USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=21 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 -173:sc= 0 (180deg=-0.123) USER MOD Single : A 1 MET N :NH3+ -152:sc= 0.0502 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0028) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -3.27 K(o=-3.3,f=-5!) USER MOD Single : A 13 ASN : amide:sc= -3.42! C(o=-3.4!,f=-5.5!) USER MOD Single : A 15 ASN : amide:sc= -2.12! C(o=-2.1!,f=-2.9!) USER MOD Single : A 16 ASN :FLIP amide:sc= -5.02! C(o=-9.4!,f=-5!) USER MOD Single : A 21 THR OG1 : rot 180:sc= -1.94! USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -2.39! C(o=-2.4!,f=-1.9!) USER MOD Single : A 32 LYS NZ :NH3+ 158:sc= -0.0787 (180deg=-0.479) USER MOD Single : A 39 LYS NZ :NH3+ 169:sc= -2.43 (180deg=-2.78!) 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 : amide:sc= -3.64! C(o=-3.6!,f=-9.2!) USER MOD Single : A 61 THR OG1 : rot 9:sc= 1.23 USER MOD Single : A 63 GLN :FLIP amide:sc= -13.8! C(o=-17!,f=-14!) USER MOD Single : A 64 HIS : no HD1:sc= -0.276 K(o=-0.28,f=-0.84) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 161:sc=0.000385 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS :FLIP no HD1:sc= -0.446 F(o=-1.3,f=-0.45) USER MOD Single : A 81 THR OG1 : rot -150:sc= -1.54! USER MOD Single : A 97 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.646) USER MOD Single : A 100 GLN : amide:sc= -0.351 K(o=-0.35,f=-1.1) USER MOD Single : A 105 MET CE :methyl 153:sc= -4.5! (180deg=-7.65!) USER MOD Single : A 106 SER OG : rot 75:sc= 0.126 USER MOD Single : A 111 ASN : amide:sc= -6.69! C(o=-6.7!,f=-6.3!) USER MOD Single : A 119 ASN : amide:sc= -1.17 K(o=-1.2,f=-4.8!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -127:sc= -2.46! (180deg=-6.52!) USER MOD Single : A 130 APC O2' : rot -2:sc= 0.442 USER MOD Single : A 130 APC O3' : rot 180:sc= 0.249 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.390 17.202 4.501 1.00 0.00 N ATOM 2 CA MET A 1 16.192 16.898 5.335 1.00 0.00 C ATOM 3 C MET A 1 16.074 15.385 5.526 1.00 0.00 C ATOM 4 O MET A 1 17.041 14.659 5.418 1.00 0.00 O ATOM 5 CB MET A 1 14.940 17.417 4.632 1.00 0.00 C ATOM 6 CG MET A 1 13.987 18.009 5.668 1.00 0.00 C ATOM 7 SD MET A 1 13.940 19.808 5.481 1.00 0.00 S ATOM 8 CE MET A 1 15.559 20.152 6.216 1.00 0.00 C ATOM 0 H1 MET A 1 17.751 18.146 4.744 1.00 0.00 H new ATOM 0 H2 MET A 1 18.128 16.492 4.682 1.00 0.00 H new ATOM 0 H3 MET A 1 17.127 17.180 3.495 1.00 0.00 H new ATOM 0 HA MET A 1 16.294 17.382 6.307 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.210 18.174 3.895 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.450 16.607 4.092 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.988 17.593 5.539 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.315 17.745 6.673 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.690 21.229 6.319 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.619 19.684 7.198 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.343 19.750 5.574 1.00 0.00 H new ATOM 20 N LYS A 2 14.892 14.899 5.798 1.00 0.00 N ATOM 21 CA LYS A 2 14.723 13.430 5.982 1.00 0.00 C ATOM 22 C LYS A 2 13.895 12.867 4.829 1.00 0.00 C ATOM 23 O LYS A 2 13.274 13.599 4.084 1.00 0.00 O ATOM 24 CB LYS A 2 14.024 13.124 7.318 1.00 0.00 C ATOM 25 CG LYS A 2 12.819 14.057 7.542 1.00 0.00 C ATOM 26 CD LYS A 2 11.636 13.674 6.632 1.00 0.00 C ATOM 27 CE LYS A 2 11.181 12.236 6.908 1.00 0.00 C ATOM 28 NZ LYS A 2 10.386 12.203 8.166 1.00 0.00 N ATOM 0 H LYS A 2 14.041 15.453 5.900 1.00 0.00 H new ATOM 0 HA LYS A 2 15.708 12.963 5.993 1.00 0.00 H new ATOM 0 HB2 LYS A 2 13.691 12.086 7.328 1.00 0.00 H new ATOM 0 HB3 LYS A 2 14.734 13.239 8.137 1.00 0.00 H new ATOM 0 HG2 LYS A 2 12.508 14.008 8.586 1.00 0.00 H new ATOM 0 HG3 LYS A 2 13.113 15.088 7.345 1.00 0.00 H new ATOM 0 HD2 LYS A 2 10.806 14.361 6.798 1.00 0.00 H new ATOM 0 HD3 LYS A 2 11.928 13.774 5.587 1.00 0.00 H new ATOM 0 HE2 LYS A 2 10.582 11.866 6.076 1.00 0.00 H new ATOM 0 HE3 LYS A 2 12.046 11.579 6.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 10.669 11.379 8.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 10.559 13.073 8.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 9.374 12.134 7.936 1.00 0.00 H new ATOM 42 N LYS A 3 13.883 11.576 4.671 1.00 0.00 N ATOM 43 CA LYS A 3 13.087 10.981 3.566 1.00 0.00 C ATOM 44 C LYS A 3 12.860 9.494 3.834 1.00 0.00 C ATOM 45 O LYS A 3 13.667 8.832 4.455 1.00 0.00 O ATOM 46 CB LYS A 3 13.834 11.152 2.242 1.00 0.00 C ATOM 47 CG LYS A 3 13.154 10.308 1.164 1.00 0.00 C ATOM 48 CD LYS A 3 13.823 10.565 -0.185 1.00 0.00 C ATOM 49 CE LYS A 3 14.343 9.245 -0.758 1.00 0.00 C ATOM 50 NZ LYS A 3 14.164 9.244 -2.237 1.00 0.00 N ATOM 0 H LYS A 3 14.387 10.910 5.256 1.00 0.00 H new ATOM 0 HA LYS A 3 12.124 11.488 3.507 1.00 0.00 H new ATOM 0 HB2 LYS A 3 13.840 12.202 1.948 1.00 0.00 H new ATOM 0 HB3 LYS A 3 14.874 10.847 2.356 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.222 9.250 1.419 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.094 10.556 1.109 1.00 0.00 H new ATOM 0 HD2 LYS A 3 13.111 11.018 -0.875 1.00 0.00 H new ATOM 0 HD3 LYS A 3 14.645 11.271 -0.066 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.396 9.117 -0.508 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.806 8.407 -0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 14.517 8.348 -2.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.155 9.348 -2.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 14.696 10.036 -2.652 1.00 0.00 H new ATOM 64 N LEU A 4 11.774 8.963 3.349 1.00 0.00 N ATOM 65 CA LEU A 4 11.496 7.514 3.545 1.00 0.00 C ATOM 66 C LEU A 4 10.506 7.050 2.482 1.00 0.00 C ATOM 67 O LEU A 4 9.662 7.798 2.030 1.00 0.00 O ATOM 68 CB LEU A 4 10.961 7.248 4.967 1.00 0.00 C ATOM 69 CG LEU A 4 9.432 7.337 5.053 1.00 0.00 C ATOM 70 CD1 LEU A 4 8.892 8.559 4.319 1.00 0.00 C ATOM 71 CD2 LEU A 4 8.798 6.061 4.488 1.00 0.00 C ATOM 0 H LEU A 4 11.064 9.472 2.823 1.00 0.00 H new ATOM 0 HA LEU A 4 12.420 6.946 3.439 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.282 6.258 5.292 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.402 7.968 5.657 1.00 0.00 H new ATOM 0 HG LEU A 4 9.166 7.440 6.105 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.806 8.584 4.405 1.00 0.00 H new ATOM 0 HD12 LEU A 4 9.312 9.463 4.760 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.172 8.505 3.267 1.00 0.00 H new ATOM 0 HD21 LEU A 4 7.712 6.134 4.554 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.091 5.940 3.445 1.00 0.00 H new ATOM 0 HD23 LEU A 4 9.139 5.200 5.063 1.00 0.00 H new ATOM 83 N GLN A 5 10.618 5.828 2.057 1.00 0.00 N ATOM 84 CA GLN A 5 9.692 5.331 1.011 1.00 0.00 C ATOM 85 C GLN A 5 8.772 4.284 1.618 1.00 0.00 C ATOM 86 O GLN A 5 8.962 3.845 2.735 1.00 0.00 O ATOM 87 CB GLN A 5 10.492 4.715 -0.133 1.00 0.00 C ATOM 88 CG GLN A 5 11.456 5.767 -0.684 1.00 0.00 C ATOM 89 CD GLN A 5 12.744 5.762 0.141 1.00 0.00 C ATOM 90 OE1 GLN A 5 13.021 6.701 0.861 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.547 4.737 0.068 1.00 0.00 N ATOM 0 H GLN A 5 11.308 5.154 2.387 1.00 0.00 H new ATOM 0 HA GLN A 5 9.098 6.158 0.623 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.045 3.844 0.219 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.821 4.370 -0.919 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.681 5.557 -1.730 1.00 0.00 H new ATOM 0 HG3 GLN A 5 10.993 6.753 -0.649 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.314 3.949 -0.536 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.408 4.723 0.615 1.00 0.00 H new ATOM 100 N ILE A 6 7.772 3.886 0.897 1.00 0.00 N ATOM 101 CA ILE A 6 6.837 2.877 1.440 1.00 0.00 C ATOM 102 C ILE A 6 6.556 1.822 0.367 1.00 0.00 C ATOM 103 O ILE A 6 5.880 2.074 -0.611 1.00 0.00 O ATOM 104 CB ILE A 6 5.554 3.590 1.871 1.00 0.00 C ATOM 105 CG1 ILE A 6 5.788 4.205 3.265 1.00 0.00 C ATOM 106 CG2 ILE A 6 4.399 2.592 1.900 1.00 0.00 C ATOM 107 CD1 ILE A 6 4.663 3.835 4.253 1.00 0.00 C ATOM 0 H ILE A 6 7.561 4.216 -0.045 1.00 0.00 H new ATOM 0 HA ILE A 6 7.266 2.372 2.305 1.00 0.00 H new ATOM 0 HB ILE A 6 5.297 4.381 1.167 1.00 0.00 H new ATOM 0 HG12 ILE A 6 6.744 3.860 3.658 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.852 5.290 3.177 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.486 3.101 2.207 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.261 2.167 0.906 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.625 1.794 2.608 1.00 0.00 H new ATOM 0 HD11 ILE A 6 4.867 4.289 5.223 1.00 0.00 H new ATOM 0 HD12 ILE A 6 3.710 4.203 3.873 1.00 0.00 H new ATOM 0 HD13 ILE A 6 4.616 2.751 4.362 1.00 0.00 H new ATOM 119 N ALA A 7 7.084 0.643 0.546 1.00 0.00 N ATOM 120 CA ALA A 7 6.866 -0.434 -0.455 1.00 0.00 C ATOM 121 C ALA A 7 5.525 -1.103 -0.191 1.00 0.00 C ATOM 122 O ALA A 7 5.462 -2.221 0.281 1.00 0.00 O ATOM 123 CB ALA A 7 7.974 -1.479 -0.337 1.00 0.00 C ATOM 0 H ALA A 7 7.659 0.380 1.346 1.00 0.00 H new ATOM 0 HA ALA A 7 6.876 -0.002 -1.456 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.811 -2.267 -1.072 1.00 0.00 H new ATOM 0 HB2 ALA A 7 8.940 -1.007 -0.519 1.00 0.00 H new ATOM 0 HB3 ALA A 7 7.963 -1.909 0.664 1.00 0.00 H new ATOM 129 N VAL A 8 4.449 -0.438 -0.489 1.00 0.00 N ATOM 130 CA VAL A 8 3.126 -1.064 -0.244 1.00 0.00 C ATOM 131 C VAL A 8 2.764 -1.963 -1.423 1.00 0.00 C ATOM 132 O VAL A 8 2.962 -3.159 -1.385 1.00 0.00 O ATOM 133 CB VAL A 8 2.037 0.009 -0.040 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.330 1.232 -0.914 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.656 -0.564 -0.410 1.00 0.00 C ATOM 0 H VAL A 8 