8.689 4.652 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -11.384 11.260 2.206 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -12.324 11.141 3.697 1.00 0.00 H new ATOM 506 N LYS A 32 -12.092 5.237 4.462 1.00 0.00 N ATOM 507 CA LYS A 32 -11.047 4.439 5.165 1.00 0.00 C ATOM 508 C LYS A 32 -10.226 3.621 4.162 1.00 0.00 C ATOM 509 O LYS A 32 -10.110 2.419 4.292 1.00 0.00 O ATOM 510 CB LYS A 32 -11.744 3.484 6.128 1.00 0.00 C ATOM 511 CG LYS A 32 -11.104 3.579 7.510 1.00 0.00 C ATOM 512 CD LYS A 32 -9.617 3.235 7.415 1.00 0.00 C ATOM 513 CE LYS A 32 -9.158 2.594 8.726 1.00 0.00 C ATOM 514 NZ LYS A 32 -8.163 3.480 9.392 1.00 0.00 N ATOM 0 H LYS A 32 -13.021 4.817 4.459 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.376 5.113 5.698 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.804 3.728 6.192 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.674 2.462 5.755 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.229 4.585 7.911 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.602 2.897 8.199 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.443 2.552 6.583 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.036 4.136 7.215 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.013 2.432 9.382 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.717 1.617 8.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.851 3.044 10.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.343 3.613 8.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.599 4.403 9.592 1.00 0.00 H new ATOM 528 N LEU A 33 -9.649 4.242 3.168 1.00 0.00 N ATOM 529 CA LEU A 33 -8.848 3.455 2.186 1.00 0.00 C ATOM 530 C LEU A 33 -7.407 3.968 2.165 1.00 0.00 C ATOM 531 O LEU A 33 -7.030 4.769 1.334 1.00 0.00 O ATOM 532 CB LEU A 33 -9.477 3.586 0.789 1.00 0.00 C ATOM 533 CG LEU A 33 -10.820 2.844 0.728 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.110 2.465 -0.724 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.784 1.562 1.570 1.00 0.00 C ATOM 0 H LEU A 33 -9.696 5.246 2.995 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.844 2.405 2.478 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.626 4.639 0.549 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.797 3.181 0.039 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.595 3.501 1.123 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -12.062 1.937 -0.779 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.160 3.368 -1.333 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.315 1.819 -1.097 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.749 1.058 1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.004 0.901 1.193 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.574 1.815 2.609 1.00 0.00 H new ATOM 547 N GLU A 34 -6.595 3.500 3.078 1.00 0.00 N ATOM 548 CA GLU A 34 -5.176 3.948 3.115 1.00 0.00 C ATOM 549 C GLU A 34 -4.322 3.006 2.253 1.00 0.00 C ATOM 550 O GLU A 34 -4.778 2.503 1.245 1.00 0.00 O ATOM 551 CB GLU A 34 -4.678 3.947 4.562 1.00 0.00 C ATOM 552 CG GLU A 34 -3.953 5.265 4.843 1.00 0.00 C ATOM 553 CD GLU A 34 -2.631 4.981 5.556 1.00 0.00 C ATOM 554 OE1 GLU A 34 -2.069 3.924 5.322 1.00 0.00 O ATOM 555 OE2 GLU A 34 -2.201 5.826 6.322 1.00 0.00 O ATOM 0 H GLU A 34 -6.856 2.827 3.798 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.096 4.960 2.717 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.516 3.825 5.248 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.006 3.105 4.728 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.768 5.796 3.909 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.578 5.912 5.459 1.00 0.00 H new ATOM 562 N PHE A 35 -3.087 2.775 2.619 1.00 0.00 N ATOM 563 CA PHE A 35 -2.225 1.880 1.785 1.00 0.00 C ATOM 564 C PHE A 35 -1.362 0.984 2.688 1.00 0.00 C ATOM 565 O PHE A 35 -0.647 1.476 3.538 1.00 0.00 O ATOM 566 CB PHE A 35 -1.304 2.734 0.898 1.00 0.00 C ATOM 567 CG PHE A 35 -1.772 4.173 0.905 1.00 0.00 C ATOM 568 CD1 PHE A 35 -1.467 5.000 1.992 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.523 4.670 -0.166 1.00 0.00 C ATOM 570 CE1 PHE A 35 -1.911 6.327 2.009 1.00 0.00 C ATOM 571 CE2 PHE A 35 -2.970 5.997 -0.148 1.00 0.00 C ATOM 572 CZ PHE A 35 -2.664 6.826 0.939 1.00 0.00 C ATOM 0 H PHE A 35 -2.640 3.162 3.450 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.865 1.255 1.163 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.278 2.674 1.261 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.305 2.347 -0.121 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.889 4.614 2.818 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.757 4.031 -1.005 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.673 6.966 2.847 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.551 6.382 -0.973 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.009 7.849 0.952 1.00 0.00 H new ATOM 582 N PRO A 36 -1.448 -0.310 2.472 1.00 0.00 N ATOM 583 CA PRO A 36 -0.670 -1.296 3.252 1.00 0.00 C ATOM 584 C PRO A 36 0.808 -1.264 2.822 1.00 0.00 C ATOM 585 O PRO A 36 1.170 -1.833 1.812 1.00 0.00 O ATOM 586 CB PRO A 36 -1.297 -2.647 2.871 1.00 0.00 C ATOM 587 CG PRO A 36 -2.134 -2.416 1.586 1.00 0.00 C ATOM 588 CD PRO A 36 -2.331 -0.901 1.444 1.00 0.00 C ATOM 0 HA PRO A 36 -0.696 -1.102 4.324 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.524 -3.395 2.697 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.926 -3.021 3.679 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.621 -2.821 0.714 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.095 -2.925 1.656 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.061 -0.558 0.445 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.372 -0.620 1.607 1.00 0.00 H new ATOM 596 N GLY A 37 1.670 -0.608 3.564 1.00 0.00 N ATOM 597 CA GLY A 37 3.106 -0.568 3.150 1.00 0.00 C ATOM 598 C GLY A 37 4.026 -0.795 4.347 1.00 0.00 C ATOM 599 O GLY A 37 3.838 -0.234 5.408 1.00 0.00 O ATOM 0 H GLY A 37 1.445 -0.107 4.424 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.292 -1.331 2.394 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.330 0.396 2.692 1.00 0.00 H new ATOM 603 N GLY A 38 5.024 -1.625 4.175 1.00 0.00 N ATOM 604 CA GLY A 38 5.969 -1.908 5.288 1.00 0.00 C ATOM 605 C GLY A 38 7.327 -1.253 5.014 1.00 0.00 C ATOM 606 O GLY A 38 8.361 -1.794 5.358 1.00 0.00 O ATOM 0 H GLY A 38 5.222 -2.119 3.305 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.559 -1.533 6.226 1.00 0.00 H new ATOM 0 HA3 GLY A 38 6.094 -2.985 5.403 1.00 0.00 H new ATOM 610 N LYS A 39 7.329 -0.081 4.422 1.00 0.00 N ATOM 611 CA LYS A 39 8.611 0.643 4.149 1.00 0.00 C ATOM 612 C LYS A 39 9.552 -0.170 3.262 1.00 0.00 C ATOM 613 O LYS A 39 10.003 -1.231 3.636 1.00 0.00 O ATOM 614 CB LYS A 39 9.319 0.909 5.473 1.00 0.00 C ATOM 615 CG LYS A 39 10.650 1.615 5.223 1.00 0.00 C ATOM 616 CD LYS A 39 10.429 3.126 5.233 1.00 0.00 C ATOM 617 CE LYS A 39 11.517 3.804 4.395 1.00 0.00 C ATOM 618 NZ LYS A 39 12.718 4.049 5.243 1.00 0.00 N ATOM 0 H LYS A 39 6.489 0.408 4.114 1.00 0.00 H new ATOM 0 HA LYS A 39 8.364 1.570 3.631 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.688 1.523 6.115 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.490 -0.031 5.998 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.372 1.336 5.990 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.066 1.303 4.265 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.444 3.363 4.831 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.455 3.502 6.256 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.781 3.175 3.545 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.146 4.746 3.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.281 4.821 4.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.417 4.313 6.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.295 3.185 5.286 1.00 0.00 H new ATOM 632 N ILE A 40 9.900 0.344 2.111 1.00 0.00 N ATOM 633 CA ILE A 40 10.870 -0.393 1.245 1.00 0.00 C ATOM 634 C ILE A 40 12.283 -0.060 1.728 1.00 0.00 C ATOM 635 O ILE A 40 12.599 1.080 2.005 1.00 0.00 O ATOM 636 CB ILE A 40 10.694 -0.018 -0.246 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.064 0.027 -0.962 1.00 0.00 C ATOM 638 CG2 ILE A 40 9.998 1.338 -0.380 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.716 1.402 -0.780 1.00 0.00 C ATOM 0 H ILE A 40 9.561 1.230 1.736 1.00 0.00 H new ATOM 0 HA ILE A 40 10.689 -1.465 1.322 1.00 0.00 H new ATOM 0 HB ILE A 40 10.075 -0.783 -0.715 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.717 -0.748 -0.561 1.00 0.00 H new ATOM 0 HG13 ILE A 40 11.934 -0.183 -2.024 1.00 0.00 H new ATOM 0 HG21 ILE A 40 9.883 1.585 -1.435 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.016 1.291 0.091 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.599 2.105 0.109 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.679 1.418 -1.289 1.00 0.00 H new ATOM 0 HD12 ILE A 40 12.069 2.170 -1.203 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.864 1.597 0.282 1.00 0.00 H new ATOM 651 N GLU A 41 13.138 -1.035 1.834 1.00 0.00 N ATOM 652 CA GLU A 41 14.520 -0.743 2.299 1.00 0.00 C ATOM 653 C GLU A 41 15.406 -1.984 2.143 1.00 0.00 C ATOM 654 O GLU A 41 16.593 -1.881 1.906 1.00 0.00 O ATOM 655 CB GLU A 41 14.470 -0.291 3.764 1.00 0.00 C ATOM 656 CG GLU A 41 14.440 -1.508 4.697 1.00 0.00 C ATOM 657 CD GLU A 41 14.138 -1.050 6.126 1.00 0.00 C ATOM 658 OE1 GLU A 41 13.857 0.125 6.303 1.00 0.00 O ATOM 659 OE2 GLU A 41 14.191 -1.879 7.018 1.00 0.00 O ATOM 0 H GLU A 41 12.943 -2.013 1.621 1.00 0.00 H new ATOM 0 HA GLU A 41 14.950 0.054 1.693 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.338 0.328 3.990 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.587 0.326 3.931 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.682 -2.217 4.363 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.398 -2.027 4.665 1.00 0.00 H new ATOM 666 N MET A 42 14.843 -3.154 2.273 1.00 0.00 N ATOM 667 CA MET A 42 15.662 -4.392 2.129 1.00 0.00 C ATOM 668 C MET A 42 16.391 -4.363 0.784 1.00 0.00 C ATOM 669 O MET A 42 15.863 -3.900 -0.208 1.00 0.00 O ATOM 670 CB MET A 42 14.752 -5.621 2.196 1.00 0.00 C ATOM 671 CG MET A 42 15.239 -6.556 3.305 1.00 0.00 C ATOM 672 SD MET A 42 14.596 -5.988 4.899 1.00 0.00 S ATOM 673 CE MET A 42 14.092 -7.605 5.533 1.00 0.00 C ATOM 0 H MET A 42 13.854 -3.307 2.472 1.00 0.00 H new ATOM 0 HA MET A 42 16.392 -4.442 2.937 1.00 0.00 H new ATOM 0 HB2 MET A 42 13.724 -5.315 2.389 1.00 0.00 H new ATOM 0 HB3 MET A 42 14.755 -6.142 1.239 1.00 0.00 H new ATOM 0 HG2 MET A 42 14.906 -7.575 3.109 1.00 0.00 H new ATOM 0 HG3 MET A 42 16.329 -6.576 3.326 1.00 0.00 H new ATOM 0 HE1 MET A 42 13.659 -7.488 6.527 1.00 0.00 H new ATOM 0 HE2 MET A 42 13.351 -8.043 4.864 1.00 0.00 H new ATOM 0 HE3 MET A 42 14.961 -8.260 5.591 1.00 0.00 H new ATOM 683 N GLY A 43 17.602 -4.848 0.743 1.00 0.00 N ATOM 684 CA GLY A 43 18.364 -4.840 -0.539 1.00 0.00 C ATOM 685 C GLY A 43 18.570 -3.399 -0.993 1.00 0.00 C ATOM 686 O GLY A 43 19.223 -2.608 -0.341 1.00 0.00 O ATOM 0 H GLY A 43 18.096 -5.249 1.540 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.327 -5.333 -0.406 1.00 0.00 H new ATOM 0 HA3 GLY A 43 17.822 -5.400 -1.301 1.00 0.00 H new ATOM 690 N GLU A 44 18.002 -3.060 -2.108 1.00 0.00 N ATOM 691 CA GLU A 44 18.135 -1.669 -2.637 1.00 0.00 C ATOM 692 C GLU A 44 17.168 -1.438 -3.812 1.00 0.00 C ATOM 693 O GLU A 44 16.913 -0.314 -4.197 1.00 0.00 O ATOM 694 CB GLU A 44 19.576 -1.432 -3.105 1.00 0.00 C ATOM 695 CG GLU A 44 20.176 -2.746 -3.614 1.00 0.00 C ATOM 696 CD GLU A 44 21.564 -2.479 -4.202 1.00 0.00 C ATOM 697 OE1 GLU A 44 21.630 -1.961 -5.304 1.00 0.00 O ATOM 698 OE2 GLU A 44 22.538 -2.798 -3.540 1.00 0.00 O ATOM 0 H GLU A 44 17.444 -3.688 -2.686 1.00 0.00 H new ATOM 0 HA GLU A 44 17.887 -0.969 -1.839 1.00 0.00 H new ATOM 0 HB2 GLU A 44 19.593 -0.683 -3.896 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.176 -1.041 -2.283 1.00 0.00 H new ATOM 0 HG2 GLU A 44 20.247 -3.466 -2.799 1.00 0.00 H new ATOM 0 HG3 GLU A 44 19.527 -3.185 -4.371 1.00 0.00 H new ATOM 705 N THR A 45 16.626 -2.482 -4.383 1.00 0.00 N ATOM 706 CA THR A 45 15.685 -2.325 -5.519 1.00 0.00 C ATOM 707 C THR A 45 14.264 -2.552 -5.002 1.00 0.00 C ATOM 708 O THR A 45 14.055 -3.417 -4.190 1.00 0.00 O ATOM 709 CB THR A 45 16.037 -3.389 -6.561 1.00 0.00 C ATOM 710 OG1 THR A 45 17.301 -3.080 -7.135 1.00 0.00 O ATOM 711 CG2 THR A 45 14.974 -3.431 -7.660 1.00 0.00 C ATOM 0 H THR A 45 16.801 -3.447 -4.103 1.00 0.00 H new ATOM 0 HA THR A 45 15.753 -1.331 -5.962 1.00 0.00 H new ATOM 0 HB THR A 45 16.077 -4.364 -6.075 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.532 -3.760 -7.802 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.239 -4.193 -8.393 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.006 -3.671 -7.221 