4.427 0.501 -0.887 1.00 0.00 H new ATOM 0 HA VAL A 8 3.184 -1.661 0.666 1.00 0.00 H new ATOM 0 HB VAL A 8 2.036 0.308 1.008 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.554 1.983 -0.761 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.299 1.651 -0.641 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.346 0.935 -1.963 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.107 0.201 -0.263 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.660 -0.877 -1.454 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.436 -1.422 0.225 1.00 0.00 H new ATOM 145 N GLY A 9 2.205 -1.409 -2.457 1.00 0.00 N ATOM 146 CA GLY A 9 1.803 -2.256 -3.599 1.00 0.00 C ATOM 147 C GLY A 9 0.466 -2.877 -3.240 1.00 0.00 C ATOM 148 O GLY A 9 0.380 -4.019 -2.834 1.00 0.00 O ATOM 0 H GLY A 9 2.011 -0.413 -2.558 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.721 -1.662 -4.510 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.549 -3.028 -3.788 1.00 0.00 H new ATOM 152 N ILE A 10 -0.579 -2.114 -3.366 1.00 0.00 N ATOM 153 CA ILE A 10 -1.921 -2.649 -3.004 1.00 0.00 C ATOM 154 C ILE A 10 -2.064 -4.002 -3.664 1.00 0.00 C ATOM 155 O ILE A 10 -1.468 -4.266 -4.685 1.00 0.00 O ATOM 156 CB ILE A 10 -3.059 -1.716 -3.451 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.503 -0.341 -3.836 1.00 0.00 C ATOM 158 CG2 ILE A 10 -4.039 -1.547 -2.279 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.650 0.579 -4.248 1.00 0.00 C ATOM 0 H ILE A 10 -0.566 -1.151 -3.701 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.995 -2.729 -1.919 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.561 -2.148 -4.316 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -1.961 0.092 -2.995 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.792 -0.442 -4.656 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.854 -0.888 -2.578 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.444 -2.520 -2.000 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.516 -1.114 -1.427 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.252 1.556 -4.521 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.173 0.148 -5.102 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.345 0.690 -3.415 1.00 0.00 H new ATOM 171 N ILE A 11 -2.809 -4.878 -3.081 1.00 0.00 N ATOM 172 CA ILE A 11 -2.928 -6.221 -3.679 1.00 0.00 C ATOM 173 C ILE A 11 -4.391 -6.525 -4.023 1.00 0.00 C ATOM 174 O ILE A 11 -5.051 -7.286 -3.349 1.00 0.00 O ATOM 175 CB ILE A 11 -2.367 -7.235 -2.675 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.982 -6.985 -1.297 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.848 -7.052 -2.564 1.00 0.00 C ATOM 178 CD1 ILE A 11 -2.371 -7.962 -0.290 1.00 0.00 C ATOM 0 H ILE A 11 -3.338 -4.726 -2.222 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.363 -6.278 -4.609 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.604 -8.243 -3.015 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.797 -5.958 -0.984 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -4.063 -7.116 -1.339 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.446 -7.772 -1.851 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.390 -7.213 -3.540 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.627 -6.041 -2.222 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.805 -7.789 0.695 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.579 -8.985 -0.603 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.293 -7.809 -0.243 1.00 0.00 H new ATOM 190 N ARG A 12 -4.895 -5.943 -5.090 1.00 0.00 N ATOM 191 CA ARG A 12 -6.313 -6.228 -5.490 1.00 0.00 C ATOM 192 C ARG A 12 -6.340 -7.568 -6.219 1.00 0.00 C ATOM 193 O ARG A 12 -5.338 -7.990 -6.758 1.00 0.00 O ATOM 194 CB ARG A 12 -6.914 -5.117 -6.383 1.00 0.00 C ATOM 195 CG ARG A 12 -5.929 -4.595 -7.438 1.00 0.00 C ATOM 196 CD ARG A 12 -6.097 -3.074 -7.569 1.00 0.00 C ATOM 197 NE ARG A 12 -4.785 -2.477 -7.947 1.00 0.00 N ATOM 198 CZ ARG A 12 -4.701 -1.216 -8.263 1.00 0.00 C ATOM 199 NH1 ARG A 12 -4.896 -0.303 -7.350 1.00 0.00 N ATOM 200 NH2 ARG A 12 -4.414 -0.866 -9.486 1.00 0.00 N ATOM 0 H ARG A 12 -4.393 -5.292 -5.693 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.928 -6.262 -4.590 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -7.803 -5.502 -6.883 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.236 -4.288 -5.754 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -4.906 -4.837 -7.151 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -6.114 -5.078 -8.397 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -6.849 -2.841 -8.323 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.447 -2.650 -6.628 1.00 0.00 H new ATOM 0 HE ARG A 12 -3.948 -3.059 -7.958 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.113 -0.578 -6.392 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -4.831 0.685 -7.595 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -4.255 -1.580 -10.197 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -4.349 0.122 -9.732 1.00 0.00 H new ATOM 214 N ASN A 13 -7.445 -8.284 -6.219 1.00 0.00 N ATOM 215 CA ASN A 13 -7.399 -9.609 -6.901 1.00 0.00 C ATOM 216 C ASN A 13 -8.760 -10.118 -7.426 1.00 0.00 C ATOM 217 O ASN A 13 -8.777 -10.947 -8.275 1.00 0.00 O ATOM 218 CB ASN A 13 -6.829 -10.640 -5.920 1.00 0.00 C ATOM 219 CG ASN A 13 -7.933 -11.142 -4.984 1.00 0.00 C ATOM 220 OD1 ASN A 13 -8.413 -10.409 -4.141 1.00 0.00 O ATOM 221 ND2 ASN A 13 -8.358 -12.371 -5.098 1.00 0.00 N ATOM 0 H ASN A 13 -8.335 -8.020 -5.796 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.771 -9.477 -7.782 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.399 -11.477 -6.469 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -6.023 -10.193 -5.338 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -9.092 -12.716 -4.480 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -7.956 -12.986 -5.805 1.00 0.00 H new ATOM 228 N GLU A 14 -9.894 -9.687 -6.972 1.00 0.00 N ATOM 229 CA GLU A 14 -11.146 -10.304 -7.551 1.00 0.00 C ATOM 230 C GLU A 14 -11.640 -9.454 -8.715 1.00 0.00 C ATOM 231 O GLU A 14 -12.170 -9.933 -9.697 1.00 0.00 O ATOM 232 CB GLU A 14 -12.222 -10.374 -6.470 1.00 0.00 C ATOM 233 CG GLU A 14 -13.221 -11.474 -6.815 1.00 0.00 C ATOM 234 CD GLU A 14 -14.611 -11.075 -6.315 1.00 0.00 C ATOM 235 OE1 GLU A 14 -15.032 -9.972 -6.621 1.00 0.00 O ATOM 236 OE2 GLU A 14 -15.228 -11.876 -5.634 1.00 0.00 O ATOM 0 H GLU A 14 -10.026 -8.969 -6.259 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.927 -11.310 -7.909 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.766 -10.574 -5.501 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.734 -9.415 -6.390 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.243 -11.635 -7.893 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.915 -12.415 -6.358 1.00 0.00 H new ATOM 243 N ASN A 15 -11.410 -8.207 -8.598 1.00 0.00 N ATOM 244 CA ASN A 15 -11.767 -7.215 -9.648 1.00 0.00 C ATOM 245 C ASN A 15 -10.920 -6.028 -9.292 1.00 0.00 C ATOM 246 O ASN A 15 -10.200 -5.455 -10.086 1.00 0.00 O ATOM 247 CB ASN A 15 -13.254 -6.854 -9.571 1.00 0.00 C ATOM 248 CG ASN A 15 -13.674 -6.138 -10.857 1.00 0.00 C ATOM 249 OD1 ASN A 15 -13.067 -6.319 -11.894 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.695 -5.324 -10.834 1.00 0.00 N ATOM 0 H ASN A 15 -10.965 -7.795 -7.778 1.00 0.00 H new ATOM 0 HA ASN A 15 -11.597 -7.582 -10.660 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -13.851 -7.755 -9.433 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -13.439 -6.214 -8.709 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -14.982 -4.841 -11.686 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -15.206 -5.171 -9.964 1.00 0.00 H new ATOM 257 N ASN A 16 -10.978 -5.730 -8.044 1.00 0.00 N ATOM 258 CA ASN A 16 -10.185 -4.668 -7.452 1.00 0.00 C ATOM 259 C ASN A 16 -10.208 -4.961 -5.959 1.00 0.00 C ATOM 260 O ASN A 16 -10.323 -4.066 -5.145 1.00 0.00 O ATOM 261 CB ASN A 16 -10.825 -3.316 -7.756 1.00 0.00 C ATOM 262 CG ASN A 16 -10.049 -2.628 -8.879 1.00 0.00 C ATOM 263 OD1 ASN A 16 -9.313 -1.588 -8.606 1.00 0.00 O flip ATOM 264 ND2 ASN A 16 -10.116 -3.042 -10.020 1.00 0.00 N flip ATOM 0 H ASN A 16 -11.582 -6.214 -7.379 1.00 0.00 H new ATOM 0 HA ASN A 16 -9.167 -4.628 -7.840 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -11.866 -3.452 -8.049 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -10.824 -2.692 -6.863 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -10.692 -3.856 -10.234 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -9.596 -2.575 -10.763 1.00 0.00 H new ATOM 271 N GLU A 17 -10.147 -6.231 -5.579 1.00 0.00 N ATOM 272 CA GLU A 17 -10.223 -6.533 -4.122 1.00 0.00 C ATOM 273 C GLU A 17 -8.848 -6.426 -3.486 1.00 0.00 C ATOM 274 O GLU A 17 -8.142 -7.403 -3.329 1.00 0.00 O ATOM 275 CB GLU A 17 -10.806 -7.922 -3.884 1.00 0.00 C ATOM 276 CG GLU A 17 -12.216 -7.984 -4.470 1.00 0.00 C ATOM 277 CD GLU A 17 -12.916 -9.260 -3.995 1.00 0.00 C ATOM 278 OE1 GLU A 17 -12.251 -10.091 -3.398 1.00 0.00 O ATOM 279 OE2 GLU A 17 -14.106 -9.384 -4.237 1.00 0.00 O ATOM 0 H GLU A 17 -10.051 -7.035 -6.199 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.883 -5.800 -3.659 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -10.173 -8.679 -4.347 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.833 -8.140 -2.816 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.787 -7.108 -4.162 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.169 -7.967 -5.559 1.00 0.00 H new ATOM 286 N ILE A 18 -8.464 -5.236 -3.117 1.00 0.00 N ATOM 287 CA ILE A 18 -7.131 -5.040 -2.488 1.00 0.00 C ATOM 288 C ILE A 18 -7.183 -5.450 -1.022 1.00 0.00 