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.919 -2.459 -8.150 1.00 0.00 H new ATOM 719 N PRO A 46 13.326 -1.778 -5.488 1.00 0.00 N ATOM 720 CA PRO A 46 11.912 -1.902 -5.073 1.00 0.00 C ATOM 721 C PRO A 46 11.460 -3.365 -5.100 1.00 0.00 C ATOM 722 O PRO A 46 10.478 -3.721 -4.484 1.00 0.00 O ATOM 723 CB PRO A 46 11.139 -1.051 -6.087 1.00 0.00 C ATOM 724 CG PRO A 46 12.183 -0.268 -6.930 1.00 0.00 C ATOM 725 CD PRO A 46 13.583 -0.732 -6.490 1.00 0.00 C ATOM 0 HA PRO A 46 11.745 -1.565 -4.050 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.524 -1.683 -6.728 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.465 -0.363 -5.576 1.00 0.00 H new ATOM 0 HG2 PRO A 46 12.034 -0.456 -7.993 1.00 0.00 H new ATOM 0 HG3 PRO A 46 12.070 0.805 -6.777 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.155 -1.121 -7.332 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.159 0.091 -6.066 1.00 0.00 H new ATOM 733 N GLU A 47 12.168 -4.222 -5.785 1.00 0.00 N ATOM 734 CA GLU A 47 11.765 -5.652 -5.807 1.00 0.00 C ATOM 735 C GLU A 47 12.203 -6.303 -4.492 1.00 0.00 C ATOM 736 O GLU A 47 11.429 -6.442 -3.583 1.00 0.00 O ATOM 737 CB GLU A 47 12.434 -6.366 -6.984 1.00 0.00 C ATOM 738 CG GLU A 47 11.381 -6.715 -8.037 1.00 0.00 C ATOM 739 CD GLU A 47 12.054 -6.854 -9.404 1.00 0.00 C ATOM 740 OE1 GLU A 47 12.935 -6.060 -9.691 1.00 0.00 O ATOM 741 OE2 GLU A 47 11.677 -7.752 -10.140 1.00 0.00 O ATOM 0 H GLU A 47 13.002 -3.993 -6.326 1.00 0.00 H new ATOM 0 HA GLU A 47 10.684 -5.729 -5.921 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.202 -5.728 -7.421 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.931 -7.272 -6.638 1.00 0.00 H new ATOM 0 HG2 GLU A 47 10.879 -7.645 -7.771 1.00 0.00 H new ATOM 0 HG3 GLU A 47 10.616 -5.939 -8.073 1.00 0.00 H new ATOM 748 N GLN A 48 13.435 -6.700 -4.373 1.00 0.00 N ATOM 749 CA GLN A 48 13.875 -7.335 -3.096 1.00 0.00 C ATOM 750 C GLN A 48 13.431 -6.481 -1.909 1.00 0.00 C ATOM 751 O GLN A 48 13.270 -6.967 -0.815 1.00 0.00 O ATOM 752 CB GLN A 48 15.396 -7.466 -3.063 1.00 0.00 C ATOM 753 CG GLN A 48 15.821 -8.657 -3.921 1.00 0.00 C ATOM 754 CD GLN A 48 17.348 -8.726 -3.980 1.00 0.00 C ATOM 755 OE1 GLN A 48 17.967 -8.078 -4.802 1.00 0.00 O ATOM 756 NE2 GLN A 48 17.987 -9.491 -3.138 1.00 0.00 N ATOM 0 H GLN A 48 14.152 -6.616 -5.093 1.00 0.00 H new ATOM 0 HA GLN A 48 13.423 -8.325 -3.033 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.859 -6.552 -3.435 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.738 -7.602 -2.037 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.421 -9.581 -3.503 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.412 -8.558 -4.927 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.468 -10.035 -2.448 1.00 0.00 H new ATOM 0 HE22 GLN A 48 19.005 -9.545 -3.170 1.00 0.00 H new ATOM 765 N ALA A 49 13.246 -5.210 -2.108 1.00 0.00 N ATOM 766 CA ALA A 49 12.827 -4.341 -0.974 1.00 0.00 C ATOM 767 C ALA A 49 11.363 -4.601 -0.635 1.00 0.00 C ATOM 768 O ALA A 49 11.041 -4.976 0.462 1.00 0.00 O ATOM 769 CB ALA A 49 13.004 -2.869 -1.348 1.00 0.00 C ATOM 0 H ALA A 49 13.366 -4.734 -3.002 1.00 0.00 H new ATOM 0 HA ALA A 49 13.448 -4.571 -0.109 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.695 -2.241 -0.512 1.00 0.00 H new ATOM 0 HB2 ALA A 49 14.052 -2.676 -1.579 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.392 -2.639 -2.220 1.00 0.00 H new ATOM 775 N VAL A 50 10.474 -4.397 -1.562 1.00 0.00 N ATOM 776 CA VAL A 50 9.025 -4.625 -1.276 1.00 0.00 C ATOM 777 C VAL A 50 8.756 -6.125 -1.117 1.00 0.00 C ATOM 778 O VAL A 50 8.135 -6.565 -0.174 1.00 0.00 O ATOM 779 CB VAL A 50 8.202 -4.045 -2.437 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.150 -5.030 -3.609 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.779 -3.755 -1.973 1.00 0.00 C ATOM 0 H VAL A 50 10.684 -4.082 -2.509 1.00 0.00 H new ATOM 0 HA VAL A 50 8.740 -4.130 -0.347 1.00 0.00 H new ATOM 0 HB VAL A 50 8.682 -3.123 -2.764 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.563 -4.600 -4.420 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.162 -5.231 -3.961 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.688 -5.961 -3.281 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.203 -3.344 -2.802 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.313 -4.679 -1.629 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.803 -3.035 -1.155 1.00 0.00 H new ATOM 791 N VAL A 51 9.231 -6.896 -2.039 1.00 0.00 N ATOM 792 CA VAL A 51 9.037 -8.370 -2.001 1.00 0.00 C ATOM 793 C VAL A 51 9.576 -8.948 -0.681 1.00 0.00 C ATOM 794 O VAL A 51 8.954 -9.790 -0.065 1.00 0.00 O ATOM 795 CB VAL A 51 9.786 -8.973 -3.193 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.260 -9.143 -2.843 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.192 -10.333 -3.550 1.00 0.00 C ATOM 0 H VAL A 51 9.762 -6.562 -2.843 1.00 0.00 H new ATOM 0 HA VAL A 51 7.976 -8.613 -2.060 1.00 0.00 H new ATOM 0 HB VAL A 51 9.688 -8.302 -4.046 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.789 -9.572 -3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.691 -8.172 -2.601 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.356 -9.807 -1.984 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.731 -10.754 -4.399 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.280 -11.004 -2.695 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.141 -10.214 -3.811 1.00 0.00 H new ATOM 807 N ARG A 52 10.724 -8.504 -0.240 1.00 0.00 N ATOM 808 CA ARG A 52 11.277 -9.035 1.036 1.00 0.00 C ATOM 809 C ARG A 52 10.484 -8.415 2.186 1.00 0.00 C ATOM 810 O ARG A 52 10.186 -9.061 3.170 1.00 0.00 O ATOM 811 CB ARG A 52 12.764 -8.685 1.145 1.00 0.00 C ATOM 812 CG ARG A 52 13.523 -9.365 0.002 1.00 0.00 C ATOM 813 CD ARG A 52 14.087 -10.702 0.484 1.00 0.00 C ATOM 814 NE ARG A 52 14.842 -11.349 -0.628 1.00 0.00 N ATOM 815 CZ ARG A 52 15.650 -12.345 -0.382 1.00 0.00 C ATOM 816 NH1 ARG A 52 15.872 -12.722 0.848 1.00 0.00 N ATOM 817 NH2 ARG A 52 16.240 -12.964 -1.368 1.00 0.00 N ATOM 0 H ARG A 52 11.298 -7.801 -0.706 1.00 0.00 H new ATOM 0 HA ARG A 52 11.189 -10.121 1.073 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.901 -7.605 1.097 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.158 -9.014 2.106 1.00 0.00 H new ATOM 0 HG2 ARG A 52 12.857 -9.524 -0.846 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.332 -8.721 -0.344 1.00 0.00 H new ATOM 0 HD2 ARG A 52 14.742 -10.545 1.341 1.00 0.00 H new ATOM 0 HD3 ARG A 52 13.278 -11.352 0.816 1.00 0.00 H new ATOM 0 HE ARG A 52 14.727 -11.012 -1.584 1.00 0.00 H new ATOM 0 HH11 ARG A 52 15.414 -12.238 1.620 1.00 0.00 H new ATOM 0 HH12 ARG A 52 16.504 -13.500 1.037 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.070 -12.670 -2.330 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.871 -13.742 -1.177 1.00 0.00 H new ATOM 831 N GLU A 53 10.088 -7.179 2.036 1.00 0.00 N ATOM 832 CA GLU A 53 9.255 -6.529 3.084 1.00 0.00 C ATOM 833 C GLU A 53 7.897 -7.222 3.077 1.00 0.00 C ATOM 834 O GLU A 53 7.110 -7.104 3.992 1.00 0.00 O ATOM 835 CB GLU A 53 9.065 -5.048 2.754 1.00 0.00 C ATOM 836 CG GLU A 53 10.419 -4.349 2.780 1.00 0.00 C ATOM 837 CD GLU A 53 10.608 -3.644 4.123 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.720 -3.747 4.951 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.638 -3.016 4.301 1.00 0.00 O ATOM 0 H GLU A 53 10.307 -6.592 1.231 1.00 0.00 H new ATOM 0 HA GLU A 53 9.735 -6.610 4.059 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.605 -4.938 1.772 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.391 -4.586 3.475 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.217 -5.075 2.624 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.482 -3.626 1.967 1.00 0.00 H new ATOM 846 N LEU A 54 7.632 -7.953 2.028 1.00 0.00 N ATOM 847 CA LEU A 54 6.348 -8.678 1.901 1.00 0.00 C ATOM 848 C LEU A 54 6.416 -9.954 2.746 1.00 0.00 C ATOM 849 O LEU A 54 5.674 -10.128 3.692 1.00 0.00 O ATOM 850 CB LEU A 54 6.150 -9.036 0.419 1.00 0.00 C ATOM 851 CG LEU A 54 5.070 -8.151 -0.213 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.827 -8.143 0.669 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.596 -6.720 -0.356 1.00 0.00 C ATOM 0 H LEU A 54 8.269 -8.077 1.241 1.00 0.00 H new ATOM 0 HA LEU A 54 5.516 -8.066 2.248 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.090 -8.911 -0.119 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.867 -10.085 0.328 1.00 0.00 H new ATOM 0 HG LEU A 54 4.815 -8.548 -1.196 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.063 -7.512 0.215 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.446 -9.159 0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.082 -7.752 1.654 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.826 -6.093 -0.806 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.855 -6.328 0.627 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.481 -6.720 -0.992 1.00 0.00 H new ATOM 865 N GLN A 55 7.310 -10.845 2.411 1.00 0.00 N ATOM 866 CA GLN A 55 7.439 -12.113 3.193 1.00 0.00 C ATOM 867 C GLN A 55 7.714 -11.790 4.665 1.00 0.00 C ATOM 868 O GLN A 55 7.030 -12.262 5.552 1.00 0.00 O ATOM 869 CB GLN A 55 8.602 -12.958 2.649 1.00 0.00 C ATOM 870 CG GLN A 55 9.658 -12.054 2.006 1.00 0.00 C ATOM 871 CD GLN A 55 11.056 -12.604 2.301 1.00 0.00 C ATOM 872 OE1 GLN A 55 12.022 -11.778 2.601 1.00 0.00 O flip ATOM 873 NE2 GLN A 55 11.274 -13.799 2.255 1.00 0.00 N flip ATOM 0 H GLN A 55 7.958 -10.751 1.629 1.00 0.00 H new ATOM 0 HA GLN A 55 6.507 -12.671 3.101 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.051 -13.535 3.457 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.229 -13.673 1.915 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.498 -12.000 0.929 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.567 -11.039 2.393 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.521 -14.446 2.021 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.210 -14.155 2.451 1.00 0.00 H new ATOM 882 N GLU A 56 8.722 -11.007 4.930 1.00 0.00 N ATOM 883 CA GLU A 56 9.061 -10.669 6.343 1.00 0.00 C ATOM 884 C GLU A 56 7.816 -10.191 7.093 1.00 0.00 C ATOM 885 O GLU A 56 7.762 -10.231 8.307 1.00 0.00 O ATOM 886 CB GLU A 56 10.124 -9.566 6.365 1.00 0.00 C ATOM 887 CG GLU A 56 9.633 -8.348 5.580 1.00 0.00 C ATOM 888 CD GLU A 56 8.930 -7.368 6.524 1.00 0.00 C ATOM 889 OE1 GLU A 56 8.595 -7.775 7.625 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.741 -6.224 6.130 1.00 0.00 O ATOM 0 H GLU A 56 9.329 -10.584 4.227 1.00 0.00 H new ATOM 0 HA GLU A 56 9.446 -11.563 6.834 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.343 -9.281 7.394 1.00 0.00 H new ATOM 0 HB3 GLU A 56 11.053 -9.937 5.933 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.474 -7.856 5.092 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.948 -8.664 4.793 1.00 0.00 H new ATOM 897 N GLU A 57 6.818 -9.733 6.390 1.00 0.00 N ATOM 898 CA GLU A 57 5.591 -9.249 7.080 1.00 0.00 C ATOM 899 C GLU A 57 4.711 -10.437 7.476 1.00 0.00 C ATOM 900 O GLU A 57 4.839 -10.990 8.551 1.00 0.00 O ATOM 901 CB GLU A 57 4.811 -8.314 6.149 1.00 0.00 C ATOM 902 CG GLU A 57 5.070 -6.867 6.565 1.00 0.00 C ATOM 903 CD GLU A 57 5.240 -5.987 5.325 1.00 0.00 C ATOM 904 OE1 GLU A 57 4.500 -6.186 4.375 1.00 0.00 O ATOM 905 OE2 GLU A 57 6.111 -5.129 5.346 1.00 0.00 O ATOM 0 H GLU A 57 6.799 -9.673 5.372 1.00 0.00 H new ATOM 0 HA GLU A 57 5.879 -8.705 7.980 1.00 0.00 H new ATOM 0 HB2 GLU A 57 5.119 -8.469 5.115 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.745 -8.535 6.200 1.00 0.00 H new ATOM 0 HG2 GLU A 57 4.241 -6.500 7.170 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.965 -6.813 7.185 1.00 0.00 H new ATOM 912 N VAL A 58 3.809 -10.819 6.619 1.00 0.00 N ATOM 913 CA VAL A 58 2.900 -11.951 6.932 1.00 0.00 C ATOM 914 C VAL A 58 3.613 -13.289 6.691 1.00 0.00 C ATOM 915 O VAL A 58 4.082 -13.915 7.620 1.00 0.00 O ATOM 916 CB VAL A 58 1.673 -11.810 6.040 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.650 -12.895 6.353 1.00 0.00 C ATOM 918 CG2 VAL A 58 1.060 -10.434 6.301 1.00 0.00 C ATOM 0 H VAL A 58 3.662 -10.390 5.705 1.00 0.00 H new ATOM 0 HA VAL A 58 2.602 -11.933 7.980 1.00 0.00 H new ATOM 0 HB VAL A 58 1.963 -11.914 4.994 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.218 -12.775 5.704 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.096 -13.875 6.185 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.339 -12.812 7.394 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.177 -10.304 5.675 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.775 -10.356 7.350 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.790 -9.660 6.064 1.00 0.00 H new ATOM 928 N GLY A 59 3.724 -13.736 5.464 1.00 0.00 N ATOM 929 CA GLY A 59 4.438 -15.028 5.231 1.00 0.00 C ATOM 930 C GLY A 59 3.856 -15.816 4.044 1.00 0.00 C ATOM 931 O GLY A 59 4.045 -17.013 3.952 1.00 0.00 O ATOM 0 H GLY A 59 3.360 -13.274 4.631 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.494 -14.828 5.048 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.381 -15.639 6.132 1.00 0.00 H new ATOM 935 N ILE A 60 3.175 -15.184 3.121 1.00 0.00 N ATOM 936 CA ILE A 60 2.640 -15.960 1.958 1.00 0.00 C ATOM 937 C ILE A 60 3.778 -16.144 0.943 1.00 0.00 C ATOM 938 O ILE A 60 4.894 -16.442 1.316 1.00 0.00 O ATOM 939 CB ILE A 60 1.456 -15.222 1.316 1.00 0.00 C ATOM 940 CG1 ILE A 60 1.883 -13.819 0.906 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.311 -15.124 2.322 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.483 -13.571 -0.550 1.00 0.00 C ATOM 0 H ILE A 60 2.969 -14.185 3.119 1.00 0.00 H new ATOM 0 HA ILE A 60 2.278 -16.932 2.292 1.00 0.00 H new ATOM 0 HB ILE A 60 1.127 -15.773 0.435 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.413 -13.080 1.555 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.961 -13.706 1.023 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.530 -14.600 1.867 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.002 -16.126 2.616 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.646 -14.576 3.202 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.788 -12.567 -0.845 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.974 -14.303 -1.192 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.402 -13.666 -0.652 1.00 0.00 H new ATOM 954 N THR A 61 3.529 -15.967 -0.329 1.00 0.00 N ATOM 955 CA THR A 61 4.636 -16.137 -1.314 1.00 0.00 C ATOM 956 C THR A 61 4.293 -15.401 -2.623 1.00 0.00 C ATOM 957 O THR A 61 4.922 -14.411 -2.941 1.00 0.00 O ATOM 958 CB THR A 61 4.886 -17.637 -1.551 1.00 0.00 C ATOM 959 OG1 THR A 61 5.786 -18.119 -0.564 1.00 0.00 O ATOM 960 CG2 THR A 61 5.492 -17.869 -2.940 1.00 0.00 C ATOM 0 H THR A 61 2.622 -15.716 -0.723 1.00 0.00 H new ATOM 0 HA THR A 61 5.554 -15.699 -0.921 1.00 0.00 H new ATOM 0 HB THR A 61 3.936 -18.168 -1.489 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.773 -17.519 0.211 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.662 -18.935 -3.089 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.806 -17.500 -3.703 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.440 -17.336 -3.017 1.00 0.00 H new ATOM 968 N PRO A 62 3.311 -15.888 -3.347 1.00 0.00 N ATOM 969 CA PRO A 62 2.897 -15.259 -4.610 1.00 0.00 C ATOM 970 C PRO A 62 2.383 -13.838 -4.365 1.00 0.00 C ATOM 971 O PRO A 62 2.444 -13.322 -3.269 1.00 0.00 O ATOM 972 CB PRO A 62 1.764 -16.143 -5.142 1.00 0.00 C ATOM 973 CG PRO A 62 1.422 -17.162 -4.033 1.00 0.00 C ATOM 974 CD PRO A 62 2.539 -17.084 -2.980 1.00 0.00 C ATOM 0 HA PRO A 62 3.727 -15.179 -5.312 1.00 0.00 H new ATOM 0 HB2 PRO A 62 0.891 -15.540 -5.393 1.00 0.00 H new ATOM 0 HB3 PRO A 62 2.071 -16.655 -6.054 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.455 -16.932 -3.585 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.352 -18.169 -4.445 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.130 -16.998 -1.973 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.162 -17.978 -2.996 1.00 0.00 H new ATOM 982 N GLN A 63 1.871 -13.233 -5.400 1.00 0.00 N ATOM 983 CA GLN A 63 1.324 -11.847 -5.344 1.00 0.00 C ATOM 984 C GLN A 63 1.636 -11.189 -6.686 1.00 0.00 C ATOM 985 O GLN A 63 0.970 -10.274 -7.118 1.00 0.00 O ATOM 986 CB GLN A 63 1.964 -11.021 -4.219 1.00 0.00 C ATOM 987 CG GLN A 63 3.493 -11.072 -4.325 1.00 0.00 C ATOM 988 CD GLN A 63 4.111 -9.798 -3.725 1.00 0.00 C ATOM 989 OE1 GLN A 63 3.359 -8.925 -3.106 1.00 0.00 O flip ATOM 990 NE2 GLN A 63 5.307 -9.599 -3.809 1.00 0.00 N flip ATOM 0 H GLN A 63 1.807 -13.662 -6.323 1.00 0.00 H new ATOM 0 HA GLN A 63 0.253 -11.890 -5.145 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.623 -9.987 -4.278 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.647 -11.406 -3.250 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.872 -11.950 -3.801 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.789 -11.171 -5.369 1.00 0.00 H new ATOM 0 HE21 GLN A 63 5.904 -10.273 -4.289 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.714 -8.758 -3.399 1.00 0.00 H new ATOM 999 N HIS A 64 2.653 -11.666 -7.350 1.00 0.00 N ATOM 1000 CA HIS A 64 3.028 -11.089 -8.671 1.00 0.00 C ATOM 1001 C HIS A 64 2.957 -9.568 -8.583 1.00 0.00 C ATOM 1002 O HIS A 64 2.365 -8.907 -9.412 1.00 0.00 O ATOM 1003 CB HIS A 64 2.064 -11.601 -9.738 1.00 0.00 C ATOM 1004 CG HIS A 64 2.830 -11.946 -10.984 1.00 0.00 C ATOM 1005 ND1 HIS A 64 2.414 -11.540 -12.242 1.00 0.00 N ATOM 1006 CD2 HIS A 64 3.984 -12.663 -11.184 1.00 0.00 C ATOM 1007 CE1 HIS A 64 3.304 -12.010 -13.135 1.00 0.00 C ATOM 1008 NE2 HIS A 64 4.281 -12.702 -12.543 1.00 0.00 N ATOM 0 H HIS A 64 3.243 -12.435 -7.032 1.00 0.00 H new ATOM 0 HA HIS A 64 4.041 -11.388 -8.939 1.00 0.00 H new ATOM 0 HB2 HIS A 64 1.532 -12.479 -9.371 1.00 0.00 H new ATOM 0 HB3 HIS A 64 1.313 -10.842 -9.959 1.00 0.00 H new ATOM 0 HD2 HIS A 64 4.572 -13.126 -10.405 1.00 0.00 H new ATOM 0 HE1 HIS A 64 3.237 -11.847 -14.201 1.00 0.00 H new ATOM 0 HE2 HIS A 64 5.074 -13.161 -12.991 1.00 0.00 H new ATOM 1016 N PHE A 65 3.556 -9.017 -7.568 1.00 0.00 N ATOM 1017 CA PHE A 65 3.540 -7.542 -7.385 1.00 0.00 C ATOM 1018 C PHE A 65 3.783 -6.832 -8.718 1.00 0.00 C ATOM 1019 O PHE A 65 4.309 -7.397 -9.657 1.00 0.00 O ATOM 1020 CB PHE A 65 4.647 -7.154 -6.408 1.00 0.00 C ATOM 1021 CG PHE A 65 5.965 -7.686 -6.924 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.701 -6.944 -7.854 1.00 0.00 C ATOM 1023 CD2 PHE A 65 6.448 -8.922 -6.479 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.918 -7.437 -8.339 1.00 0.00 C ATOM 1025 CE2 PHE A 65 7.664 -9.415 -6.963 1.00 0.00 C ATOM 1026 CZ PHE A 65 8.400 -8.674 -7.893 1.00 0.00 C ATOM 0 H PHE A 65 4.062 -9.533 -6.848 1.00 0.00 H new ATOM 0 HA PHE A 65 2.565 -7.244 -6.999 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.694 -6.070 -6.302 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.437 -7.562 -5.419 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.330 -5.990 -8.198 1.00 0.00 H new ATOM 0 HD2 PHE A 65 5.881 -9.496 -5.761 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.485 -6.863 -9.057 1.00 0.00 H new ATOM 0 HE2 PHE A 65 8.035 -10.369 -6.618 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.339 -9.055 -8.267 1.00 0.00 H new ATOM 1036 N SER A 66 3.413 -5.585 -8.789 1.00 0.00 N ATOM 1037 CA SER A 66 3.620 -4.794 -10.034 1.00 0.00 C ATOM 1038 C SER A 66 3.644 -3.315 -9.652 1.00 0.00 C ATOM 1039 O SER A 66 2.858 -2.871 -8.850 1.00 0.00 O ATOM 1040 CB SER A 66 2.471 -5.053 -11.008 1.00 0.00 C ATOM 1041 OG SER A 66 2.946 -5.830 -12.100 1.00 0.00 O ATOM 0 H SER A 66 2.970 -5.073 -8.027 1.00 0.00 H new ATOM 0 HA SER A 66 4.556 -5.080 -10.514 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.660 -5.576 -10.501 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.065 -4.108 -11.369 1.00 0.00 H new ATOM 0 HG SER A 66 2.211 -5.999 -12.725 1.00 0.00 H new ATOM 1047 N LEU A 67 4.545 -2.551 -10.195 1.00 0.00 N ATOM 1048 CA LEU A 67 4.609 -1.107 -9.822 1.00 0.00 C ATOM 1049 C LEU A 67 3.286 -0.412 -10.157 1.00 0.00 C ATOM 1050 O LEU A 67 2.537 -0.044 -9.289 1.00 0.00 O ATOM 1051 CB LEU A 67 5.741 -0.419 -10.588 1.00 0.00 C ATOM 1052 CG LEU A 67 6.267 0.775 -9.786 1.00 0.00 C ATOM 1053 CD1 LEU A 67 6.958 1.747 -10.737 1.00 0.00 C ATOM 1054 CD2 LEU A 67 5.110 1.498 -9.088 1.00 0.00 C ATOM 0 H LEU A 67 5.238 -2.858 -10.878 1.00 0.00 H new ATOM 0 HA LEU A 67 4.794 -1.036 -8.750 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.549 -1.127 -10.773 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.382 -0.084 -11.561 1.00 0.00 H new ATOM 0 HG LEU A 67 6.969 0.417 -9.033 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.336 2.600 -10.174 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.788 1.243 -11.232 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.245 2.093 -11.485 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.499 2.344 -8.522 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.401 1.856 -9.835 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.606 0.809 -8.410 1.00 0.00 H new ATOM 1066 N PHE A 68 3.028 -0.213 -11.413 1.00 0.00 N ATOM 1067 CA PHE A 68 1.784 0.472 -11.866 1.00 0.00 C ATOM 1068 C PHE A 68 2.030 1.986 -11.830 1.00 0.00 C ATOM 1069 O PHE A 68 1.911 2.656 -12.833 1.00 0.00 O ATOM 1070 CB PHE A 68 0.582 0.048 -10.987 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.117 1.253 -10.394 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -1.162 1.862 -11.097 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.282 1.761 -9.152 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -1.809 2.978 -10.559 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.366 2.879 -8.615 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.412 3.487 -9.319 1.00 0.00 C ATOM 0 H PHE A 68 3.645 -0.505 -12.171 1.00 0.00 H new ATOM 0 HA PHE A 68 1.535 0.183 -12.887 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.124 -0.527 -11.586 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.927 -0.606 -10.186 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.469 1.470 -12.055 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.089 1.291 -8.609 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.616 3.447 -11.102 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.059 3.273 -7.657 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.912 4.349 -8.904 1.00 0.00 H new ATOM 1086 N GLU A 69 2.406 2.511 -10.692 1.00 0.00 N ATOM 1087 CA GLU A 69 2.697 3.979 -10.584 1.00 0.00 C ATOM 1088 C GLU A 69 2.769 4.383 -9.117 1.00 0.00 C ATOM 1089 O GLU A 69 1.842 4.190 -8.358 1.00 0.00 O ATOM 1090 CB GLU A 69 1.607 4.817 -11.268 1.00 0.00 C ATOM 1091 CG GLU A 69 2.029 6.287 -11.263 1.00 0.00 C ATOM 1092 CD GLU A 69 3.253 6.467 -12.164 1.00 0.00 C ATOM 1093 OE1 GLU A 69 3.287 5.843 -13.213 1.00 0.00 O ATOM 1094 OE2 GLU A 69 4.135 7.222 -11.790 1.00 0.00 O ATOM 0 H GLU A 69 2.526 1.985 -9.826 1.00 0.00 H new ATOM 0 HA GLU A 69 3.650 4.165 -11.080 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.455 4.473 -12.291 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.657 4.697 -10.747 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.209 6.913 -11.615 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.261 6.607 -10.247 1.00 0.00 H new ATOM 1101 N LYS A 70 3.870 4.953 -8.721 1.00 0.00 N ATOM 1102 CA LYS A 70 4.029 5.380 -7.307 1.00 0.00 C ATOM 1103 C LYS A 70 4.022 6.908 -7.228 1.00 0.00 C ATOM 1104 O LYS A 70 4.078 7.590 -8.234 1.00 0.00 O ATOM 1105 CB LYS A 70 5.361 4.854 -6.785 1.00 0.00 C ATOM 1106 CG LYS A 70 6.498 5.405 -7.646 1.00 0.00 C ATOM 1107 CD LYS A 70 7.839 5.129 -6.960 1.00 0.00 C ATOM 1108 CE LYS A 70 8.166 6.275 -6.001 1.00 0.00 C ATOM 1109 NZ LYS A 70 9.627 6.569 -6.057 1.00 0.00 N ATOM 0 H LYS A 70 4.672 5.143 -9.321 1.00 0.00 H new ATOM 0 HA LYS A 70 3.209 4.986 -6.707 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.500 5.152 -5.746 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.368 3.764 -6.808 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.480 4.941 -8.632 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.368 6.477 -7.796 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.794 4.186 -6.415 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.627 5.028 -7.706 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.595 7.163 -6.271 1.00 0.00 H new ATOM 0 HE3 LYS A 70 7.877 6.007 -4.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.813 7.491 -5.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.150 5.828 -5.