C ATOM 289 O ILE A 18 -8.208 -5.368 -0.378 1.00 0.00 O ATOM 290 CB ILE A 18 -6.741 -3.556 -2.543 1.00 0.00 C ATOM 291 CG1 ILE A 18 -7.980 -2.695 -2.200 1.00 0.00 C ATOM 292 CG2 ILE A 18 -6.166 -3.208 -3.923 1.00 0.00 C ATOM 293 CD1 ILE A 18 -8.577 -2.033 -3.450 1.00 0.00 C ATOM 0 H ILE A 18 -9.020 -4.388 -3.225 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.405 -5.647 -3.029 1.00 0.00 H new ATOM 0 HB ILE A 18 -5.963 -3.346 -1.809 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.736 -3.319 -1.723 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -7.700 -1.926 -1.480 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.894 -2.153 -3.948 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.281 -3.816 -4.112 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.914 -3.408 -4.690 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -9.445 -1.437 -3.167 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -7.830 -1.388 -3.912 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -8.881 -2.803 -4.159 1.00 0.00 H new ATOM 305 N PHE A 19 -6.061 -5.837 -0.486 1.00 0.00 N ATOM 306 CA PHE A 19 -5.981 -6.197 0.959 1.00 0.00 C ATOM 307 C PHE A 19 -5.806 -4.883 1.737 1.00 0.00 C ATOM 308 O PHE A 19 -4.980 -4.776 2.621 1.00 0.00 O ATOM 309 CB PHE A 19 -4.754 -7.092 1.176 1.00 0.00 C ATOM 310 CG PHE A 19 -4.847 -7.813 2.501 1.00 0.00 C ATOM 311 CD1 PHE A 19 -6.036 -8.449 2.879 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.734 -7.855 3.350 1.00 0.00 C ATOM 313 CE1 PHE A 19 -6.110 -9.124 4.104 1.00 0.00 C ATOM 314 CE2 PHE A 19 -3.810 -8.530 4.575 1.00 0.00 C ATOM 315 CZ PHE A 19 -4.998 -9.164 4.952 1.00 0.00 C ATOM 0 H PHE A 19 -5.181 -5.921 -0.995 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.872 -6.729 1.292 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.679 -7.817 0.366 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.847 -6.488 1.148 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.896 -8.419 2.226 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.816 -7.366 3.060 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.027 -9.615 4.395 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.951 -8.561 5.229 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.057 -9.684 5.897 1.00 0.00 H new ATOM 325 N ILE A 20 -6.542 -3.865 1.366 1.00 0.00 N ATOM 326 CA ILE A 20 -6.387 -2.539 2.018 1.00 0.00 C ATOM 327 C ILE A 20 -7.125 -2.474 3.340 1.00 0.00 C ATOM 328 O ILE A 20 -8.169 -3.063 3.536 1.00 0.00 O ATOM 329 CB ILE A 20 -6.943 -1.455 1.096 1.00 0.00 C ATOM 330 CG1 ILE A 20 -6.826 -0.074 1.753 1.00 0.00 C ATOM 331 CG2 ILE A 20 -8.415 -1.743 0.826 1.00 0.00 C ATOM 332 CD1 ILE A 20 -5.373 0.205 2.150 1.00 0.00 C ATOM 0 H ILE A 20 -7.249 -3.902 0.632 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.325 -2.383 2.207 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.372 -1.457 0.168 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -7.176 0.695 1.064 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.466 -0.028 2.634 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -8.821 -0.975 0.168 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.513 -2.718 0.349 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -8.964 -1.743 1.767 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.305 1.189 2.615 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.037 -0.554 2.856 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.742 0.179 1.262 1.00 0.00 H new ATOM 344 N THR A 21 -6.590 -1.706 4.227 1.00 0.00 N ATOM 345 CA THR A 21 -7.227 -1.517 5.555 1.00 0.00 C ATOM 346 C THR A 21 -8.629 -0.968 5.327 1.00 0.00 C ATOM 347 O THR A 21 -8.835 0.228 5.261 1.00 0.00 O ATOM 348 CB THR A 21 -6.403 -0.516 6.364 1.00 0.00 C ATOM 349 OG1 THR A 21 -7.203 0.022 7.408 1.00 0.00 O ATOM 350 CG2 THR A 21 -5.925 0.611 5.447 1.00 0.00 C ATOM 0 H THR A 21 -5.722 -1.188 4.092 1.00 0.00 H new ATOM 0 HA THR A 21 -7.277 -2.459 6.101 1.00 0.00 H new ATOM 0 HB THR A 21 -5.538 -1.020 6.796 1.00 0.00 H new ATOM 0 HG1 THR A 21 -6.674 0.663 7.928 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.337 1.325 6.024 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.309 0.195 4.649 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.787 1.117 5.013 1.00 0.00 H new ATOM 358 N ARG A 22 -9.594 -1.829 5.180 1.00 0.00 N ATOM 359 CA ARG A 22 -10.972 -1.346 4.927 1.00 0.00 C ATOM 360 C ARG A 22 -11.753 -1.314 6.233 1.00 0.00 C ATOM 361 O ARG A 22 -12.363 -2.291 6.612 1.00 0.00 O ATOM 362 CB ARG A 22 -11.664 -2.286 3.944 1.00 0.00 C ATOM 363 CG ARG A 22 -13.034 -1.715 3.590 1.00 0.00 C ATOM 364 CD ARG A 22 -12.845 -0.415 2.815 1.00 0.00 C ATOM 365 NE ARG A 22 -14.180 0.171 2.513 1.00 0.00 N ATOM 366 CZ ARG A 22 -14.269 1.380 2.039 1.00 0.00 C ATOM 367 NH1 ARG A 22 -13.696 1.672 0.907 1.00 0.00 N ATOM 368 NH2 ARG A 22 -14.920 2.298 2.695 1.00 0.00 N ATOM 0 H ARG A 22 -9.486 -2.842 5.224 1.00 0.00 H new ATOM 0 HA ARG A 22 -10.932 -0.341 4.507 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.060 -2.400 3.044 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -11.772 -3.278 4.384 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -13.597 -2.431 2.992 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -13.611 -1.532 4.496 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.249 0.287 3.398 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.300 -0.604 1.890 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.025 -0.375 2.678 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.181 0.955 0.396 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -13.762 2.618 0.531 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -15.363 2.071 3.585 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -14.986 3.244 2.319 1.00 0.00 H new ATOM 382 N ARG A 23 -11.732 -0.182 6.903 1.00 0.00 N ATOM 383 CA ARG A 23 -12.470 -0.017 8.210 1.00 0.00 C ATOM 384 C ARG A 23 -12.911 -1.375 8.766 1.00 0.00 C ATOM 385 O ARG A 23 -14.048 -1.778 8.622 1.00 0.00 O ATOM 386 CB ARG A 23 -13.708 0.877 8.019 1.00 0.00 C ATOM 387 CG ARG A 23 -13.998 1.111 6.530 1.00 0.00 C ATOM 388 CD ARG A 23 -15.512 1.144 6.306 1.00 0.00 C ATOM 389 NE ARG A 23 -15.939 -0.151 5.708 1.00 0.00 N ATOM 390 CZ ARG A 23 -17.201 -0.482 5.690 1.00 0.00 C ATOM 391 NH1 ARG A 23 -18.117 0.424 5.889 1.00 0.00 N ATOM 392 NH2 ARG A 23 -17.544 -1.722 5.466 1.00 0.00 N ATOM 0 H ARG A 23 -11.227 0.650 6.597 1.00 0.00 H new ATOM 0 HA ARG A 23 -11.788 0.452 8.919 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.573 0.412 8.492 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -13.549 1.834 8.516 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -13.551 2.050 6.204 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -13.548 0.319 5.932 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.029 1.312 7.251 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -15.778 1.970 5.646 1.00 0.00 H new ATOM 0 HE ARG A 23 -15.243 -0.782 5.311 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -17.848 1.393 6.059 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.103 0.164 5.875 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -16.826 -2.429 5.306 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -18.530 -1.984 5.451 1.00 0.00 H new ATOM 406 N ALA A 24 -12.009 -2.089 9.382 1.00 0.00 N ATOM 407 CA ALA A 24 -12.358 -3.430 9.930 1.00 0.00 C ATOM 408 C ALA A 24 -13.738 -3.389 10.597 1.00 0.00 C ATOM 409 O ALA A 24 -14.622 -4.150 10.258 1.00 0.00 O ATOM 410 CB ALA A 24 -11.309 -3.846 10.964 1.00 0.00 C ATOM 0 H ALA A 24 -11.042 -1.800 9.530 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.380 -4.151 9.113 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -11.563 -4.827 11.366 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -10.329 -3.891 10.490 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -11.287 -3.117 11.774 1.00 0.00 H new ATOM 416 N ALA A 25 -13.930 -2.513 11.547 1.00 0.00 N ATOM 417 CA ALA A 25 -15.251 -2.437 12.233 1.00 0.00 C ATOM 418 C ALA A 25 -16.267 -1.768 11.309 1.00 0.00 C ATOM 419 O ALA A 25 -15.959 -1.406 10.191 1.00 0.00 O ATOM 420 CB ALA A 25 -15.114 -1.617 13.519 1.00 0.00 C ATOM 0 H ALA A 25 -13.230 -1.848 11.877 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.590 -3.443 12.479 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -16.080 -1.562 14.020 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.390 -2.094 14.179 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.774 -0.611 13.274 1.00 0.00 H new ATOM 426 N ASP A 26 -17.478 -1.603 11.763 1.00 0.00 N ATOM 427 CA ASP A 26 -18.505 -0.961 10.902 1.00 0.00 C ATOM 428 C ASP A 26 -18.308 0.554 10.915 1.00 0.00 C ATOM 429 O ASP A 26 -18.938 1.268 11.670 1.00 0.00 O ATOM 430 CB ASP A 26 -19.901 -1.298 11.429 1.00 0.00 C ATOM 431 CG ASP A 26 -20.485 -2.458 10.622 1.00 0.00 C ATOM 432 OD1 ASP A 26 -20.191 -3.594 10.957 1.00 0.00 O ATOM 433 OD2 ASP A 26 -21.214 -2.192 9.681 1.00 0.00 O ATOM 0 H ASP A 26 -17.798 -1.884 12.690 1.00 0.00 H new ATOM 0 HA ASP A 26 -18.404 -1.332 9.882 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -19.848 -1.566 12.484 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -20.550 -0.426 11.354 1.00 0.00 H new ATOM 438 N ALA A 27 -17.436 1.052 10.083 1.00 0.00 N ATOM 439 CA ALA A 27 -17.198 2.521 10.046 1.00 0.00 C ATOM 440 C ALA A 27 -18.394 3.210 9.396 1.00 0.00 C ATOM 441 O ALA A 27 -18.777 4.299 9.778 1.00 0.00 O ATOM 442 CB ALA A 27 -15.945 2.818 9.221 1.00 0.00 C ATOM 0 H ALA A 27 -16.878 0.505 9.427 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.063 2.890 11.063 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -15.773 3.894 9.195 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -15.086 2.324 9.674 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -16.082 2.448 8.205 1.00 0.00 H new ATOM 448 N HIS A 28 -18.975 2.596 8.403 1.00 0.00 N ATOM 449 CA HIS A 28 -20.128 3.236 7.719 1.00 0.00 C ATOM 450 C HIS A 28 -19.736 4.667 7.362 1.00 0.00 C ATOM 451 O HIS A 28 -20.573 5.533 7.194 1.00 0.00 O ATOM 452 CB HIS A 28 -21.341 3.249 8.653 1.00 0.00 C ATOM 453 CG HIS A 28 -22.562 2.815 7.892 1.00 0.00 C ATOM 454 ND1 HIS A 28 -23.043 1.516 7.948 1.00 0.00 N ATOM 455 CD2 HIS A 28 -23.410 3.493 7.051 1.00 0.00 C ATOM 456 CE1 HIS A 28 -24.131 1.453 7.161 1.00 0.00 C ATOM 457 NE2 HIS A 28 -24.400 2.631 6.589 1.00 0.00 N ATOM 0 H HIS A 28 -18.702 1.683 8.039 1.00 0.00 H new ATOM 0 HA HIS A 28 -20.387 2.681 6.818 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -21.170 2.583 9.498 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -21.489 4.249 9.060 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -23.322 4.537 6.788 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -24.717 0.559 7.009 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -25.165 2.851 5.952 1.00 0.00 H new ATOM 465 N MET A 29 -18.458 4.919 7.248 1.00 0.00 N ATOM 466 CA MET A 29 -17.989 6.288 6.909 1.00 0.00 C ATOM 467 C MET A 29 -17.262 6.249 5.567 1.00 0.00 C ATOM 468 O MET A 29 -17.315 7.182 4.791 1.00 0.00 O ATOM 469 CB MET A 29 -17.030 6.780 7.996 1.00 0.00 C ATOM 470 CG MET A 29 -17.798 7.636 9.004 1.00 0.00 C ATOM 471 SD MET A 29 -17.156 9.328 8.973 1.00 0.00 S ATOM 472 CE MET A 29 -15.822 9.086 10.172 1.00 0.00 C ATOM 0 H MET A 29 -17.718 4.229 7.377 1.00 0.00 H new ATOM 0 HA MET A 29 -18.841 6.965 6.845 1.00 0.00 H new ATOM 0 HB2 MET A 29 -16.569 5.931 8.501 1.00 0.00 H new ATOM 0 HB3 MET A 29 -16.224 7.361 7.549 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.861 7.635 8.763 1.00 0.00 H new ATOM 0 HG3 MET A 29 -17.698 7.216 10.005 1.00 0.00 H new ATOM 0 HE1 MET A 29 -15.282 10.023 10.309 1.00 0.00 H new ATOM 0 HE2 MET A 29 -16.243 8.767 11.125 1.00 0.00 H new ATOM 0 HE3 MET A 29 -15.136 8.323 9.804 1.00 0.00 H new ATOM 482 N ALA A 30 -16.583 5.173 5.290 1.00 0.00 N ATOM 483 CA ALA A 30 -15.852 5.060 4.002 1.00 0.00 C ATOM 484 C ALA A 30 -14.668 6.028 3.991 1.00 0.00 C ATOM 485 O ALA A 30 -14.402 6.708 4.961 1.00 0.00 O ATOM 486 CB ALA A 30 -16.796 5.396 2.852 1.00 0.00 C ATOM 0 H ALA A 30 -16.503 4.363 5.905 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.483 4.041 3.886 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.261 5.314 1.906 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.636 4.701 2.856 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.167 6.414 2.971 1.00 0.00 H new ATOM 492 N ASN A 31 -13.948 6.082 2.899 1.00 0.00 N ATOM 493 CA ASN A 31 -12.769 6.993 2.814 1.00 0.00 C ATOM 494 C ASN A 31 -11.580 6.360 3.541 1.00 0.00 C ATOM 495 O ASN A 31 -10.469 6.848 3.476 1.00 0.00 O ATOM 496 CB ASN A 31 -13.111 8.340 3.461 1.00 0.00 C ATOM 497 CG ASN A 31 -12.801 9.476 2.484 1.00 0.00 C ATOM 498 OD1 ASN A 31 -13.317 9.505 1.386 1.00 0.00 O ATOM 499 ND2 ASN A 31 -11.978 10.424 2.839 1.00 0.00 N ATOM 0 H ASN A 31 -14.128 5.531 2.060 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.510 7.152 1.767 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -14.165 8.364 3.738 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -12.537 8.470 4.378 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -11.770 11.187 2.194 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -11.543 10.403 3.761 1.00 0.00 H new ATOM 506 N LYS A 32 -11.808 5.279 4.236 1.00 0.00 N ATOM 507 CA LYS A 32 -10.704 4.602 4.970 1.00 0.00 C ATOM 508 C LYS A 32 -9.929 3.681 4.027 1.00 0.00 C ATOM 509 O LYS A 32 -9.716 2.520 4.320 1.00 0.00 O ATOM 510 CB LYS A 32 -11.295 3.780 6.107 1.00 0.00 C ATOM 511 CG LYS A 32 -10.291 3.702 7.253 1.00 0.00 C ATOM 512 CD LYS A 32 -10.214 2.266 7.758 1.00 0.00 C ATOM 513 CE LYS A 32 -9.391 2.211 9.047 1.00 0.00 C ATOM 514 NZ LYS A 32 -10.149 2.872 10.146 1.00 0.00 N ATOM 0 H LYS A 32 -12.721 4.833 4.327 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.022 5.354 5.367 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.224 4.233 6.453 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.541 2.778 5.756 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -9.309 4.034 6.915 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.592 4.368 8.061 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.217 1.881 7.940 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.761 1.628 6.999 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.176 1.175 9.310 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.432 2.709 8.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.801 2.528 11.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.016 3.902 10.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.160 2.648 10.054 1.00 0.00 H new ATOM 528 N LEU A 33 -9.499 4.178 2.906 1.00 0.00 N ATOM 529 CA LEU A 33 -8.732 3.319 1.961 1.00 0.00 C ATOM 530 C LEU A 33 -7.270 3.762 2.001 1.00 0.00 C ATOM 531 O LEU A 33 -6.841 4.578 1.223 1.00 0.00 O ATOM 532 CB LEU A 33 -9.307 3.491 0.540 1.00 0.00 C ATOM 533 CG LEU A 33 -10.620 2.727 0.432 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.058 2.709 -1.029 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.423 1.290 0.918 1.00 0.00 C ATOM 0 H LEU A 33 -9.644 5.140 2.601 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.806 2.268 2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.469 4.547 0.326 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.596 3.122 -0.199 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.379 3.212 1.046 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.998 2.164 -1.120 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.195 3.732 -1.380 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.294 2.218 -1.632 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.365 0.747 0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.668 0.799 0.304 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.096 1.299 1.958 1.00 0.00 H new ATOM 547 N GLU A 34 -6.498 3.255 2.913 1.00 0.00 N ATOM 548 CA GLU A 34 -5.077 3.694 2.981 1.00 0.00 C ATOM 549 C GLU A 34 -4.227 2.827 2.052 1.00 0.00 C ATOM 550 O GLU A 34 -4.618 2.540 0.939 1.00 0.00 O ATOM 551 CB GLU A 34 -4.572 3.579 4.420 1.00 0.00 C ATOM 552 CG GLU A 34 -3.417 4.562 4.625 1.00 0.00 C ATOM 553 CD GLU A 34 -2.318 3.893 5.453 1.00 0.00 C ATOM 554 OE1 GLU A 34 -2.654 3.147 6.356 1.00 0.00 O ATOM 555 OE2 GLU A 34 -1.157 4.140 5.169 1.00 0.00 O ATOM 0 H GLU A 34 -6.781 2.564 3.608 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.001 4.734 2.662 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.379 3.795 5.120 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.240 2.561 4.622 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.019 4.878 3.661 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.774 5.459 5.132 1.00 0.00 H new ATOM 562 N PHE A 35 -3.067 2.411 2.487 1.00 0.00 N ATOM 563 CA PHE A 35 -2.212 1.568 1.611 1.00 0.00 C ATOM 564 C PHE A 35 -1.303 0.688 2.474 1.00 0.00 C ATOM 565 O PHE A 35 -0.589 1.189 3.322 1.00 0.00 O ATOM 566 CB PHE A 35 -1.352 2.468 0.722 1.00 0.00 C ATOM 567 CG PHE A 35 -2.197 3.586 0.168 1.00 0.00 C ATOM 568 CD1 PHE A 35 -2.356 4.771 0.897 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.825 3.439 -1.074 1.00 0.00 C ATOM 570 CE1 PHE A 35 -3.141 5.809 0.383 1.00 0.00 C ATOM 571 CE2 PHE A 35 -3.612 4.477 -1.588 1.00 0.00 C ATOM 572 CZ PHE A 35 -3.769 5.662 -0.860 1.00 0.00 C ATOM 0 H PHE A 35 -2.679 2.619 3.407 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.844 0.935 0.988 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.521 2.877 1.297 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.921 1.886 -0.093 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.873 4.884 1.856 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.703 2.525 -1.636 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -3.263 6.723 0.945 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -4.098 4.363 -2.546 1.00 0.00 H new ATOM 0 HZ PHE A 35 -4.375 6.463 -1.257 1.00 0.00 H new ATOM 582 N PRO A 36 -1.342 -0.596 2.224 1.00 0.00 N ATOM 583 CA PRO A 36 -0.509 -1.560 2.961 1.00 0.00 C ATOM 584 C PRO A 36 0.959 -1.285 2.630 1.00 0.00 C ATOM 585 O PRO A 36 1.487 -1.821 1.683 1.00 0.00 O ATOM 586 CB PRO A 36 -0.939 -2.931 2.420 1.00 0.00 C ATOM 587 CG PRO A 36 -1.889 -2.687 1.220 1.00 0.00 C ATOM 588 CD PRO A 36 -2.211 -1.190 1.190 1.00 0.00 C ATOM 0 HA PRO A 36 -0.624 -1.501 4.043 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.069 -3.509 2.108 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.443 -3.507 3.196 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.417 -2.997 0.288 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.801 -3.274 1.327 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.008 -0.761 0.209 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.264 -1.008 1.406 1.00 0.00 H new ATOM 596 N GLY A 37 1.609 -0.428 3.375 1.00 0.00 N ATOM 597 CA GLY A 37 3.030 -0.096 3.054 1.00 0.00 C ATOM 598 C GLY A 37 3.977 -0.549 4.166 1.00 0.00 C ATOM 599 O GLY A 37 4.031 0.041 5.228 1.00 0.00 O ATOM 0 H GLY A 37 1.221 0.053 4.186 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.313 -0.574 2.116 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.129 0.979 2.906 1.00 0.00 H new ATOM 603 N GLY A 38 4.732 -1.590 3.921 1.00 0.00 N ATOM 604 CA GLY A 38 5.683 -2.093 4.950 1.00 0.00 C ATOM 605 C GLY A 38 6.988 -1.286 4.940 1.00 0.00 C ATOM 606 O GLY A 38 7.979 -1.717 5.496 1.00 0.00 O ATOM 0 H GLY A 38 4.728 -2.114 3.046 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.222 -2.032 5.936 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.901 -3.145 4.764 1.00 0.00 H new ATOM 610 N LYS A 39 6.993 -0.120 4.336 1.00 0.00 N ATOM 611 CA LYS A 39 8.231 0.722 4.314 1.00 0.00 C ATOM 612 C LYS A 39 9.358 0.022 3.543 1.00 0.00 C ATOM 613 O LYS A 39 9.945 -0.926 4.020 1.00 0.00 O ATOM 614 CB LYS A 39 8.690 0.983 5.752 1.00 0.00 C ATOM 615 CG LYS A 39 10.066 1.654 5.739 1.00 0.00 C ATOM 616 CD LYS A 39 9.928 3.097 5.264 1.00 0.00 C ATOM 617 CE LYS A 39 11.094 3.446 4.332 1.00 0.00 C ATOM 618 NZ LYS A 39 12.389 3.083 4.982 1.00 0.00 N ATOM 0 H LYS A 39 6.189 0.285 3.856 1.00 0.00 H new ATOM 0 HA LYS A 39 8.001 1.663 3.814 1.00 0.00 H new ATOM 0 HB2 LYS A 39 7.969 1.620 6.265 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.737 0.045 6.305 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.503 1.629 6.737 1.00 0.00 H new ATOM 0 HG3 LYS A 39 10.742 1.107 5.082 1.00 0.00 H new ATOM 0 HD2 LYS A 39 8.980 3.230 4.742 1.00 0.00 H new ATOM 0 HD3 LYS A 39 9.918 3.773 6.119 1.00 0.00 H new ATOM 0 HE2 LYS A 39 10.989 2.912 3.388 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.079 4.511 4.