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.939 6.592 -7.049 1.00 0.00 H new ATOM 1123 N LEU A 71 3.962 7.456 -6.044 1.00 0.00 N ATOM 1124 CA LEU A 71 3.959 8.939 -5.916 1.00 0.00 C ATOM 1125 C LEU A 71 5.121 9.393 -5.036 1.00 0.00 C ATOM 1126 O LEU A 71 5.768 8.603 -4.378 1.00 0.00 O ATOM 1127 CB LEU A 71 2.636 9.420 -5.294 1.00 0.00 C ATOM 1128 CG LEU A 71 2.281 8.606 -4.034 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.427 8.643 -3.016 1.00 0.00 C ATOM 1130 CD2 LEU A 71 1.033 9.212 -3.389 1.00 0.00 C ATOM 0 H LEU A 71 3.915 6.942 -5.164 1.00 0.00 H new ATOM 0 HA LEU A 71 4.066 9.369 -6.912 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.715 10.476 -5.037 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.833 9.330 -6.026 1.00 0.00 H new ATOM 0 HG LEU A 71 2.104 7.571 -4.327 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.151 8.061 -2.136 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.326 8.219 -3.464 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.620 9.675 -2.723 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.772 8.644 -2.496 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.232 10.248 -3.115 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.204 9.177 -4.096 1.00 0.00 H new ATOM 1142 N GLU A 72 5.365 10.670 -5.002 1.00 0.00 N ATOM 1143 CA GLU A 72 6.456 11.208 -4.147 1.00 0.00 C ATOM 1144 C GLU A 72 6.024 12.587 -3.659 1.00 0.00 C ATOM 1145 O GLU A 72 6.332 13.599 -4.257 1.00 0.00 O ATOM 1146 CB GLU A 72 7.755 11.316 -4.950 1.00 0.00 C ATOM 1147 CG GLU A 72 8.947 11.063 -4.023 1.00 0.00 C ATOM 1148 CD GLU A 72 10.248 11.227 -4.811 1.00 0.00 C ATOM 1149 OE1 GLU A 72 10.187 11.197 -6.029 1.00 0.00 O ATOM 1150 OE2 GLU A 72 11.284 11.378 -4.183 1.00 0.00 O ATOM 0 H GLU A 72 4.851 11.371 -5.535 1.00 0.00 H new ATOM 0 HA GLU A 72 6.639 10.544 -3.302 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.753 10.592 -5.765 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.835 12.304 -5.402 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.925 11.761 -3.186 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.888 10.059 -3.602 1.00 0.00 H new ATOM 1157 N TYR A 73 5.292 12.630 -2.582 1.00 0.00 N ATOM 1158 CA TYR A 73 4.815 13.933 -2.057 1.00 0.00 C ATOM 1159 C TYR A 73 5.932 14.578 -1.255 1.00 0.00 C ATOM 1160 O TYR A 73 6.457 14.000 -0.322 1.00 0.00 O ATOM 1161 CB TYR A 73 3.594 13.706 -1.162 1.00 0.00 C ATOM 1162 CG TYR A 73 2.494 14.656 -1.569 1.00 0.00 C ATOM 1163 CD1 TYR A 73 2.628 16.026 -1.320 1.00 0.00 C ATOM 1164 CD2 TYR A 73 1.341 14.168 -2.196 1.00 0.00 C ATOM 1165 CE1 TYR A 73 1.611 16.910 -1.698 1.00 0.00 C ATOM 1166 CE2 TYR A 73 0.322 15.052 -2.574 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.458 16.423 -2.325 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.543 17.297 -2.698 1.00 0.00 O ATOM 0 H TYR A 73 5.004 11.814 -2.042 1.00 0.00 H new ATOM 0 HA TYR A 73 4.533 14.587 -2.882 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.251 12.675 -1.250 1.00 0.00 H new ATOM 0 HB3 TYR A 73 3.860 13.866 -0.117 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.517 16.402 -0.836 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.237 13.110 -2.388 1.00 0.00 H new ATOM 0 HE1 TYR A 73 1.716 17.968 -1.506 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -0.568 14.676 -3.057 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.272 16.798 -3.121 1.00 0.00 H new ATOM 1178 N GLU A 74 6.310 15.769 -1.608 1.00 0.00 N ATOM 1179 CA GLU A 74 7.400 16.433 -0.861 1.00 0.00 C ATOM 1180 C GLU A 74 6.795 17.268 0.264 1.00 0.00 C ATOM 1181 O GLU A 74 6.179 18.288 0.032 1.00 0.00 O ATOM 1182 CB GLU A 74 8.203 17.330 -1.804 1.00 0.00 C ATOM 1183 CG GLU A 74 9.667 16.889 -1.797 1.00 0.00 C ATOM 1184 CD GLU A 74 10.484 17.815 -2.701 1.00 0.00 C ATOM 1185 OE1 GLU A 74 10.919 18.848 -2.219 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.661 17.474 -3.858 1.00 0.00 O ATOM 0 H GLU A 74 5.913 16.308 -2.378 1.00 0.00 H new ATOM 0 HA GLU A 74 8.068 15.682 -0.439 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.798 17.270 -2.814 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.123 18.371 -1.490 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.061 16.915 -0.781 1.00 0.00 H new ATOM 0 HG3 GLU A 74 9.749 15.859 -2.144 1.00 0.00 H new ATOM 1193 N PHE A 75 6.957 16.836 1.480 1.00 0.00 N ATOM 1194 CA PHE A 75 6.382 17.594 2.621 1.00 0.00 C ATOM 1195 C PHE A 75 7.272 18.799 2.933 1.00 0.00 C ATOM 1196 O PHE A 75 8.363 18.910 2.410 1.00 0.00 O ATOM 1197 CB PHE A 75 6.321 16.675 3.841 1.00 0.00 C ATOM 1198 CG PHE A 75 4.917 16.152 4.012 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.281 15.500 2.950 1.00 0.00 C ATOM 1200 CD2 PHE A 75 4.249 16.318 5.231 1.00 0.00 C ATOM 1201 CE1 PHE A 75 2.978 15.014 3.106 1.00 0.00 C ATOM 1202 CE2 PHE A 75 2.946 15.831 5.388 1.00 0.00 C ATOM 1203 CZ PHE A 75 2.310 15.180 4.325 1.00 0.00 C ATOM 0 H PHE A 75 7.464 15.988 1.734 1.00 0.00 H new ATOM 0 HA PHE A 75 5.381 17.943 2.369 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.017 15.845 3.718 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.628 17.219 4.734 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.796 15.372 2.009 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.739 16.822 6.051 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.488 14.511 2.286 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.432 15.958 6.329 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.304 14.806 4.445 1.00 0.00 H new ATOM 1213 N PRO A 76 6.782 19.663 3.786 1.00 0.00 N ATOM 1214 CA PRO A 76 7.523 20.870 4.191 1.00 0.00 C ATOM 1215 C PRO A 76 8.945 20.488 4.604 1.00 0.00 C ATOM 1216 O PRO A 76 9.899 21.186 4.325 1.00 0.00 O ATOM 1217 CB PRO A 76 6.734 21.420 5.386 1.00 0.00 C ATOM 1218 CG PRO A 76 5.416 20.611 5.490 1.00 0.00 C ATOM 1219 CD PRO A 76 5.461 19.508 4.424 1.00 0.00 C ATOM 0 HA PRO A 76 7.613 21.605 3.391 1.00 0.00 H new ATOM 0 HB2 PRO A 76 7.314 21.326 6.304 1.00 0.00 H new ATOM 0 HB3 PRO A 76 6.523 22.481 5.250 1.00 0.00 H new ATOM 0 HG2 PRO A 76 5.311 20.178 6.485 1.00 0.00 H new ATOM 0 HG3 PRO A 76 4.555 21.261 5.332 1.00 0.00 H new ATOM 0 HD2 PRO A 76 5.350 18.520 4.871 1.00 0.00 H new ATOM 0 HD3 PRO A 76 4.655 19.623 3.700 1.00 0.00 H new ATOM 1227 N ASP A 77 9.082 19.375 5.259 1.00 0.00 N ATOM 1228 CA ASP A 77 10.425 18.908 5.694 1.00 0.00 C ATOM 1229 C ASP A 77 10.361 17.398 5.859 1.00 0.00 C ATOM 1230 O ASP A 77 10.851 16.838 6.819 1.00 0.00 O ATOM 1231 CB ASP A 77 10.792 19.561 7.029 1.00 0.00 C ATOM 1232 CG ASP A 77 12.178 20.202 6.924 1.00 0.00 C ATOM 1233 OD1 ASP A 77 12.695 20.275 5.822 1.00 0.00 O ATOM 1234 OD2 ASP A 77 12.698 20.609 7.950 1.00 0.00 O ATOM 0 H ASP A 77 8.311 18.759 5.516 1.00 0.00 H new ATOM 0 HA ASP A 77 11.181 19.179 4.957 1.00 0.00 H new ATOM 0 HB2 ASP A 77 10.051 20.315 7.292 1.00 0.00 H new ATOM 0 HB3 ASP A 77 10.784 18.815 7.824 1.00 0.00 H new ATOM 1239 N ARG A 78 9.738 16.739 4.924 1.00 0.00 N ATOM 1240 CA ARG A 78 9.607 15.266 5.009 1.00 0.00 C ATOM 1241 C ARG A 78 9.604 14.678 3.595 1.00 0.00 C ATOM 1242 O ARG A 78 8.591 14.649 2.927 1.00 0.00 O ATOM 1243 CB ARG A 78 8.290 14.929 5.713 1.00 0.00 C ATOM 1244 CG ARG A 78 8.553 14.657 7.198 1.00 0.00 C ATOM 1245 CD ARG A 78 9.469 13.439 7.344 1.00 0.00 C ATOM 1246 NE ARG A 78 9.020 12.612 8.502 1.00 0.00 N ATOM 1247 CZ ARG A 78 8.545 13.184 9.575 1.00 0.00 C ATOM 1248 NH1 ARG A 78 7.276 13.481 9.645 1.00 0.00 N ATOM 1249 NH2 ARG A 78 9.337 13.462 10.575 1.00 0.00 N ATOM 0 H ARG A 78 9.312 17.164 4.100 1.00 0.00 H new ATOM 0 HA ARG A 78 10.441 14.845 5.570 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.586 15.754 5.604 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.832 14.056 5.249 1.00 0.00 H new ATOM 0 HG2 ARG A 78 9.014 15.529 7.661 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.611 14.481 7.718 1.00 0.00 H new ATOM 0 HD2 ARG A 78 9.449 12.845 6.430 1.00 0.00 H new ATOM 0 HD3 ARG A 78 10.499 13.762 7.492 1.00 0.00 H new ATOM 0 HE ARG A 78 9.085 11.595 8.455 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.658 13.266 8.862 1.00 0.00 H new ATOM 0 HH12 ARG A 78 6.902 13.928 10.482 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.329 13.232 10.519 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.964 13.909 11.412 1.00 0.00 H new ATOM 1263 N HIS A 79 10.732 14.208 3.137 1.00 0.00 N ATOM 1264 CA HIS A 79 10.788 13.615 1.769 1.00 0.00 C ATOM 1265 C HIS A 79 10.242 12.187 1.837 1.00 0.00 C ATOM 1266 O HIS A 79 10.953 11.256 2.162 1.00 0.00 O ATOM 1267 CB HIS A 79 12.238 13.589 1.278 1.00 0.00 C ATOM 1268 CG HIS A 79 12.393 14.533 0.116 1.00 0.00 C ATOM 1269 ND1 HIS A 79 13.412 15.473 0.056 1.00 0.00 N ATOM 1270 CD2 HIS A 79 11.667 14.695 -1.040 1.00 0.00 C ATOM 1271 CE1 HIS A 79 13.271 16.151 -1.098 1.00 0.00 C ATOM 1272 NE2 HIS A 79 12.224 15.716 -1.804 1.00 0.00 N ATOM 0 H HIS A 79 11.615 14.208 3.648 1.00 0.00 H new ATOM 0 HA HIS A 79 10.192 14.211 1.078 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.911 13.876 2.086 1.00 0.00 H new ATOM 0 HB3 HIS A 79 12.513 12.578 0.978 1.00 0.00 H new ATOM 0 HD1 HIS A 79 14.136 15.623 0.759 1.00 0.00 H new ATOM 0 HD2 HIS A 79 10.796 14.117 -1.314 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.925 16.950 -1.415 1.00 0.00 H new ATOM 1280 N ILE A 80 8.981 12.007 1.552 1.00 0.00 N ATOM 1281 CA ILE A 80 8.387 10.640 1.625 1.00 0.00 C ATOM 1282 C ILE A 80 8.240 10.042 0.223 1.00 0.00 C ATOM 1283 O ILE A 80 8.284 10.730 -0.778 1.00 0.00 O ATOM 1284 CB ILE A 80 6.991 10.719 2.269 1.00 0.00 C ATOM 1285 CG1 ILE A 80 7.089 10.972 3.785 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.254 9.398 2.043 1.00 0.00 C ATOM 1287 CD1 ILE A 80 8.346 11.775 4.124 1.00 0.00 C ATOM 0 H ILE A 80 8.336 12.746 1.272 1.00 0.00 H new ATOM 0 HA ILE A 80 9.047 10.010 2.221 1.00 0.00 H new ATOM 0 HB ILE A 80 6.452 11.547 1.808 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.205 11.511 4.126 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.106 10.020 4.316 1.00 0.00 H new ATOM 0 HG21 ILE A 80 5.265 9.451 2.498 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.152 9.217 0.973 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.819 8.584 2.497 1.00 0.00 H new ATOM 0 HD11 ILE A 80 8.393 11.941 5.200 1.00 0.00 H new ATOM 0 HD12 ILE A 80 9.229 11.222 3.804 1.00 0.00 H new ATOM 0 HD13 ILE A 80 8.314 12.736 3.610 1.00 0.00 H new ATOM 1299 N THR A 81 8.032 8.755 0.168 1.00 0.00 N ATOM 1300 CA THR A 81 7.836 8.060 -1.130 1.00 0.00 C ATOM 1301 C THR A 81 6.889 6.886 -0.886 1.00 0.00 C ATOM 1302 O THR A 81 6.832 6.353 0.203 1.00 0.00 O ATOM 1303 CB THR A 81 9.174 7.534 -1.637 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.207 8.429 -1.247 1.00 0.00 O ATOM 1305 CG2 THR A 81 9.140 7.424 -3.161 1.00 0.00 C ATOM 0 H THR A 81 7.989 8.147 0.986 1.00 0.00 H new ATOM 0 HA THR A 81 7.423 8.743 -1.872 1.00 0.00 H new ATOM 0 HB THR A 81 9.363 6.549 -1.211 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.964 8.344 -1.864 1.00 0.00 H new ATOM 0 HG21 THR A 81 10.098 7.048 -3.520 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.346 6.739 -3.459 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.951 8.407 -3.593 1.00 0.00 H new ATOM 1313 N LEU A 82 6.135 6.478 -1.866 1.00 0.00 N ATOM 1314 CA LEU A 82 5.202 5.339 -1.629 1.00 0.00 C ATOM 1315 C LEU A 82 5.123 4.440 -2.863 1.00 0.00 C ATOM 1316 O LEU A 82 4.184 4.509 -3.631 1.00 0.00 O ATOM 1317 CB LEU A 82 3.809 5.882 -1.310 1.00 0.00 C ATOM 1318 CG LEU A 82 3.246 5.150 -0.091 1.00 0.00 C ATOM 1319 CD1 LEU A 82 3.371 6.045 1.142 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.771 4.822 -0.332 1.00 0.00 C ATOM 0 H LEU A 82 6.121 6.874 -2.806 1.00 0.00 H new ATOM 0 HA LEU A 82 5.575 4.751 -0.790 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.860 6.953 -1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.149 5.746 -2.167 1.00 0.00 H new ATOM 0 HG LEU A 82 3.804 4.228 0.070 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.970 5.524 2.012 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.421 6.283 1.314 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.812 6.966 0.981 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.368 4.300 0.536 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.214 5.745 -0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.679 4.186 -1.213 1.00 0.00 H new ATOM 1332 N TRP A 83 6.090 3.582 -3.056 1.00 0.00 N ATOM 1333 CA TRP A 83 6.039 2.673 -4.238 1.00 0.00 C ATOM 1334 C TRP A 83 4.706 1.920 -4.240 1.00 0.00 C ATOM 1335 O TRP A 83 4.455 1.082 -3.397 1.00 0.00 O ATOM 1336 CB TRP A 83 7.184 1.664 -4.161 1.00 0.00 C ATOM 1337 CG TRP A 83 8.483 2.383 -4.290 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.157 2.950 -3.266 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.274 2.622 -5.489 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.314 3.528 -3.760 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.430 3.351 -5.127 1.00 0.00 C ATOM 1342 CE3 TRP A 83 9.100 2.282 -6.843 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.382 3.727 -6.074 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 10.056 2.659 -7.799 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.195 3.381 -7.416 1.00 0.00 C ATOM 0 H TRP A 83 6.905 3.472 -2.453 1.00 0.00 H new ATOM 0 HA TRP A 83 6.134 3.262 -5.150 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.146 1.125 -3.214 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.085 0.923 -4.954 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.845 2.952 -2.232 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.997 4.023 -3.187 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.225 1.727 -7.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.258 4.282 -5.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 9.913 2.391 -8.836 1.00 0.00 H new ATOM 0 HH2 TRP A 83 11.927 3.670 -8.156 1.00 0.00 H new ATOM 1356 N PHE A 84 3.848 2.210 -5.181 1.00 0.00 N ATOM 1357 CA PHE A 84 2.531 1.509 -5.235 1.00 0.00 C ATOM 1358 C PHE A 84 2.674 0.215 -6.029 1.00 0.00 C ATOM 1359 O PHE A 84 2.165 0.101 -7.117 1.00 0.00 O ATOM 1360 CB PHE A 84 1.508 2.395 -5.944 1.00 0.00 C ATOM 1361 CG PHE A 84 0.774 3.235 -4.924 1.00 0.00 C ATOM 1362 CD1 PHE A 84 1.374 4.382 -4.388 1.00 0.00 C ATOM 1363 CD2 PHE A 84 -0.515 2.865 -4.517 1.00 0.00 C ATOM 1364 CE1 PHE A 84 0.685 5.156 -3.444 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -1.202 3.639 -3.575 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.603 4.783 -3.038 1.00 0.00 C ATOM 0 H PHE A 84 4.001 2.902 -5.915 1.00 0.00 H new ATOM 0 HA PHE A 84 2.203 1.294 -4.218 1.00 0.00 H new ATOM 0 HB2 PHE A 84 2.008 3.038 -6.668 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.801 1.779 -6.500 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.367 4.670 -4.702 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.979 1.982 -4.931 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.147 6.040 -3.030 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.195 3.353 -3.263 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.133 5.379 -2.310 1.00 0.00 H new ATOM 1376 N TRP A 85 3.333 -0.769 -5.493 1.00 0.00 N ATOM 1377 CA TRP A 85 3.472 -2.048 -6.243 1.00 0.00 C ATOM 1378 C TRP A 85 2.148 -2.820 -6.191 1.00 0.00 C ATOM 1379 O TRP A 85 1.938 -3.655 -5.333 1.00 0.00 O ATOM 1380 CB TRP A 85 4.584 -2.886 -5.612 1.00 0.00 C ATOM 1381 CG TRP A 85 5.909 -2.407 -6.112 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.699 -1.507 -5.482 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.611 -2.782 -7.332 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.841 -1.308 -6.236 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.835 -2.073 -7.385 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.311 -3.663 -8.387 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.727 -2.231 -8.447 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.205 -3.823 -9.457 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.412 -3.110 -9.486 1.00 0.00 C ATOM 0 H TRP A 85 3.779 -0.747 -4.576 1.00 0.00 H new ATOM 0 HA TRP A 85 3.723 -1.837 -7.283 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.542 -2.807 -4.526 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.448 -3.938 -5.861 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.474 -1.023 -4.543 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.596 -0.673 -5.975 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.386 -4.220 -8.373 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.654 -1.678 -8.465 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 6.962 -4.499 -10.263 1.00 0.00 H new ATOM 0 HH2 TRP A 85 9.097 -3.240 -10.311 1.00 0.00 H new ATOM 1400 N LEU A 86 1.244 -2.553 -7.095 1.00 0.00 N ATOM 1401 CA LEU A 86 -0.052 -3.285 -7.067 1.00 0.00 C ATOM 1402 C LEU A 86 0.179 -4.756 -7.414 1.00 0.00 C ATOM 1403 O LEU A 86 0.819 -5.084 -8.394 1.00 0.00 O ATOM 1404 CB LEU A 86 -1.020 -2.682 -8.090 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.844 -1.560 -7.451 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.375 -2.001 -6.085 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.964 -0.320 -7.286 1.00 0.00 C ATOM 0 H LEU A 86 1.346 -1.867 -7.843 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.479 -3.201 -6.067 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.462 -2.292 -8.942 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.684 -3.457 -8.472 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.691 -1.328 -8.096 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.958 -1.193 -5.643 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.007 -2.881 -6.207 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.538 -2.244 -5.430 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.546 0.482 -6.831 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.115 -0.559 -6.646 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.603 0.003 -8.263 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.352 -5.643 -6.620 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.187 -7.100 -6.901 1.00 0.00 C ATOM 1421 C VAL A 87 -1.559 -7.663 -7.301 1.00 0.00 C ATOM 1422 O VAL A 87 -2.533 -6.937 -7.346 1.00 0.00 O ATOM 1423 CB VAL A 87 0.379 -7.814 -5.650 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.095 -6.799 -4.751 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.740 -8.488 -4.847 1.00 0.00 C ATOM 0 H VAL A 87 -0.895 -5.423 -5.785 1.00 0.00 H new ATOM 0 HA VAL A 87 0.519 -7.264 -7.715 1.00 0.00 H new ATOM 0 HB VAL A 87 1.081 -8.577 -5.987 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.491 -7.307 -3.872 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.914 -6.338 -5.303 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.390 -6.029 -4.438 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.314 -8.982 -3.974 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.460 -7.736 -4.524 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.243 -9.226 -5.472 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.665 -8.933 -7.608 1.00 0.00 N ATOM 1436 CA GLU A 88 -3.005 -9.455 -8.008 1.00 0.00 C ATOM 1437 C GLU A 88 -3.103 -10.986 -7.886 1.00 0.00 C ATOM 1438 O GLU A 88 -3.995 -11.586 -8.453 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.274 -9.052 -9.457 1.00 0.00 C ATOM 1440 CG GLU A 88 -4.011 -7.712 -9.488 1.00 0.00 C ATOM 1441 CD GLU A 88 -5.201 -7.812 -10.442 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -5.620 -8.923 -10.721 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -5.674 -6.776 -10.879 1.00 0.00 O ATOM 0 H GLU A 88 -0.904 -9.613 -7.600 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.745 -9.026 -7.332 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.334 -8.975 -10.004 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -3.870 -9.818 -9.954 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.354 -7.449 -8.487 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.336 -6.920 -9.812 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.232 -11.639 -7.162 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.365 -13.128 -7.055 1.00 0.00 C ATOM 1452 C ARG A 89 -1.609 -13.663 -5.839 1.00 0.00 C ATOM 1453 O ARG A 89 -0.850 -14.600 -5.937 1.00 0.00 O ATOM 1454 CB ARG A 89 -1.833 -13.795 -8.328 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.303 -13.802 -8.322 1.00 0.00 C ATOM 1456 CD ARG A 89 0.208 -15.233 -8.136 1.00 0.00 C ATOM 1457 NE ARG A 89 0.504 -15.831 -9.470 1.00 0.00 N ATOM 1458 CZ ARG A 89 1.202 -16.932 -9.552 1.00 0.00 C ATOM 1459 NH1 ARG A 89 1.484 -17.609 -8.472 1.00 0.00 N ATOM 1460 NH2 ARG A 89 1.618 -17.355 -10.713 1.00 0.00 N ATOM 0 H ARG A 89 -1.453 -11.223 -6.652 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.422 -13.365 -6.934 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.208 -14.816 -8.396 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.198 -13.262 -9.206 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.075 -13.390 -9.257 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.070 -13.166 -7.519 1.00 0.00 H new ATOM 0 HD2 ARG A 89 1.106 -15.233 -7.518 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.538 -15.832 -7.614 1.00 0.00 H new ATOM 0 HE ARG A 89 0.161 -15.380 -10.318 1.00 0.00 H new ATOM 0 HH11 ARG A 89 1.159 -17.278 -7.563 1.00 0.00 H new ATOM 0 HH12 ARG A 89 2.029 -18.469 -8.537 1.00 0.00 H new ATOM 0 HH21 ARG A 89 1.398 -16.826 -11.557 1.00 0.00 H new ATOM 0 HH22 ARG A 89 2.163 -18.215 -10.777 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.824 -13.102 -4.688 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.120 -13.616 -3.482 1.00 0.00 C ATOM 1476 C TRP A 90 -1.631 -15.021 -3.157 1.00 0.00 C ATOM 1477 O TRP A 90 -2.662 -15.444 -3.644 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.397 -12.690 -2.300 1.00 0.00 C ATOM 1479 CG TRP A 90 -2.850 -12.770 -1.932 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.444 -13.858 -1.391 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -3.898 -11.758 -2.061 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.782 -13.584 -1.185 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.111 -12.306 -1.576 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -3.921 -10.434 -2.543 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.297 -11.575 -1.568 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -5.120 -9.697 -2.535 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.303 -10.267 -2.048 1.00 0.00 C ATOM 0 H TRP A 90 -2.452 -12.315 -4.527 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.047 -13.652 -3.673 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -0.779 -12.975 -1.449 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.132 -11.665 -2.558 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -2.952 -14.790 -1.158 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.447 -14.249 -0.790 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.015 -9.983 -2.920 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.207 -12.020 -1.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -5.128 -8.683 -2.908 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.218 -9.694 -2.045 1.00 0.00 H new ATOM 1498 N GLU A 91 -0.927 -15.746 -2.334 1.00 0.00 N ATOM 1499 CA GLU A 91 -1.387 -17.120 -1.976 1.00 0.00 C ATOM 1500 C GLU A 91 -2.331 -17.042 -0.771 1.00 0.00 C ATOM 1501 O GLU A 91 -2.094 -16.302 0.158 1.00 0.00 O ATOM 1502 CB GLU A 91 -0.168 -17.992 -1.629 1.00 0.00 C ATOM 1503 CG GLU A 91 -0.555 -19.083 -0.619 1.00 0.00 C ATOM 1504 CD GLU A 91 0.648 -19.987 -0.352 1.00 0.00 C ATOM 1505 OE1 GLU A 91 1.416 -20.209 -1.274 1.00 0.00 O ATOM 1506 OE2 GLU A 91 0.781 -20.444 0.770 1.00 0.00 O ATOM 0 H GLU A 91 -0.056 -15.450 -1.894 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.917 -17.562 -2.820 1.00 0.00 H new ATOM 0 HB2 GLU A 91 0.227 -18.451 -2.535 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.625 -17.370 -1.215 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.893 -18.627 0.312 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.386 -19.672 -1.006 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.379 -17.827 -0.784 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.349 -17.847 0.356 1.00 0.00 C ATOM 1515 C GLY A 92 -4.538 -16.451 0.953 1.00 0.00 C ATOM 1516 O GLY A 92 -5.460 -15.741 0.610 1.00 0.00 O ATOM 0 H GLY A 92 -3.607 -18.464 -1.547 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.310 -18.230 0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.992 -18.529 1.128 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.683 -16.060 1.858 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.820 -14.721 2.489 1.00 0.00 C ATOM 1522 C GLU A 93 -2.818 -13.748 1.859 1.00 0.00 C ATOM 1523 O GLU A 93 -1.837 -14.162 1.277 1.00 0.00 O ATOM 1524 CB GLU A 93 -3.535 -14.840 3.988 1.00 0.00 C ATOM 1525 CG GLU A 93 -2.029 -14.995 4.217 1.00 0.00 C ATOM 1526 CD GLU A 93 -1.762 -15.343 5.682 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -1.922 -16.498 6.035 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -1.402 -14.446 6.428 1.00 0.00 O ATOM 0 H GLU A 93 -2.893 -16.614 2.188 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.832 -14.348 2.333 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.903 -13.956 4.509 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.066 -15.698 4.402 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.632 -15.777 3.570 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -1.515 -14.071 3.953 1.00 0.00 H new ATOM 1535 N PRO A 94 -3.096 -12.481 2.006 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.231 -11.417 1.470 1.00 0.00 C ATOM 1537 C PRO A 94 -0.986 -11.275 2.347 1.00 0.00 C ATOM 1538 O PRO A 94 -0.642 -12.164 3.099 1.00 0.00 O ATOM 1539 CB PRO A 94 -3.080 -10.150 1.579 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.236 -10.470 2.555 1.00 0.00 C ATOM 1541 CD PRO A 94 -4.298 -11.996 2.708 1.00 0.00 C ATOM 0 HA PRO A 94 -1.899 -11.618 0.451 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.483 -9.315 1.947 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.468 -9.859 0.603 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -4.066 -9.994 3.521 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -5.180 -10.084 2.171 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -4.292 -12.291 3.757 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -5.208 -12.403 2.267 1.00 0.00 H new ATOM 1549 N TRP A 95 -0.329 -10.151 2.268 1.00 0.00 N ATOM 1550 CA TRP A 95 0.880 -9.927 3.108 1.00 0.00 C ATOM 1551 C TRP A 95 1.544 -8.592 2.755 1.00 0.00 C ATOM 1552 O TRP A 95 2.732 -8.426 2.936 1.00 0.00 O ATOM 1553 CB TRP A 95 1.888 -11.053 2.879 1.00 0.00 C ATOM 1554 CG TRP A 95 2.405 -11.000 1.475 1.00 0.00 C ATOM 1555 CD1 TRP A 95 1.783 -10.407 0.428 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.644 -11.555 0.951 1.00 0.00 C ATOM 1557 NE1 TRP A 95 2.562 -10.569 -0.702 1.00 0.00 N ATOM 1558 CE2 TRP A 95 3.717 -11.270 -0.432 1.00 0.00 C ATOM 1559 CE3 TRP A 95 4.698 -12.273 1.537 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 4.802 -11.686 -1.207 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 5.790 -12.693 0.763 1.00 0.00 C ATOM 1562 CH2 TRP A 95 5.842 -12.400 -0.606 1.00 0.00 C ATOM 0 H TRP A 95 -0.579 -9.375 1.655 1.00 0.00 H new ATOM 0 HA TRP A 95 0.569 -9.910 4.153 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.715 -10.961 3.583 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.416 -12.018 3.065 1.00 0.00 H new ATOM 0 HD1 TRP A 95 0.834 -9.892 0.469 1.00 0.00 H new ATOM 0 HE1 TRP A 95 2.312 -10.213 -1.624 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.668 -12.504 2.