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.157 3.145 4.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.580 3.739 5.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.333 2.112 5.349 1.00 0.00 H new ATOM 632 N ILE A 40 9.690 0.498 2.367 1.00 0.00 N ATOM 633 CA ILE A 40 10.805 -0.140 1.597 1.00 0.00 C ATOM 634 C ILE A 40 12.139 0.369 2.139 1.00 0.00 C ATOM 635 O ILE A 40 12.299 1.536 2.433 1.00 0.00 O ATOM 636 CB ILE A 40 10.696 0.174 0.087 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.100 0.181 -0.568 1.00 0.00 C ATOM 638 CG2 ILE A 40 10.009 1.527 -0.139 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.701 1.593 -0.558 1.00 0.00 C ATOM 0 H ILE A 40 9.243 1.293 1.910 1.00 0.00 H new ATOM 0 HA ILE A 40 10.739 -1.221 1.718 1.00 0.00 H new ATOM 0 HB ILE A 40 10.092 -0.606 -0.377 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.759 -0.503 -0.033 1.00 0.00 H new ATOM 0 HG13 ILE A 40 12.029 -0.181 -1.594 1.00 0.00 H new ATOM 0 HG21 ILE A 40 9.943 1.727 -1.208 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.006 1.502 0.288 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.589 2.314 0.343 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.687 1.572 -1.023 1.00 0.00 H new ATOM 0 HD12 ILE A 40 12.051 2.269 -1.114 1.00 0.00 H new ATOM 0 HD13 ILE A 40 12.792 1.942 0.470 1.00 0.00 H new ATOM 651 N GLU A 41 13.097 -0.503 2.272 1.00 0.00 N ATOM 652 CA GLU A 41 14.420 -0.067 2.788 1.00 0.00 C ATOM 653 C GLU A 41 15.428 -1.215 2.674 1.00 0.00 C ATOM 654 O GLU A 41 16.604 -0.999 2.458 1.00 0.00 O ATOM 655 CB GLU A 41 14.266 0.360 4.244 1.00 0.00 C ATOM 656 CG GLU A 41 14.037 -0.871 5.122 1.00 0.00 C ATOM 657 CD GLU A 41 13.139 -0.495 6.302 1.00 0.00 C ATOM 658 OE1 GLU A 41 13.635 0.136 7.221 1.00 0.00 O ATOM 659 OE2 GLU A 41 11.970 -0.846 6.265 1.00 0.00 O ATOM 0 H GLU A 41 13.021 -1.495 2.046 1.00 0.00 H new ATOM 0 HA GLU A 41 14.788 0.774 2.200 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.159 0.892 4.573 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.428 1.050 4.344 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.574 -1.667 4.538 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.991 -1.255 5.485 1.00 0.00 H new ATOM 666 N MET A 42 14.980 -2.435 2.817 1.00 0.00 N ATOM 667 CA MET A 42 15.919 -3.592 2.716 1.00 0.00 C ATOM 668 C MET A 42 16.653 -3.539 1.374 1.00 0.00 C ATOM 669 O MET A 42 16.206 -2.911 0.435 1.00 0.00 O ATOM 670 CB MET A 42 15.133 -4.902 2.812 1.00 0.00 C ATOM 671 CG MET A 42 14.878 -5.245 4.280 1.00 0.00 C ATOM 672 SD MET A 42 13.727 -6.639 4.380 1.00 0.00 S ATOM 673 CE MET A 42 13.848 -6.912 6.165 1.00 0.00 C ATOM 0 H MET A 42 14.007 -2.680 2.999 1.00 0.00 H new ATOM 0 HA MET A 42 16.642 -3.541 3.530 1.00 0.00 H new ATOM 0 HB2 MET A 42 14.186 -4.808 2.281 1.00 0.00 H new ATOM 0 HB3 MET A 42 15.690 -5.707 2.332 1.00 0.00 H new ATOM 0 HG2 MET A 42 15.816 -5.497 4.774 1.00 0.00 H new ATOM 0 HG3 MET A 42 14.466 -4.381 4.801 1.00 0.00 H new ATOM 0 HE1 MET A 42 13.205 -7.745 6.450 1.00 0.00 H new ATOM 0 HE2 MET A 42 14.880 -7.144 6.428 1.00 0.00 H new ATOM 0 HE3 MET A 42 13.532 -6.012 6.693 1.00 0.00 H new ATOM 683 N GLY A 43 17.777 -4.197 1.273 1.00 0.00 N ATOM 684 CA GLY A 43 18.536 -4.182 -0.012 1.00 0.00 C ATOM 685 C GLY A 43 18.604 -2.753 -0.545 1.00 0.00 C ATOM 686 O GLY A 43 18.946 -1.828 0.164 1.00 0.00 O ATOM 0 H GLY A 43 18.202 -4.743 2.023 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.542 -4.572 0.143 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.051 -4.831 -0.741 1.00 0.00 H new ATOM 690 N GLU A 44 18.275 -2.568 -1.790 1.00 0.00 N ATOM 691 CA GLU A 44 18.308 -1.202 -2.377 1.00 0.00 C ATOM 692 C GLU A 44 17.476 -1.198 -3.659 1.00 0.00 C ATOM 693 O GLU A 44 17.676 -0.389 -4.544 1.00 0.00 O ATOM 694 CB GLU A 44 19.755 -0.807 -2.689 1.00 0.00 C ATOM 695 CG GLU A 44 20.284 -1.650 -3.852 1.00 0.00 C ATOM 696 CD GLU A 44 21.613 -2.296 -3.450 1.00 0.00 C ATOM 697 OE1 GLU A 44 22.555 -1.563 -3.198 1.00 0.00 O ATOM 698 OE2 GLU A 44 21.666 -3.514 -3.401 1.00 0.00 O ATOM 0 H GLU A 44 17.983 -3.307 -2.430 1.00 0.00 H new ATOM 0 HA GLU A 44 17.895 -0.483 -1.669 1.00 0.00 H new ATOM 0 HB2 GLU A 44 19.806 0.252 -2.943 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.380 -0.954 -1.808 1.00 0.00 H new ATOM 0 HG2 GLU A 44 19.559 -2.419 -4.117 1.00 0.00 H new ATOM 0 HG3 GLU A 44 20.423 -1.025 -4.734 1.00 0.00 H new ATOM 705 N THR A 45 16.542 -2.104 -3.762 1.00 0.00 N ATOM 706 CA THR A 45 15.687 -2.171 -4.976 1.00 0.00 C ATOM 707 C THR A 45 14.240 -2.396 -4.533 1.00 0.00 C ATOM 708 O THR A 45 14.003 -3.138 -3.614 1.00 0.00 O ATOM 709 CB THR A 45 16.163 -3.341 -5.843 1.00 0.00 C ATOM 710 OG1 THR A 45 17.563 -3.223 -6.058 1.00 0.00 O ATOM 711 CG2 THR A 45 15.441 -3.321 -7.192 1.00 0.00 C ATOM 0 H THR A 45 16.335 -2.805 -3.050 1.00 0.00 H new ATOM 0 HA THR A 45 15.751 -1.248 -5.552 1.00 0.00 H new ATOM 0 HB THR A 45 15.942 -4.279 -5.334 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.873 -3.970 -6.611 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.786 -4.156 -7.802 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.367 -3.408 -7.031 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.656 -2.384 -7.706 1.00 0.00 H new ATOM 719 N PRO A 46 13.313 -1.753 -5.195 1.00 0.00 N ATOM 720 CA PRO A 46 11.881 -1.891 -4.862 1.00 0.00 C ATOM 721 C PRO A 46 11.509 -3.368 -4.771 1.00 0.00 C ATOM 722 O PRO A 46 10.531 -3.731 -4.153 1.00 0.00 O ATOM 723 CB PRO A 46 11.149 -1.199 -6.015 1.00 0.00 C ATOM 724 CG PRO A 46 12.217 -0.488 -6.888 1.00 0.00 C ATOM 725 CD PRO A 46 13.602 -0.855 -6.325 1.00 0.00 C ATOM 0 HA PRO A 46 11.622 -1.449 -3.900 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.593 -1.926 -6.607 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.426 -0.479 -5.632 1.00 0.00 H new ATOM 0 HG2 PRO A 46 12.132 -0.802 -7.928 1.00 0.00 H new ATOM 0 HG3 PRO A 46 12.070 0.592 -6.868 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.218 -1.348 -7.077 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.146 0.032 -5.999 1.00 0.00 H new ATOM 733 N GLU A 47 12.293 -4.224 -5.363 1.00 0.00 N ATOM 734 CA GLU A 47 11.994 -5.675 -5.287 1.00 0.00 C ATOM 735 C GLU A 47 12.379 -6.184 -3.899 1.00 0.00 C ATOM 736 O GLU A 47 11.575 -6.217 -3.006 1.00 0.00 O ATOM 737 CB GLU A 47 12.810 -6.424 -6.343 1.00 0.00 C ATOM 738 CG GLU A 47 11.906 -6.815 -7.512 1.00 0.00 C ATOM 739 CD GLU A 47 12.756 -7.012 -8.768 1.00 0.00 C ATOM 740 OE1 GLU A 47 13.718 -7.758 -8.698 1.00 0.00 O ATOM 741 OE2 GLU A 47 12.432 -6.412 -9.779 1.00 0.00 O ATOM 0 H GLU A 47 13.128 -3.979 -5.896 1.00 0.00 H new ATOM 0 HA GLU A 47 10.932 -5.842 -5.467 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.628 -5.796 -6.697 1.00 0.00 H new ATOM 0 HB3 GLU A 47 13.259 -7.315 -5.905 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.366 -7.732 -7.277 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.159 -6.040 -7.683 1.00 0.00 H new ATOM 748 N GLN A 48 13.605 -6.577 -3.708 1.00 0.00 N ATOM 749 CA GLN A 48 14.023 -7.086 -2.367 1.00 0.00 C ATOM 750 C GLN A 48 13.425 -6.220 -1.268 1.00 0.00 C ATOM 751 O GLN A 48 13.120 -6.689 -0.197 1.00 0.00 O ATOM 752 CB GLN A 48 15.545 -7.048 -2.240 1.00 0.00 C ATOM 753 CG GLN A 48 16.147 -8.236 -2.989 1.00 0.00 C ATOM 754 CD GLN A 48 17.664 -8.250 -2.792 1.00 0.00 C ATOM 755 OE1 GLN A 48 18.400 -7.754 -3.621 1.00 0.00 O ATOM 756 NE2 GLN A 48 18.166 -8.803 -1.721 1.00 0.00 N ATOM 0 H GLN A 48 14.337 -6.569 -4.418 1.00 0.00 H new ATOM 0 HA GLN A 48 13.668 -8.112 -2.266 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.932 -6.114 -2.647 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.834 -7.082 -1.190 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.714 -9.167 -2.623 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.908 -8.169 -4.050 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.548 -9.220 -1.025 1.00 0.00 H new ATOM 0 HE22 GLN A 48 19.176 -8.818 -1.581 1.00 0.00 H new ATOM 765 N ALA A 49 13.267 -4.962 -1.513 1.00 0.00 N ATOM 766 CA ALA A 49 12.698 -4.080 -0.467 1.00 0.00 C ATOM 767 C ALA A 49 11.241 -4.452 -0.219 1.00 0.00 C ATOM 768 O ALA A 49 10.876 -4.857 0.852 1.00 0.00 O ATOM 769 CB ALA A 49 12.767 -2.627 -0.922 1.00 