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.837 -11.458 -2.262 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 6.595 -13.245 1.225 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.685 -12.726 -1.197 1.00 0.00 H new ATOM 1573 N GLY A 96 0.800 -7.637 2.268 1.00 0.00 N ATOM 1574 CA GLY A 96 1.422 -6.325 1.919 1.00 0.00 C ATOM 1575 C GLY A 96 1.090 -5.296 2.996 1.00 0.00 C ATOM 1576 O GLY A 96 1.574 -4.183 2.978 1.00 0.00 O ATOM 0 H GLY A 96 -0.203 -7.705 2.097 1.00 0.00 H new ATOM 0 HA2 GLY A 96 2.503 -6.436 1.829 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.055 -5.984 0.951 1.00 0.00 H new ATOM 1580 N LYS A 97 0.260 -5.658 3.930 1.00 0.00 N ATOM 1581 CA LYS A 97 -0.116 -4.703 5.003 1.00 0.00 C ATOM 1582 C LYS A 97 0.958 -4.656 6.091 1.00 0.00 C ATOM 1583 O LYS A 97 1.360 -5.664 6.636 1.00 0.00 O ATOM 1584 CB LYS A 97 -1.439 -5.145 5.615 1.00 0.00 C ATOM 1585 CG LYS A 97 -1.316 -6.590 6.097 1.00 0.00 C ATOM 1586 CD LYS A 97 -2.058 -6.733 7.422 1.00 0.00 C ATOM 1587 CE LYS A 97 -2.730 -8.109 7.499 1.00 0.00 C ATOM 1588 NZ LYS A 97 -2.827 -8.541 8.923 1.00 0.00 N ATOM 0 H LYS A 97 -0.176 -6.578 3.996 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.212 -3.706 4.572 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.703 -4.493 6.448 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.239 -5.062 4.879 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.733 -7.272 5.356 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -0.267 -6.858 6.222 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.363 -6.611 8.253 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -2.807 -5.947 7.516 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -3.724 -8.065 7.054 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -2.156 -8.837 6.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -3.283 -9.474 8.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -1.873 -8.599 9.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -3.392 -7.851 9.457 1.00 0.00 H new ATOM 1602 N GLU A 98 1.404 -3.481 6.426 1.00 0.00 N ATOM 1603 CA GLU A 98 2.423 -3.348 7.499 1.00 0.00 C ATOM 1604 C GLU A 98 1.693 -3.397 8.844 1.00 0.00 C ATOM 1605 O GLU A 98 1.369 -4.455 9.348 1.00 0.00 O ATOM 1606 CB GLU A 98 3.143 -2.011 7.333 1.00 0.00 C ATOM 1607 CG GLU A 98 4.081 -1.769 8.520 1.00 0.00 C ATOM 1608 CD GLU A 98 5.152 -2.861 8.558 1.00 0.00 C ATOM 1609 OE1 GLU A 98 5.706 -3.154 7.513 1.00 0.00 O ATOM 1610 OE2 GLU A 98 5.402 -3.382 9.633 1.00 0.00 O ATOM 0 H GLU A 98 1.105 -2.603 6.001 1.00 0.00 H new ATOM 0 HA GLU A 98 3.159 -4.150 7.448 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.712 -2.008 6.403 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.415 -1.203 7.264 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.550 -0.789 8.432 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.514 -1.769 9.451 1.00 0.00 H new ATOM 1617 N GLY A 99 1.390 -2.258 9.409 1.00 0.00 N ATOM 1618 CA GLY A 99 0.639 -2.234 10.688 1.00 0.00 C ATOM 1619 C GLY A 99 -0.853 -2.202 10.349 1.00 0.00 C ATOM 1620 O GLY A 99 -1.701 -2.531 11.155 1.00 0.00 O ATOM 0 H GLY A 99 1.634 -1.341 9.034 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.876 -3.113 11.288 1.00 0.00 H new ATOM 0 HA3 GLY A 99 0.916 -1.361 11.278 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.164 -1.810 9.141 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.583 -1.750 8.688 1.00 0.00 C ATOM 1626 C GLN A 100 -3.190 -3.157 8.742 1.00 0.00 C ATOM 1627 O GLN A 100 -2.493 -4.132 8.544 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.602 -1.254 7.237 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.660 -0.166 7.063 1.00 0.00 C ATOM 1630 CD GLN A 100 -2.975 1.171 6.782 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -1.887 1.210 6.246 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -3.574 2.279 7.125 1.00 0.00 N ATOM 0 H GLN A 100 -0.482 -1.524 8.439 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.157 -1.080 9.329 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.621 -0.864 6.966 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -2.811 -2.085 6.564 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.330 -0.423 6.242 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.272 -0.091 7.962 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -4.489 2.246 7.576 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -3.128 3.178 6.942 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.474 -3.224 8.990 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.184 -4.510 9.050 1.00 0.00 C ATOM 1643 C PRO A 101 -5.208 -5.123 7.655 1.00 0.00 C ATOM 1644 O PRO A 101 -5.094 -6.319 7.485 1.00 0.00 O ATOM 1645 CB PRO A 101 -6.609 -4.157 9.498 1.00 0.00 C ATOM 1646 CG PRO A 101 -6.693 -2.615 9.612 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.317 -2.042 9.233 1.00 0.00 C ATOM 0 HA PRO A 101 -4.715 -5.225 9.726 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.340 -4.529 8.780 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -6.837 -4.625 10.456 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.466 -2.224 8.950 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -6.964 -2.321 10.626 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.381 -1.412 8.346 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -4.911 -1.424 10.034 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.360 -4.298 6.654 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.397 -4.812 5.262 1.00 0.00 C ATOM 1657 C GLY A 102 -6.564 -5.785 5.120 1.00 0.00 C ATOM 1658 O GLY A 102 -6.666 -6.755 5.839 1.00 0.00 O ATOM 0 H GLY A 102 -5.460 -3.287 6.745 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.508 -3.986 4.559 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.459 -5.312 5.021 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.454 -5.534 4.204 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.610 -6.463 4.034 1.00 0.00 C ATOM 1664 C GLU A 103 -9.096 -6.426 2.582 1.00 0.00 C ATOM 1665 O GLU A 103 -9.394 -5.375 2.051 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.742 -6.049 4.987 1.00 0.00 C ATOM 1667 CG GLU A 103 -10.515 -4.854 4.415 1.00 0.00 C ATOM 1668 CD GLU A 103 -11.718 -5.356 3.615 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -12.341 -6.308 4.056 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -11.996 -4.779 2.576 1.00 0.00 O ATOM 0 H GLU A 103 -7.435 -4.735 3.570 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.299 -7.480 4.272 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.420 -6.888 5.142 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.328 -5.789 5.962 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.849 -4.204 5.223 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -9.863 -4.259 3.776 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.177 -7.563 1.930 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.646 -7.562 0.513 1.00 0.00 C ATOM 1679 C TRP A 104 -10.869 -6.662 0.418 1.00 0.00 C ATOM 1680 O TRP A 104 -11.777 -6.745 1.221 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.029 -8.976 0.059 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.081 -9.972 0.644 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -7.744 -9.971 0.452 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.374 -11.111 1.504 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.195 -11.036 1.140 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.158 -11.770 1.804 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.562 -11.631 2.048 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.123 -12.906 2.616 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -10.531 -12.773 2.865 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -9.313 -13.410 3.148 1.00 0.00 C ATOM 0 H TRP A 104 -8.941 -8.478 2.314 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.842 -7.202 -0.129 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.048 -9.204 0.371 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.008 -9.036 -1.029 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.195 -9.255 -0.142 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.199 -11.254 1.156 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.505 -11.149 1.836 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.183 -13.392 2.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -11.450 -13.163 3.278 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -9.295 -14.288 3.776 1.00 0.00 H new ATOM 1701 N MET A 105 -10.902 -5.797 -0.546 1.00 0.00 N ATOM 1702 CA MET A 105 -12.072 -4.892 -0.669 1.00 0.00 C ATOM 1703 C MET A 105 -12.675 -5.037 -2.056 1.00 0.00 C ATOM 1704 O MET A 105 -12.022 -4.792 -3.044 1.00 0.00 O ATOM 1705 CB MET A 105 -11.619 -3.440 -0.456 1.00 0.00 C ATOM 1706 CG MET A 105 -12.829 -2.497 -0.507 1.00 0.00 C ATOM 1707 SD MET A 105 -14.170 -3.140 0.525 1.00 0.00 S ATOM 1708 CE MET A 105 -15.542 -2.471 -0.447 1.00 0.00 C ATOM 0 H MET A 105 -10.176 -5.675 -1.252 1.00 0.00 H new ATOM 0 HA MET A 105 -12.818 -5.153 0.082 1.00 0.00 H new ATOM 0 HB2 MET A 105 -11.115 -3.346 0.506 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.897 -3.160 -1.223 1.00 0.00 H new ATOM 0 HG2 MET A 105 -12.540 -1.504 -0.162 1.00 0.00 H new ATOM 0 HG3 MET A 105 -13.172 -2.390 -1.536 1.00 0.00 H new ATOM 0 HE1 MET A 105 -16.368 -2.217 0.217 1.00 0.00 H new ATOM 0 HE2 MET A 105 -15.212 -1.576 -0.975 1.00 0.00 H new ATOM 0 HE3 MET A 105 -15.874 -3.217 -1.170 1.00 0.00 H new ATOM 1718 N SER A 106 -13.920 -5.416 -2.142 1.00 0.00 N ATOM 1719 CA SER A 106 -14.561 -5.549 -3.476 1.00 0.00 C ATOM 1720 C SER A 106 -15.024 -4.161 -3.923 1.00 0.00 C ATOM 1721 O SER A 106 -16.143 -3.972 -4.357 1.00 0.00 O ATOM 1722 CB SER A 106 -15.762 -6.487 -3.376 1.00 0.00 C ATOM 1723 OG SER A 106 -16.045 -6.746 -2.007 1.00 0.00 O ATOM 0 H SER A 106 -14.519 -5.639 -1.347 1.00 0.00 H new ATOM 0 HA SER A 106 -13.854 -5.960 -4.197 1.00 0.00 H new ATOM 0 HB2 SER A 106 -16.630 -6.038 -3.860 1.00 0.00 H new ATOM 0 HB3 SER A 106 -15.553 -7.420 -3.899 1.00 0.00 H new ATOM 0 HG SER A 106 -16.415 -5.940 -1.591 1.00 0.00 H new ATOM 1729 N LEU A 107 -14.161 -3.190 -3.804 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.510 -1.805 -4.197 1.00 0.00 C ATOM 1731 C LEU A 107 -14.888 -1.777 -5.672 1.00 0.00 C ATOM 1732 O LEU A 107 -15.884 -1.199 -6.048 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.283 -0.918 -3.966 1.00 0.00 C ATOM 1734 CG LEU A 107 -13.621 0.545 -4.247 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -12.524 1.428 -3.647 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -13.689 0.776 -5.760 1.00 0.00 C ATOM 0 H LEU A 107 -13.213 -3.305 -3.444 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.352 -1.445 -3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -12.937 -1.027 -2.938 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -12.467 -1.240 -4.613 1.00 0.00 H new ATOM 0 HG LEU A 107 -14.585 0.793 -3.803 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -12.754 2.476 -3.841 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -12.471 1.261 -2.571 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -11.566 1.177 -4.101 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -13.930 1.820 -5.958 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -12.725 0.535 -6.209 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -14.460 0.137 -6.191 1.00 0.00 H new ATOM 1748 N VAL A 108 -14.081 -2.385 -6.500 1.00 0.00 N ATOM 1749 CA VAL A 108 -14.346 -2.399 -7.968 1.00 0.00 C ATOM 1750 C VAL A 108 -13.827 -1.100 -8.574 1.00 0.00 C ATOM 1751 O VAL A 108 -14.345 -0.034 -8.304 1.00 0.00 O ATOM 1752 CB VAL A 108 -15.845 -2.516 -8.257 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -16.038 -2.587 -9.762 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -16.408 -3.783 -7.605 1.00 0.00 C ATOM 0 H VAL A 108 -13.236 -2.880 -6.216 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.840 -3.260 -8.404 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.370 -1.652 -7.849 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -17.101 -2.671 -9.989 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.639 -1.684 -10.223 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -15.513 -3.458 -10.155 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -17.475 -3.858 -7.816 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.896 -4.657 -8.007 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -16.254 -3.737 -6.527 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.803 -1.177 -9.385 1.00 0.00 N ATOM 1765 CA GLY A 109 -12.245 0.061 -10.000 1.00 0.00 C ATOM 1766 C GLY A 109 -12.221 1.171 -8.950 1.00 0.00 C ATOM 1767 O GLY A 109 -13.119 1.985 -8.878 1.00 0.00 O ATOM 0 H GLY A 109 -12.331 -2.043 -9.646 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.238 -0.125 -10.374 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.851 0.363 -10.854 1.00 0.00 H new ATOM 1771 N LEU A 110 -11.210 1.198 -8.122 1.00 0.00 N ATOM 1772 CA LEU A 110 -11.140 2.246 -7.065 1.00 0.00 C ATOM 1773 C LEU A 110 -11.561 3.599 -7.645 1.00 0.00 C ATOM 1774 O LEU A 110 -11.647 3.768 -8.846 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.723 2.324 -6.521 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.740 1.892 -5.058 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.433 1.180 -4.710 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -9.904 3.126 -4.176 1.00 0.00 C ATOM 0 H LEU A 110 -10.431 0.540 -8.133 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.819 1.988 -6.252 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -9.060 1.680 -7.098 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.338 3.340 -6.611 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.571 1.206 -4.890 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.452 0.875 -3.664 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -8.318 0.300 -5.343 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.595 1.857 -4.875 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -9.917 2.825 -3.128 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -9.072 3.809 -4.347 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.841 3.627 -4.421 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.861 4.558 -6.806 1.00 0.00 N ATOM 1791 CA ASN A 111 -12.321 5.877 -7.333 1.00 0.00 C ATOM 1792 C ASN A 111 -11.700 7.046 -6.567 1.00 0.00 C ATOM 1793 O ASN A 111 -11.904 8.188 -6.925 1.00 0.00 O ATOM 1794 CB ASN A 111 -13.836 5.947 -7.170 1.00 0.00 C ATOM 1795 CG ASN A 111 -14.426 6.837 -8.267 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -15.270 6.326 -9.123 1.00 0.00 O flip ATOM 1797 ND2 ASN A 111 -14.115 8.009 -8.348 1.00 0.00 N flip ATOM 0 H ASN A 111 -11.808 4.486 -5.790 1.00 0.00 H new ATOM 0 HA ASN A 111 -12.018 5.957 -8.377 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -14.265 4.947 -7.228 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -14.089 6.346 -6.188 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -13.456 8.409 -7.680 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -14.513 8.593 -9.084 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.989 6.787 -5.502 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.401 7.903 -4.693 1.00 0.00 C ATOM 1806 C ALA A 112 -11.475 8.445 -3.741 1.00 0.00 C ATOM 1807 O ALA A 112 -11.179 8.971 -2.687 1.00 0.00 O ATOM 1808 CB ALA A 112 -9.914 9.031 -5.604 1.00 0.00 C ATOM 0 H ALA A 112 -10.788 5.850 -5.154 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.550 7.523 -4.127 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -9.491 9.832 -4.997 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.152 8.648 -6.282 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -10.752 9.419 -6.183 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.722 8.302 -4.105 1.00 0.00 N ATOM 1815 CA ASP A 113 -13.827 8.775 -3.239 1.00 0.00 C ATOM 1816 C ASP A 113 -13.714 8.073 -1.892 1.00 0.00 C ATOM 1817 O ASP A 113 -14.186 8.547 -0.877 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.146 8.387 -3.904 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.076 9.601 -3.959 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -16.505 10.043 -2.906 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -16.341 10.069 -5.055 1.00 0.00 O ATOM 0 H ASP A 113 -13.020 7.870 -4.980 1.00 0.00 H new ATOM 0 HA ASP A 113 -13.782 9.855 -3.097 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.960 8.014 -4.911 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.621 7.579 -3.347 1.00 0.00 H new ATOM 1826 N ASP A 114 -13.091 6.933 -1.893 1.00 0.00 N ATOM 1827 CA ASP A 114 -12.930 6.156 -0.640 1.00 0.00 C ATOM 1828 C ASP A 114 -11.497 6.321 -0.118 1.00 0.00 C ATOM 1829 O ASP A 114 -11.196 5.989 1.011 1.00 0.00 O ATOM 1830 CB ASP A 114 -13.213 4.687 -0.955 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.718 4.427 -0.892 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.248 4.389 0.206 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -15.315 4.262 -1.942 1.00 0.00 O ATOM 0 H ASP A 114 -12.681 6.501 -2.721 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.620 6.511 0.126 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.832 4.438 -1.945 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.693 4.046 -0.243 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.613 6.837 -0.933 1.00 0.00 N ATOM 1839 CA PHE A 115 -9.200 7.028 -0.485 1.00 0.00 C ATOM 1840 C PHE A 115 -9.003 8.459 0.028 1.00 0.00 C ATOM 1841 O PHE A 115 -9.548 9.392 -0.527 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.248 6.821 -1.663 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.605 5.459 -1.589 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -8.309 4.336 -2.028 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -6.297 5.322 -1.107 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -7.708 3.073 -1.988 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -5.697 4.060 -1.060 1.00 0.00 C ATOM 1848 CZ PHE A 115 -6.401 2.936 -1.503 1.00 0.00 C ATOM 0 H PHE A 115 -10.808 7.134 -1.889 1.00 0.00 H new ATOM 0 HA PHE A 115 -8.991 6.307 0.306 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.794 6.922 -2.601 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.479 7.594 -1.657 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -9.318 4.442 -2.399 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -5.752 6.192 -0.771 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -8.251 2.205 -2.331 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -4.691 3.953 -0.682 1.00 0.00 H new ATOM 0 HZ PHE A 115 -5.937 1.961 -1.471 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.203 8.593 1.054 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.889 9.912 1.634 1.00 0.00 C ATOM 1860 C PRO A 116 -7.222 10.800 0.566 1.00 0.00 C ATOM 1861 O PRO A 116 -6.323 10.357 -0.119 1.00 0.00 O ATOM 1862 CB PRO A 116 -6.906 9.605 2.773 1.00 0.00 C ATOM 1863 CG PRO A 116 -6.795 8.067 2.904 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.558 7.449 1.724 1.00 0.00 C ATOM 0 HA PRO A 116 -8.772 10.444 1.988 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -5.930 10.041 2.562 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.256 10.043 3.708 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.751 7.755 2.891 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.216 7.731 3.852 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -6.883 6.923 1.048 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.296 6.723 2.066 1.00 0.00 H new ATOM 1872 N PRO A 117 -7.683 12.022 0.451 1.00 0.00 N ATOM 1873 CA PRO A 117 -7.141 12.977 -0.538 1.00 0.00 C ATOM 1874 C PRO A 117 -5.634 13.180 -0.337 1.00 0.00 C ATOM 1875 O PRO A 117 -4.949 13.682 -1.207 1.00 0.00 O ATOM 1876 CB PRO A 117 -7.903 14.284 -0.284 1.00 0.00 C ATOM 1877 CG PRO A 117 -8.932 14.018 0.844 1.00 0.00 C ATOM 1878 CD PRO A 117 -8.774 12.554 1.287 1.00 0.00 C ATOM 0 HA PRO A 117 -7.267 12.619 -1.560 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.215 15.078 0.006 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -8.408 14.615 -1.192 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -8.762 14.692 1.684 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.946 14.202 0.488 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.529 12.486 2.347 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.697 11.994 1.136 1.00 0.00 H new ATOM 1886 N ALA A 118 -5.108 12.797 0.793 1.00 0.00 N ATOM 1887 CA ALA A 118 -3.644 12.976 1.025 1.00 0.00 C ATOM 1888 C ALA A 118 -2.874 12.387 -0.158 1.00 0.00 C ATOM 1889 O ALA A 118 -2.103 13.061 -0.810 1.00 0.00 O ATOM 1890 CB ALA A 118 -3.234 12.248 2.304 1.00 0.00 C ATOM 0 H ALA A 118 -5.623 12.370 1.563 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.418 14.038 1.124 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -2.165 12.380 2.471 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -3.787 12.658 3.149 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.457 11.186 2.205 1.00 0.00 H new ATOM 1896 N ASN A 119 -3.084 11.129 -0.435 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.376 10.478 -1.572 1.00 0.00 C ATOM 1898 C ASN A 119 -3.177 10.707 -2.856 1.00 0.00 C ATOM 1899 O ASN A 119 -3.441 9.800 -3.614 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.253 8.985 -1.282 1.00 0.00 C ATOM 1901 CG ASN A 119 -1.014 8.750 -0.421 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.522 9.662 0.214 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -0.484 7.565 -0.367 1.00 0.00 N ATOM 0 H ASN A 119 -3.720 10.521 0.081 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.380 10.903 -1.696 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -3.144 8.626 -0.767 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.176 8.425 -2.214 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.343 7.402 0.207 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.895 6.798 -0.899 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.562 11.925 -3.087 1.00 0.00 N ATOM 1911 CA GLU A 120 -4.357 12.275 -4.298 1.00 0.00 C ATOM 1912 C GLU A 120 -3.649 11.867 -5.604 1.00 0.00 C ATOM 1913 O GLU A 120 -4.289 11.368 -6.504 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.564 13.785 -4.302 1.00 0.00 C ATOM 1915 CG GLU A 120 -6.048 14.101 -4.106 1.00 0.00 C ATOM 1916 CD GLU A 120 -6.452 15.258 -5.020 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -6.317 16.395 -4.599 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -6.890 14.988 -6.126 1.00 0.00 O ATOM 0 H GLU A 120 -3.356 12.714 -2.475 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.302 11.734 -4.256 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.976 14.245 -3.508 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.213 14.208 -5.244 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.650 13.220 -4.330 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.240 14.362 -3.065 1.00 0.00 H new ATOM 1925 N PRO A 121 -2.367 12.130 -5.697 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.590 11.828 -6.920 1.00 0.00 C ATOM 1927 C PRO A 121 -1.731 10.368 -7.374 1.00 0.00 C ATOM 1928 O PRO A 121 -2.124 10.100 -8.493 1.00 0.00 O ATOM 1929 CB PRO A 121 -0.140 12.154 -6.544 1.00 0.00 C ATOM 1930 CG PRO A 121 -0.168 12.897 -5.187 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.580 12.744 -4.608 1.00 0.00 C ATOM 0 HA PRO A 121 -1.949 12.412 -7.768 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.451 11.241 -6.469 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.325 12.773 -7.311 1.00 0.00 H new ATOM 0 HG2 PRO A 121 0.573 12.479 -4.506 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.080 13.950 -5.321 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.577 12.115 -3.718 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.995 13.709 -4.315 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.402 9.427 -6.542 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.503 8.000 -6.957 1.00 0.00 C ATOM 1941 C VAL A 122 -2.963 7.544 -6.872 1.00 0.00 C ATOM 1942 O VAL A 122 -3.410 6.731 -7.653 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.617 7.161 -6.037 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.226 5.771 -5.828 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.771 7.012 -6.669 1.00 0.00 C ATOM 0 H VAL A 122 -1.067 9.581 -5.591 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.167 