0.00 C ATOM 0 H ALA A 49 13.506 -4.502 -2.391 1.00 0.00 H new ATOM 0 HA ALA A 49 13.272 -4.204 0.451 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.347 -1.983 -0.149 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.806 -2.350 -1.100 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.197 -2.507 -1.843 1.00 0.00 H new ATOM 775 N VAL A 50 10.407 -4.303 -1.202 1.00 0.00 N ATOM 776 CA VAL A 50 8.963 -4.623 -1.016 1.00 0.00 C ATOM 777 C VAL A 50 8.767 -6.129 -0.790 1.00 0.00 C ATOM 778 O VAL A 50 8.092 -6.546 0.127 1.00 0.00 O ATOM 779 CB VAL A 50 8.207 -4.154 -2.261 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.303 -5.199 -3.375 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.740 -3.919 -1.917 1.00 0.00 C ATOM 0 H VAL A 50 10.660 -3.972 -2.133 1.00 0.00 H new ATOM 0 HA VAL A 50 8.577 -4.111 -0.135 1.00 0.00 H new ATOM 0 HB VAL A 50 8.658 -3.224 -2.608 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.759 -4.847 -4.252 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.349 -5.357 -3.636 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.869 -6.138 -3.031 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.207 -3.585 -2.807 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.298 -4.847 -1.556 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.666 -3.156 -1.142 1.00 0.00 H new ATOM 791 N VAL A 51 9.348 -6.933 -1.625 1.00 0.00 N ATOM 792 CA VAL A 51 9.217 -8.410 -1.496 1.00 0.00 C ATOM 793 C VAL A 51 9.704 -8.871 -0.112 1.00 0.00 C ATOM 794 O VAL A 51 9.070 -9.676 0.537 1.00 0.00 O ATOM 795 CB VAL A 51 10.057 -9.066 -2.594 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.530 -9.040 -2.198 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.613 -10.512 -2.792 1.00 0.00 C ATOM 0 H VAL A 51 9.922 -6.625 -2.410 1.00 0.00 H new ATOM 0 HA VAL A 51 8.171 -8.699 -1.601 1.00 0.00 H new ATOM 0 HB VAL A 51 9.919 -8.515 -3.524 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.126 -9.508 -2.982 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.853 -8.007 -2.064 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.665 -9.586 -1.264 1.00 0.00 H new ATOM 0 HG21 VAL A 51 10.215 -10.973 -3.575 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.744 -11.064 -1.861 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.562 -10.534 -3.082 1.00 0.00 H new ATOM 807 N ARG A 52 10.823 -8.369 0.344 1.00 0.00 N ATOM 808 CA ARG A 52 11.338 -8.784 1.682 1.00 0.00 C ATOM 809 C ARG A 52 10.452 -8.160 2.763 1.00 0.00 C ATOM 810 O ARG A 52 10.218 -8.741 3.804 1.00 0.00 O ATOM 811 CB ARG A 52 12.788 -8.314 1.849 1.00 0.00 C ATOM 812 CG ARG A 52 13.666 -8.983 0.788 1.00 0.00 C ATOM 813 CD ARG A 52 14.423 -10.153 1.418 1.00 0.00 C ATOM 814 NE ARG A 52 15.131 -10.921 0.356 1.00 0.00 N ATOM 815 CZ ARG A 52 16.084 -11.754 0.676 1.00 0.00 C ATOM 816 NH1 ARG A 52 17.257 -11.301 1.022 1.00 0.00 N ATOM 817 NH2 ARG A 52 15.862 -13.040 0.649 1.00 0.00 N ATOM 0 H ARG A 52 11.401 -7.691 -0.152 1.00 0.00 H new ATOM 0 HA ARG A 52 11.314 -9.870 1.771 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.844 -7.230 1.752 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.150 -8.564 2.846 1.00 0.00 H new ATOM 0 HG2 ARG A 52 13.050 -9.337 -0.039 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.370 -8.261 0.375 1.00 0.00 H new ATOM 0 HD2 ARG A 52 15.139 -9.783 2.152 1.00 0.00 H new ATOM 0 HD3 ARG A 52 13.729 -10.804 1.950 1.00 0.00 H new ATOM 0 HE ARG A 52 14.871 -10.796 -0.622 1.00 0.00 H new ATOM 0 HH11 ARG A 52 17.430 -10.296 1.043 1.00 0.00 H new ATOM 0 HH12 ARG A 52 18.002 -11.952 1.272 1.00 0.00 H new ATOM 0 HH21 ARG A 52 14.944 -13.394 0.378 1.00 0.00 H new ATOM 0 HH22 ARG A 52 16.606 -13.691 0.899 1.00 0.00 H new ATOM 831 N GLU A 53 9.925 -6.994 2.501 1.00 0.00 N ATOM 832 CA GLU A 53 9.015 -6.344 3.485 1.00 0.00 C ATOM 833 C GLU A 53 7.673 -7.064 3.418 1.00 0.00 C ATOM 834 O GLU A 53 6.835 -6.948 4.289 1.00 0.00 O ATOM 835 CB GLU A 53 8.820 -4.872 3.125 1.00 0.00 C ATOM 836 CG GLU A 53 10.174 -4.172 3.121 1.00 0.00 C ATOM 837 CD GLU A 53 10.360 -3.400 4.426 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.503 -3.516 5.285 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.359 -2.709 4.545 1.00 0.00 O ATOM 0 H GLU A 53 10.087 -6.463 1.645 1.00 0.00 H new ATOM 0 HA GLU A 53 9.438 -6.402 4.488 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.349 -4.784 2.146 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.153 -4.395 3.843 1.00 0.00 H new ATOM 0 HG2 GLU A 53 10.972 -4.905 3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.239 -3.491 2.272 1.00 0.00 H new ATOM 846 N LEU A 54 7.481 -7.811 2.370 1.00 0.00 N ATOM 847 CA LEU A 54 6.223 -8.565 2.183 1.00 0.00 C ATOM 848 C LEU A 54 6.276 -9.836 3.025 1.00 0.00 C ATOM 849 O LEU A 54 5.489 -10.038 3.927 1.00 0.00 O ATOM 850 CB LEU A 54 6.109 -8.929 0.701 1.00 0.00 C ATOM 851 CG LEU A 54 4.984 -8.128 0.051 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.712 -8.255 0.884 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.387 -6.656 -0.032 1.00 0.00 C ATOM 0 H LEU A 54 8.162 -7.930 1.620 1.00 0.00 H new ATOM 0 HA LEU A 54 5.363 -7.970 2.491 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.052 -8.724 0.194 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.915 -9.996 0.594 1.00 0.00 H new ATOM 0 HG LEU A 54 4.802 -8.516 -0.951 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.912 -7.682 0.416 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.420 -9.303 0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.894 -7.871 1.888 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.583 -6.084 -0.496 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.572 -6.272 0.971 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.293 -6.560 -0.630 1.00 0.00 H new ATOM 865 N GLN A 55 7.207 -10.692 2.724 1.00 0.00 N ATOM 866 CA GLN A 55 7.339 -11.964 3.494 1.00 0.00 C ATOM 867 C GLN A 55 7.537 -11.650 4.978 1.00 0.00 C ATOM 868 O GLN A 55 6.840 -12.171 5.826 1.00 0.00 O ATOM 869 CB GLN A 55 8.535 -12.788 2.987 1.00 0.00 C ATOM 870 CG GLN A 55 9.496 -11.911 2.173 1.00 0.00 C ATOM 871 CD GLN A 55 10.897 -12.524 2.199 1.00 0.00 C ATOM 872 OE1 GLN A 55 11.881 -11.817 2.288 1.00 0.00 O ATOM 873 NE2 GLN A 55 11.031 -13.819 2.123 1.00 0.00 N ATOM 0 H GLN A 55 7.888 -10.568 1.975 1.00 0.00 H new ATOM 0 HA GLN A 55 6.427 -12.545 3.355 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.064 -13.227 3.833 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.178 -13.613 2.371 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.144 -11.826 1.145 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.522 -10.902 2.585 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.206 -14.414 2.048 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.961 -14.237 2.138 1.00 0.00 H new ATOM 882 N GLU A 56 8.479 -10.807 5.309 1.00 0.00 N ATOM 883 CA GLU A 56 8.696 -10.486 6.747 1.00 0.00 C ATOM 884 C GLU A 56 7.345 -10.187 7.396 1.00 0.00 C ATOM 885 O GLU A 56 7.161 -10.364 8.584 1.00 0.00 O ATOM 886 CB GLU A 56 9.627 -9.273 6.892 1.00 0.00 C ATOM 887 CG GLU A 56 9.131 -8.105 6.042 1.00 0.00 C ATOM 888 CD GLU A 56 8.199 -7.208 6.869 1.00 0.00 C ATOM 889 OE1 GLU A 56 7.661 -7.692 7.851 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.044 -6.046 6.509 1.00 0.00 O ATOM 0 H GLU A 56 9.100 -10.333 4.654 1.00 0.00 H new ATOM 0 HA GLU A 56 9.164 -11.337 7.241 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.679 -8.971 7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.638 -9.546 6.589 1.00 0.00 H new ATOM 0 HG2 GLU A 56 9.979 -7.524 5.678 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.603 -8.481 5.166 1.00 0.00 H new ATOM 897 N GLU A 57 6.395 -9.742 6.621 1.00 0.00 N ATOM 898 CA GLU A 57 5.053 -9.441 7.185 1.00 0.00 C ATOM 899 C GLU A 57 4.263 -10.744 7.340 1.00 0.00 C ATOM 900 O GLU A 57 4.382 -11.443 8.327 1.00 0.00 O ATOM 901 CB GLU A 57 4.308 -8.481 6.249 1.00 0.00 C ATOM 902 CG GLU A 57 4.479 -7.049 6.757 1.00 0.00 C ATOM 903 CD GLU A 57 4.793 -6.107 5.591 1.00 0.00 C ATOM 904 OE1 GLU A 57 4.459 -6.452 4.469 1.00 0.00 O ATOM 905 OE2 GLU A 57 5.364 -5.052 5.842 1.00 0.00 O ATOM 0 H GLU A 57 6.492 -9.574 5.620 1.00 0.00 H new ATOM 0 HA GLU A 57 5.162 -8.971 8.162 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.697 -8.568 5.234 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.250 -8.741 6.209 1.00 0.00 H new ATOM 0 HG2 GLU A 57 3.569 -6.724 7.262 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.283 -7.010 7.492 1.00 0.00 H new ATOM 912 N VAL A 58 3.452 -11.070 6.373 1.00 0.00 N ATOM 913 CA VAL A 58 2.642 -12.315 6.446 1.00 0.00 C ATOM 914 C VAL A 58 3.494 -13.528 6.056 1.00 0.00 C ATOM 915 O VAL A 58 3.961 -14.263 6.904 1.00 0.00 O ATOM 916 CB VAL A 58 1.480 -12.164 5.482 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.520 -13.339 5.619 1.00 0.00 C ATOM 918 CG2 VAL A 58 0.753 -10.854 5.791 1.00 0.00 C ATOM 0 H VAL A 58 3.315 -10.519 5.525 1.00 0.00 H new ATOM 0 HA VAL A 58 2.280 -12.472 7.462 1.00 0.00 H new ATOM 0 HB VAL A 58 1.855 -12.148 4.459 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.308 -13.216 4.921 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.047 -14.267 5.397 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.133 -13.376 6.637 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.085 -10.733 5.105 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.383 -10.876 6.816 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.443 -10.018 5.673 1.00 0.00 H new ATOM 928 N GLY A 59 3.707 -13.748 4.782 1.00 0.00 N ATOM 929 CA GLY A 59 4.536 -14.918 4.370 1.00 0.00 C ATOM 930 C GLY A 59 3.927 -15.632 3.154 1.00 0.00 C ATOM 931 O GLY A 59 4.063 -16.830 3.006 1.00 0.00 O ATOM 0 H GLY A 59 3.347 -13.175 4.019 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.546 -14.585 4.131 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.620 -15.618 5.201 1.00 0.00 H new ATOM 935 N ILE A 60 3.277 -14.921 2.268 1.00 0.00 N ATOM 936 CA ILE A 60 2.702 -15.598 1.066 1.00 0.00 C ATOM 937 C ILE A 60 3.752 -15.567 -0.052 1.00 0.00 C ATOM 938 O ILE A 60 4.936 -15.546 0.220 1.00 0.00 O ATOM 939 CB ILE A 60 1.424 -14.887 0.620 1.00 0.00 C ATOM 940 CG1 ILE A 60 1.774 -13.521 0.050 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.498 -14.704 1.822 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.425 -13.475 -1.436 1.00 0.00 C ATOM 0 H ILE A 60 3.121 -13.915 2.323 1.00 0.00 H new ATOM 0 HA ILE A 60 2.445 -16.630 1.304 1.00 0.00 H new ATOM 0 HB ILE A 60 0.926 -15.486 -0.142 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.229 -12.743 0.585 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.836 -13.320 0.190 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.414 -14.197 1.505 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.245 -15.679 2.238 1.00 0.00 H new ATOM 0 HG23 ILE A 60 1.001 -14.105 2.581 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.678 -12.494 -1.839 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.990 -14.242 -1.966 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.358 -13.656 -1.565 1.00 0.00 H new ATOM 954 N THR A 61 3.360 -15.573 -1.302 1.00 0.00 N ATOM 955 CA THR A 61 4.407 -15.554 -2.369 1.00 0.00 C ATOM 956 C THR A 61 3.848 -15.127 -3.748 1.00 0.00 C ATOM 957 O THR A 61 4.279 -14.129 -4.290 1.00 0.00 O ATOM 958 CB THR A 61 5.058 -16.945 -2.448 1.00 0.00 C ATOM 959 OG1 THR A 61 6.051 -17.047 -1.437 1.00 0.00 O ATOM 960 CG2 THR A 61 5.710 -17.155 -3.816 1.00 0.00 C ATOM 0 H THR A 61 2.392 -15.590 -1.623 1.00 0.00 H new ATOM 0 HA THR A 61 5.152 -14.805 -2.102 1.00 0.00 H new ATOM 0 HB THR A 61 4.291 -17.706 -2.305 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.991 -16.272 -0.840 1.00 0.00 H new ATOM 0 HG21 THR A 61 6.166 -18.144 -3.854 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.953 -17.074 -4.596 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.477 -16.396 -3.974 1.00 0.00 H new ATOM 968 N PRO A 62 2.938 -15.904 -4.300 1.00 0.00 N ATOM 969 CA PRO A 62 2.358 -15.628 -5.638 1.00 0.00 C ATOM 970 C PRO A 62 1.723 -14.245 -5.777 1.00 0.00 C ATOM 971 O PRO A 62 1.196 -13.936 -6.820 1.00 0.00 O ATOM 972 CB PRO A 62 1.265 -16.678 -5.822 1.00 0.00 C ATOM 973 CG PRO A 62 1.279 -17.597 -4.590 1.00 0.00 C ATOM 974 CD PRO A 62 2.405 -17.117 -3.655 1.00 0.00 C ATOM 0 HA PRO A 62 3.155 -15.662 -6.381 1.00 0.00 H new ATOM 0 HB2 PRO A 62 0.291 -16.200 -5.930 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.439 -17.255 -6.730 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.317 -17.563 -4.078 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.446 -18.632 -4.888 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.025 -16.900 -2.657 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.178 -17.878 -3.543 1.00 0.00 H new ATOM 982 N GLN A 63 1.735 -13.419 -4.769 1.00 0.00 N ATOM 983 CA GLN A 63 1.092 -12.081 -4.916 1.00 0.00 C ATOM 984 C GLN A 63 1.369 -11.509 -6.309 1.00 0.00 C ATOM 985 O GLN A 63 0.598 -10.732 -6.825 1.00 0.00 O ATOM 986 CB GLN A 63 1.632 -11.119 -3.863 1.00 0.00 C ATOM 987 CG GLN A 63 3.154 -11.075 -3.934 1.00 0.00 C ATOM 988 CD GLN A 63 3.623 -9.648 -3.642 1.00 0.00 C ATOM 989 OE1 GLN A 63 3.190 -8.672 -4.383 1.00 0.00 O flip ATOM 990 NE2 GLN A 63 4.387 -9.417 -2.732 1.00 0.00 N flip ATOM 0 H GLN A 63 2.156 -13.607 -3.859 1.00 0.00 H new ATOM 0 HA GLN A 63 0.017 -12.201 -4.782 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.223 -10.122 -4.024 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.314 -11.437 -2.870 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.585 -11.769 -3.212 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.495 -11.389 -4.921 1.00 0.00 H new ATOM 0 HE21 GLN A 63 4.730 -10.180 -2.148 1.00 0.00 H new ATOM 0 HE22 GLN A 63 4.688 -8.460 -2.549 1.00 0.00 H new ATOM 999 N HIS A 64 2.458 -11.882 -6.930 1.00 0.00 N ATOM 1000 CA HIS A 64 2.746 -11.334 -8.285 1.00 0.00 C ATOM 1001 C HIS A 64 2.644 -9.814 -8.200 1.00 0.00 C ATOM 1002 O HIS A 64 1.588 -9.242 -8.383 1.00 0.00 O ATOM 1003 CB HIS A 64 1.715 -11.875 -9.282 1.00 0.00 C ATOM 1004 CG HIS A 64 2.225 -11.721 -10.692 1.00 0.00 C ATOM 1005 ND1 HIS A 64 3.573 -11.580 -10.988 1.00 0.00 N ATOM 1006 CD2 HIS A 64 1.572 -11.693 -11.900 1.00 0.00 C ATOM 1007 CE1 HIS A 64 3.685 -11.473 -12.325 1.00 0.00 C ATOM 1008 NE2 HIS A 64 2.496 -11.536 -12.929 1.00 0.00 N ATOM 0 H HIS A 64 3.151 -12.534 -6.562 1.00 0.00 H new ATOM 0 HA HIS A 64 3.741 -11.628 -8.621 1.00 0.00 H new ATOM 0 HB2 HIS A 64 1.513 -12.926 -9.073 1.00 0.00 H new ATOM 0 HB3 HIS A 64 0.772 -11.340 -9.168 1.00 0.00 H new ATOM 0 HD2 HIS A 64 0.504 -11.780 -12.031 1.00 0.00 H new ATOM 0 HE1 HIS A 64 4.623 -11.351 -12.846 1.00 0.00 H new ATOM 0 HE2 HIS A 64 2.306 -11.481 -13.930 1.00 0.00 H new ATOM 1016 N PHE A 65 3.723 -9.161 -7.878 1.00 0.00 N ATOM 1017 CA PHE A 65 3.674 -7.678 -7.726 1.00 0.00 C ATOM 1018 C PHE A 65 3.946 -6.961 -9.046 1.00 0.00 C ATOM 1019 O PHE A 65 4.528 -7.495 -9.968 1.00 0.00 O ATOM 1020 CB PHE A 65 4.699 -7.221 -6.681 1.00 0.00 C ATOM 1021 CG PHE A 65 5.903 -8.134 -6.681 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.543 -8.453 -7.884 1.00 0.00 C ATOM 1023 CD2 PHE A 65 6.381 -8.658 -5.473 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.659 -9.297 -7.880 1.00 0.00 C ATOM 1025 CE2 PHE A 65 7.498 -9.503 -5.470 1.00 0.00 C ATOM 1026 CZ PHE A 65 8.136 -9.823 -6.674 1.00 0.00 C ATOM 0 H PHE A 65 4.635 -9.586 -7.713 1.00 0.00 H new ATOM 0 HA PHE A 65 2.667 -7.419 -7.400 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.011 -6.199 -6.893 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.240 -7.215 -5.692 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.176 -8.048 -8.815 1.00 0.00 H new ATOM 0 HD2 PHE A 65 5.888 -8.411 -4.544 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.153 -9.543 -8.809 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.867 -9.907 -4.539 1.00 0.00 H new ATOM 0 HZ PHE A 65 8.996 -10.476 -6.672 1.00 0.00 H new ATOM 1036 N SER A 66 3.521 -5.730 -9.113 1.00 0.00 N ATOM 1037 CA SER A 66 3.728 -4.900 -10.328 1.00 0.00 C ATOM 1038 C SER A 66 3.745 -3.436 -9.886 1.00 0.00 C ATOM 1039 O SER A 66 3.007 -3.047 -9.010 1.00 0.00 O ATOM 1040 CB SER A 66 2.582 -5.132 -11.311 1.00 0.00 C ATOM 1041 OG SER A 66 3.099 -5.686 -12.514 1.00 0.00 O ATOM 0 H SER A 66 3.027 -5.256 -8.357 1.00 0.00 H new ATOM 0 HA SER A 66 4.664 -5.163 -10.821 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.844 -5.805 -10.875 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.071 -4.192 -11.520 1.00 0.00 H new ATOM 0 HG SER A 66 2.366 -5.838 -13.146 1.00 0.00 H new ATOM 1047 N LEU A 67 4.589 -2.627 -10.456 1.00 0.00 N ATOM 1048 CA LEU A 67 4.650 -1.197 -10.025 1.00 0.00 C ATOM 1049 C LEU A 67 3.321 -0.497 -10.320 1.00 0.00 C ATOM 1050 O LEU A 67 2.616 -0.097 -9.427 1.00 0.00 O ATOM 1051 CB LEU A 67 5.770 -0.484 -10.783 1.00 0.00 C ATOM 1052 CG LEU A 67 6.363 0.656 -9.940 1.00 0.00 C ATOM 1053 CD1 LEU A 67 6.816 1.770 -10.877 1.00 0.00 C ATOM 1054 CD2 LEU A 67 5.320 1.225 -8.966 1.00 0.00 C ATOM 0 H LEU A 67 5.238 -2.887 -11.198 1.00 0.00 H new ATOM 0 HA LEU A 67 4.844 -1.161 -8.953 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.553 -1.198 -11.039 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.383 -0.085 -11.721 1.00 0.00 H new ATOM 0 HG LEU A 67 7.200 0.264 -9.363 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.240 2.587 -10.293 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.571 1.385 -11.562 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.962 2.136 -11.447 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.768 2.030 -8.383 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.471 1.613 -9.528 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.980 0.436 -8.295 1.00 0.00 H new ATOM 1066 N PHE A 68 3.006 -0.333 -11.572 1.00 0.00 N ATOM 1067 CA PHE A 68 1.742 0.351 -11.981 1.00 0.00 C ATOM 1068 C PHE A 68 1.973 1.867 -11.980 1.00 0.00 C ATOM 1069 O PHE A 68 1.698 2.538 -12.952 1.00 0.00 O ATOM 1070 CB PHE A 68 0.581 -0.053 -11.040 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.082 1.167 -10.428 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -1.108 1.824 -11.118 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.335 1.642 -9.178 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -1.718 2.952 -10.557 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.275 2.770 -8.619 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.301 3.424 -9.308 1.00 0.00 C ATOM 0 H PHE A 68 3.583 -0.651 -12.350 1.00 0.00 H new ATOM 0 HA PHE A 68 1.461 0.043 -12.988 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.157 -0.630 -11.597 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.960 -0.699 -10.248 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.429 1.460 -12.083 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.128 1.137 -8.646 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.511 3.458 -11.088 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.047 3.136 -7.655 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.772 4.294 -8.875 1.00 0.00 H new ATOM 1086 N GLU A 69 2.482 2.399 -10.901 1.00 0.00 N ATOM 