7.878 -7.987 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.538 7.662 -5.072 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.582 5.187 -5.170 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.213 5.870 -5.375 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.317 5.265 -6.789 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.406 6.414 -6.015 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.679 6.519 -7.637 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.216 7.997 -6.805 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.711 8.062 -5.941 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.139 7.658 -5.847 1.00 0.00 C ATOM 1957 C ILE A 123 -5.820 8.131 -7.131 1.00 0.00 C ATOM 1958 O ILE A 123 -6.824 7.598 -7.556 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.798 8.325 -4.631 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -5.491 7.523 -3.363 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.315 8.375 -4.829 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -5.422 8.480 -2.170 1.00 0.00 C ATOM 0 H ILE A 123 -3.399 8.741 -5.247 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.230 6.578 -5.729 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.403 9.336 -4.529 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -6.262 6.771 -3.198 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.546 6.991 -3.474 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.779 8.849 -3.964 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.546 8.950 -5.726 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.701 7.362 -4.938 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -5.204 7.916 -1.263 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.635 9.215 -2.338 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.378 8.991 -2.058 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.250 9.130 -7.751 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.812 9.670 -9.017 1.00 0.00 C ATOM 1976 C ALA A 124 -5.798 8.569 -10.074 1.00 0.00 C ATOM 1977 O ALA A 124 -6.599 8.545 -10.986 1.00 0.00 O ATOM 1978 CB ALA A 124 -4.934 10.829 -9.484 1.00 0.00 C ATOM 0 H ALA A 124 -4.405 9.600 -7.426 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.834 10.016 -8.861 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.333 11.237 -10.413 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.923 11.607 -8.721 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.918 10.471 -9.652 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.872 7.668 -9.949 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.751 6.557 -10.932 1.00 0.00 C ATOM 1986 C LYS A 125 -5.767 5.451 -10.629 1.00 0.00 C ATOM 1987 O LYS A 125 -6.364 4.896 -11.530 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.332 6.008 -10.863 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.374 7.104 -11.316 1.00 0.00 C ATOM 1990 CD LYS A 125 -2.645 7.445 -12.783 1.00 0.00 C ATOM 1991 CE LYS A 125 -1.332 7.421 -13.566 1.00 0.00 C ATOM 1992 NZ LYS A 125 -0.817 6.025 -13.623 1.00 0.00 N ATOM 0 H LYS A 125 -4.182 7.651 -9.198 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.959 6.930 -11.935 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -3.096 5.693 -9.847 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -3.233 5.129 -11.500 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.501 7.991 -10.696 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.343 6.774 -11.193 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.348 6.729 -13.209 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -3.107 8.429 -12.859 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -1.490 7.804 -14.574 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -0.599 8.072 -13.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 0.161 6.001 -13.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -1.414 5.410 -13.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.837 5.687 -14.606 1.00 0.00 H new ATOM 2006 N LEU A 126 -5.988 5.124 -9.384 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.991 4.061 -9.090 1.00 0.00 C ATOM 2008 C LEU A 126 -8.361 4.587 -9.496 1.00 0.00 C ATOM 2009 O LEU A 126 -9.279 3.844 -9.772 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.996 3.709 -7.597 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.601 3.254 -7.110 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.616 3.107 -8.276 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -5.051 4.285 -6.122 1.00 0.00 C ATOM 0 H LEU A 126 -5.528 5.537 -8.573 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.740 3.157 -9.645 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.317 4.576 -7.020 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.722 2.917 -7.413 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.712 2.281 -6.631 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.647 2.786 -7.895 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.993 2.365 -8.980 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.507 4.066 -8.783 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.067 3.968 -5.776 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.968 5.253 -6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.726 4.369 -5.270 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.492 5.874 -9.567 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.783 6.460 -9.994 1.00 0.00 C ATOM 2027 C LYS A 127 -10.088 5.912 -11.376 1.00 0.00 C ATOM 2028 O LYS A 127 -11.220 5.683 -11.754 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.622 7.969 -10.081 1.00 0.00 C ATOM 2030 CG LYS A 127 -8.915 8.462 -8.826 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.514 9.801 -8.393 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.334 10.829 -9.511 1.00 0.00 C ATOM 2033 NZ LYS A 127 -10.270 11.967 -9.288 1.00 0.00 N ATOM 0 H LYS A 127 -7.759 6.548 -9.347 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.583 6.217 -9.294 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.047 8.236 -10.967 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.597 8.447 -10.177 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.020 7.729 -8.026 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -7.848 8.574 -9.018 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.573 9.680 -8.163 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.028 10.151 -7.482 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.305 11.188 -9.529 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -9.528 10.368 -10.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -10.151 12.668 -10.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.249 11.617 -9.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -10.064 12.411 -8.370 1.00 0.00 H new ATOM 2047 N ARG A 128 -9.048 5.699 -12.124 1.00 0.00 N ATOM 2048 CA ARG A 128 -9.182 5.160 -13.497 1.00 0.00 C ATOM 2049 C ARG A 128 -9.199 3.633 -13.422 1.00 0.00 C ATOM 2050 O ARG A 128 -9.668 2.958 -14.317 1.00 0.00 O ATOM 2051 CB ARG A 128 -7.976 5.612 -14.330 1.00 0.00 C ATOM 2052 CG ARG A 128 -7.343 6.870 -13.717 1.00 0.00 C ATOM 2053 CD ARG A 128 -6.598 7.649 -14.800 1.00 0.00 C ATOM 2054 NE ARG A 128 -7.416 8.820 -15.220 1.00 0.00 N ATOM 2055 CZ ARG A 128 -6.866 9.788 -15.900 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -5.922 10.508 -15.360 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -7.263 10.037 -17.117 1.00 0.00 N ATOM 0 H ARG A 128 -8.088 5.881 -11.833 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.102 5.521 -13.957 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.238 4.812 -14.377 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -8.289 5.817 -15.354 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -8.115 7.497 -13.270 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -6.656 6.591 -12.918 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -5.632 7.983 -14.423 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -6.400 7.004 -15.656 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.405 8.865 -14.976 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -5.615 10.314 -14.407 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -5.491 11.265 -15.891 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -8.003 9.475 -17.537 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -6.833 10.794 -17.649 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.682 3.087 -12.352 1.00 0.00 N ATOM 2072 CA LEU A 129 -8.653 1.606 -12.198 1.00 0.00 C ATOM 2073 C LEU A 129 -9.977 1.011 -12.678 1.00 0.00 C ATOM 2074 O LEU A 129 -9.975 -0.140 -13.084 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.437 1.254 -10.728 1.00 0.00 C ATOM 2076 CG LEU A 129 -7.246 0.307 -10.599 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -6.006 0.971 -11.197 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -6.997 0.003 -9.120 1.00 0.00 C ATOM 2079 OXT LEU A 129 -10.971 1.717 -12.631 1.00 0.00 O ATOM 0 H LEU A 129 -8.277 3.609 -11.575 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.839 1.196 -12.795 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.259 2.160 -10.149 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -9.333 0.786 -10.320 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.456 -0.621 -11.131 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.153 0.298 -11.107 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.184 1.192 -12.249 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.795 1.897 -10.662 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.147 -0.673 -9.026 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.784 0.931 -8.589 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.883 -0.465 -8.691 1.00 0.00 H new TER 2091 LEU A 129 HETATM 2092 MG MG A 132 7.841 -3.936 6.649 1.00 0.00 MG HETATM 2093 PG APC A 130 6.444 0.380 11.088 1.00 0.00 P HETATM 2094 O1G APC A 130 7.416 1.191 12.083 1.00 0.00 O HETATM 2095 O2G APC A 130 6.210 -0.996 11.582 1.00 0.00 O HETATM 2096 O3G APC A 130 5.034 1.140 10.914 1.00 0.00 O HETATM 2097 PB APC A 130 7.980 1.340 8.763 1.00 0.00 P HETATM 2098 O1B APC A 130 8.863 2.234 9.769 1.00 0.00 O HETATM 2099 O2B APC A 130 8.877 0.537 7.907 1.00 0.00 O HETATM 2100 O3B APC A 130 7.043 0.321 9.592 1.00 0.00 O HETATM 2101 PA APC A 130 6.714 3.402 8.712 1.00 0.00 P HETATM 2102 O1A APC A 130 6.600 2.997 10.131 1.00 0.00 O HETATM 2103 O2A APC A 130 5.522 3.972 8.045 1.00 0.00 O HETATM 2104 C3A APC A 130 7.140 2.228 7.925 1.00 0.00 C HETATM 2105 O5' APC A 130 7.889 4.506 8.633 1.00 0.00 O HETATM 2106 C5' APC A 130 7.985 5.400 7.520 1.00 0.00 C HETATM 2107 C4' APC A 130 7.622 6.822 7.924 1.00 0.00 C HETATM 2108 O4' APC A 130 7.424 7.670 6.776 1.00 0.00 O HETATM 2109 C3' APC A 130 6.344 6.808 8.719 1.00 0.00 C HETATM 2110 O3' APC A 130 6.580 7.110 10.097 1.00 0.00 O HETATM 2111 C2' APC A 130 5.424 7.797 8.072 1.00 0.00 C HETATM 2112 O2' APC A 130 5.057 8.837 8.966 1.00 0.00 O HETATM 2113 C1' APC A 130 6.160 8.345 6.870 1.00 0.00 C HETATM 2114 N9 APC A 130 5.357 8.110 5.674 1.00 0.00 N HETATM 2115 C8 APC A 130 5.078 6.942 5.067 1.00 0.00 C HETATM 2116 N7 APC A 130 4.234 6.968 4.086 1.00 0.00 N HETATM 2117 C5 APC A 130 3.915 8.331 4.028 1.00 0.00 C HETATM 2118 C6 APC A 130 3.068 9.081 3.202 1.00 0.00 C HETATM 2119 N6 APC A 130 2.315 8.543 2.243 1.00 0.00 N HETATM 2120 N1 APC A 130 3.002 10.406 3.424 1.00 0.00 N HETATM 2121 C2 APC A 130 3.725 10.966 4.395 1.00 0.00 C HETATM 2122 N3 APC A 130 4.553 10.354 5.232 1.00 0.00 N HETATM 2123 C4 APC A 130 4.603 9.030 4.991 1.00 0.00 C HETATM 0 HO3' APC A 130 7.168 6.429 10.485 1.00 0.00 H new HETATM 0 HO2' APC A 130 5.621 8.795 9.766 1.00 0.00 H new HETATM 0 HN62 APC A 130 1.716 9.138 1.671 1.00 0.00 H new HETATM 0 HN61 APC A 130 2.338 7.536 2.081 1.00 0.00 H new HETATM 0 H5'2 APC A 130 8.999 5.380 7.121 1.00 0.00 H new HETATM 0 H5'1 APC A 130 7.322 5.065 6.723 1.00 0.00 H new HETATM 0 H3A2 APC A 130 7.699 2.551 7.047 1.00 0.00 H new HETATM 0 H3A1 APC A 130 6.267 1.684 7.564 1.00 0.00 H new HETATM 0 H8 APC A 130 5.544 6.011 5.389 1.00 0.00 H new HETATM 0 H4' APC A 130 8.450 7.215 8.515 1.00 0.00 H new HETATM 0 H3' APC A 130 5.893 5.815 8.715 1.00 0.00 H new HETATM 0 H2' APC A 130 4.492 7.316 7.777 1.00 0.00 H new HETATM 0 H2 APC A 130 3.625 12.045 4.514 1.00 0.00 H new HETATM 0 H1' APC A 130 6.329 9.417 6.967 1.00 0.00 H new HETATM 2139 CO CON A 131 9.388 1.861 11.768 1.00 0.00 CO HETATM 2140 N1 CON A 131 11.358 2.533 11.405 1.00 0.00 N HETATM 2141 N2 CON A 131 9.892 1.461 13.774 1.00 0.00 N HETATM 2142 N3 CON A 131 8.804 3.819 12.301 1.00 0.00 N HETATM 2143 N4 CON A 131 9.963 -0.099 11.241 1.00 0.00 N HETATM 2156 O HOH A 133 9.269 -2.555 7.356 1.00 0.00 O HETATM 2159 O HOH A 134 7.899 -4.801 8.578 1.00 0.00 O