1087 CA GLU A 69 2.744 3.870 -10.823 1.00 0.00 C ATOM 1088 C GLU A 69 2.838 4.276 -9.357 1.00 0.00 C ATOM 1089 O GLU A 69 2.038 3.877 -8.539 1.00 0.00 O ATOM 1090 CB GLU A 69 1.608 4.656 -11.497 1.00 0.00 C ATOM 1091 CG GLU A 69 1.762 6.153 -11.206 1.00 0.00 C ATOM 1092 CD GLU A 69 2.718 6.772 -12.227 1.00 0.00 C ATOM 1093 OE1 GLU A 69 2.414 6.710 -13.407 1.00 0.00 O ATOM 1094 OE2 GLU A 69 3.738 7.297 -11.813 1.00 0.00 O ATOM 0 H GLU A 69 2.730 1.875 -10.062 1.00 0.00 H new ATOM 0 HA GLU A 69 3.677 4.095 -11.339 1.00 0.00 H new ATOM 0 HB2 GLU A 69 1.623 4.483 -12.573 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.644 4.303 -11.131 1.00 0.00 H new ATOM 0 HG2 GLU A 69 0.791 6.646 -11.255 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.145 6.301 -10.196 1.00 0.00 H new ATOM 1101 N LYS A 70 3.811 5.069 -9.023 1.00 0.00 N ATOM 1102 CA LYS A 70 3.963 5.501 -7.611 1.00 0.00 C ATOM 1103 C LYS A 70 4.007 7.027 -7.546 1.00 0.00 C ATOM 1104 O LYS A 70 3.889 7.705 -8.548 1.00 0.00 O ATOM 1105 CB LYS A 70 5.266 4.934 -7.052 1.00 0.00 C ATOM 1106 CG LYS A 70 6.332 4.920 -8.149 1.00 0.00 C ATOM 1107 CD LYS A 70 7.574 4.190 -7.637 1.00 0.00 C ATOM 1108 CE LYS A 70 8.228 5.012 -6.526 1.00 0.00 C ATOM 1109 NZ LYS A 70 9.324 5.841 -7.102 1.00 0.00 N ATOM 0 H LYS A 70 4.510 5.438 -9.668 1.00 0.00 H new ATOM 0 HA LYS A 70 3.120 5.137 -7.024 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.605 5.537 -6.209 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.103 3.924 -6.676 1.00 0.00 H new ATOM 0 HG2 LYS A 70 5.947 4.425 -9.040 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.588 5.940 -8.436 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.300 3.204 -7.261 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.280 4.035 -8.453 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.486 5.652 -6.048 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.624 4.351 -5.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.552 6.617 -6.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.168 5.250 -7.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.018 6.235 -8.015 1.00 0.00 H new ATOM 1123 N LEU A 71 4.183 7.572 -6.376 1.00 0.00 N ATOM 1124 CA LEU A 71 4.241 9.053 -6.254 1.00 0.00 C ATOM 1125 C LEU A 71 5.378 9.454 -5.318 1.00 0.00 C ATOM 1126 O LEU A 71 6.108 8.626 -4.810 1.00 0.00 O ATOM 1127 CB LEU A 71 2.914 9.593 -5.698 1.00 0.00 C ATOM 1128 CG LEU A 71 2.407 8.712 -4.545 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.518 8.488 -3.516 1.00 0.00 C ATOM 1130 CD2 LEU A 71 1.224 9.409 -3.860 1.00 0.00 C ATOM 0 H LEU A 71 4.289 7.058 -5.502 1.00 0.00 H new ATOM 0 HA LEU A 71 4.416 9.476 -7.243 1.00 0.00 H new ATOM 0 HB2 LEU A 71 3.051 10.616 -5.347 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.168 9.625 -6.492 1.00 0.00 H new ATOM 0 HG LEU A 71 2.096 7.748 -4.948 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.143 7.862 -2.706 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.363 7.994 -3.995 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.840 9.448 -3.113 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.860 8.788 -3.041 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.547 10.373 -3.468 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.423 9.561 -4.583 1.00 0.00 H new ATOM 1142 N GLU A 72 5.516 10.723 -5.075 1.00 0.00 N ATOM 1143 CA GLU A 72 6.580 11.208 -4.160 1.00 0.00 C ATOM 1144 C GLU A 72 6.094 12.511 -3.530 1.00 0.00 C ATOM 1145 O GLU A 72 6.366 13.591 -4.016 1.00 0.00 O ATOM 1146 CB GLU A 72 7.873 11.453 -4.942 1.00 0.00 C ATOM 1147 CG GLU A 72 9.073 11.304 -4.001 1.00 0.00 C ATOM 1148 CD GLU A 72 10.314 11.916 -4.655 1.00 0.00 C ATOM 1149 OE1 GLU A 72 10.929 11.238 -5.461 1.00 0.00 O ATOM 1150 OE2 GLU A 72 10.626 13.051 -4.339 1.00 0.00 O ATOM 0 H GLU A 72 4.929 11.454 -5.477 1.00 0.00 H new ATOM 0 HA GLU A 72 6.786 10.466 -3.388 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.953 10.744 -5.766 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.862 12.451 -5.380 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.868 11.799 -3.052 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.247 10.251 -3.780 1.00 0.00 H new ATOM 1157 N TYR A 73 5.363 12.416 -2.455 1.00 0.00 N ATOM 1158 CA TYR A 73 4.843 13.639 -1.798 1.00 0.00 C ATOM 1159 C TYR A 73 5.961 14.258 -0.973 1.00 0.00 C ATOM 1160 O TYR A 73 6.301 13.779 0.090 1.00 0.00 O ATOM 1161 CB TYR A 73 3.668 13.268 -0.887 1.00 0.00 C ATOM 1162 CG TYR A 73 2.591 14.319 -0.997 1.00 0.00 C ATOM 1163 CD1 TYR A 73 2.852 15.633 -0.592 1.00 0.00 C ATOM 1164 CD2 TYR A 73 1.332 13.977 -1.504 1.00 0.00 C ATOM 1165 CE1 TYR A 73 1.851 16.607 -0.694 1.00 0.00 C ATOM 1166 CE2 TYR A 73 0.332 14.951 -1.606 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.591 16.266 -1.200 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.394 17.227 -1.302 1.00 0.00 O ATOM 0 H TYR A 73 5.104 11.539 -2.004 1.00 0.00 H new ATOM 0 HA TYR A 73 4.499 14.352 -2.547 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.269 12.294 -1.169 1.00 0.00 H new ATOM 0 HB3 TYR A 73 4.007 13.187 0.146 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.824 15.895 -0.201 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.132 12.963 -1.816 1.00 0.00 H new ATOM 0 HE1 TYR A 73 2.051 17.621 -0.382 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -0.640 14.688 -1.998 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.207 16.824 -1.673 1.00 0.00 H new ATOM 1178 N GLU A 74 6.543 15.316 -1.455 1.00 0.00 N ATOM 1179 CA GLU A 74 7.638 15.951 -0.695 1.00 0.00 C ATOM 1180 C GLU A 74 7.056 17.084 0.140 1.00 0.00 C ATOM 1181 O GLU A 74 6.025 17.638 -0.185 1.00 0.00 O ATOM 1182 CB GLU A 74 8.688 16.503 -1.662 1.00 0.00 C ATOM 1183 CG GLU A 74 9.973 16.818 -0.894 1.00 0.00 C ATOM 1184 CD GLU A 74 10.846 17.762 -1.723 1.00 0.00 C ATOM 1185 OE1 GLU A 74 10.313 18.733 -2.235 1.00 0.00 O ATOM 1186 OE2 GLU A 74 12.032 17.497 -1.831 1.00 0.00 O ATOM 0 H GLU A 74 6.306 15.764 -2.340 1.00 0.00 H new ATOM 0 HA GLU A 74 8.114 15.217 -0.044 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.891 15.777 -2.449 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.312 17.403 -2.148 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.733 17.277 0.065 1.00 0.00 H new ATOM 0 HG3 GLU A 74 10.516 15.897 -0.680 1.00 0.00 H new ATOM 1193 N PHE A 75 7.693 17.427 1.217 1.00 0.00 N ATOM 1194 CA PHE A 75 7.154 18.516 2.068 1.00 0.00 C ATOM 1195 C PHE A 75 8.318 19.359 2.601 1.00 0.00 C ATOM 1196 O PHE A 75 9.465 19.002 2.418 1.00 0.00 O ATOM 1197 CB PHE A 75 6.387 17.887 3.237 1.00 0.00 C ATOM 1198 CG PHE A 75 4.896 17.967 2.984 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.336 19.100 2.377 1.00 0.00 C ATOM 1200 CD2 PHE A 75 4.071 16.899 3.360 1.00 0.00 C ATOM 1201 CE1 PHE A 75 2.957 19.162 2.147 1.00 0.00 C ATOM 1202 CE2 PHE A 75 2.693 16.962 3.129 1.00 0.00 C ATOM 1203 CZ PHE A 75 2.135 18.093 2.523 1.00 0.00 C ATOM 0 H PHE A 75 8.561 17.003 1.545 1.00 0.00 H new ATOM 0 HA PHE A 75 6.485 19.155 1.491 1.00 0.00 H new ATOM 0 HB2 PHE A 75 6.687 16.847 3.361 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.635 18.403 4.164 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.969 19.925 2.087 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.500 16.026 3.829 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.527 20.035 1.679 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.059 16.137 3.419 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.071 18.141 2.345 1.00 0.00 H new ATOM 1213 N PRO A 76 7.994 20.446 3.257 1.00 0.00 N ATOM 1214 CA PRO A 76 9.014 21.337 3.832 1.00 0.00 C ATOM 1215 C PRO A 76 10.034 20.514 4.615 1.00 0.00 C ATOM 1216 O PRO A 76 11.223 20.765 4.571 1.00 0.00 O ATOM 1217 CB PRO A 76 8.227 22.269 4.763 1.00 0.00 C ATOM 1218 CG PRO A 76 6.718 22.007 4.520 1.00 0.00 C ATOM 1219 CD PRO A 76 6.603 20.876 3.486 1.00 0.00 C ATOM 0 HA PRO A 76 9.571 21.893 3.078 1.00 0.00 H new ATOM 0 HB2 PRO A 76 8.486 22.078 5.804 1.00 0.00 H new ATOM 0 HB3 PRO A 76 8.473 23.311 4.559 1.00 0.00 H new ATOM 0 HG2 PRO A 76 6.223 21.727 5.450 1.00 0.00 H new ATOM 0 HG3 PRO A 76 6.226 22.909 4.157 1.00 0.00 H new ATOM 0 HD2 PRO A 76 5.990 20.056 3.860 1.00 0.00 H new ATOM 0 HD3 PRO A 76 6.138 21.226 2.564 1.00 0.00 H new ATOM 1227 N ASP A 77 9.575 19.521 5.318 1.00 0.00 N ATOM 1228 CA ASP A 77 10.501 18.660 6.097 1.00 0.00 C ATOM 1229 C ASP A 77 9.914 17.256 6.132 1.00 0.00 C ATOM 1230 O ASP A 77 10.014 16.547 7.114 1.00 0.00 O ATOM 1231 CB ASP A 77 10.629 19.197 7.522 1.00 0.00 C ATOM 1232 CG ASP A 77 9.234 19.427 8.107 1.00 0.00 C ATOM 1233 OD1 ASP A 77 8.627 20.427 7.764 1.00 0.00 O ATOM 1234 OD2 ASP A 77 8.797 18.599 8.889 1.00 0.00 O ATOM 0 H ASP A 77 8.590 19.267 5.387 1.00 0.00 H new ATOM 0 HA ASP A 77 11.489 18.651 5.637 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.182 18.490 8.140 1.00 0.00 H new ATOM 0 HB3 ASP A 77 11.193 20.130 7.521 1.00 0.00 H new ATOM 1239 N ARG A 78 9.277 16.859 5.066 1.00 0.00 N ATOM 1240 CA ARG A 78 8.653 15.515 5.033 1.00 0.00 C ATOM 1241 C ARG A 78 8.803 14.900 3.639 1.00 0.00 C ATOM 1242 O ARG A 78 7.875 14.890 2.856 1.00 0.00 O ATOM 1243 CB ARG A 78 7.170 15.663 5.372 1.00 0.00 C ATOM 1244 CG ARG A 78 6.849 14.864 6.637 1.00 0.00 C ATOM 1245 CD ARG A 78 7.457 15.563 7.857 1.00 0.00 C ATOM 1246 NE ARG A 78 6.389 15.853 8.859 1.00 0.00 N ATOM 1247 CZ ARG A 78 5.206 16.246 8.467 1.00 0.00 C ATOM 1248 NH1 ARG A 78 5.093 17.057 7.451 1.00 0.00 N ATOM 1249 NH2 ARG A 78 4.139 15.830 9.093 1.00 0.00 N ATOM 0 H ARG A 78 9.163 17.411 4.216 1.00 0.00 H new ATOM 0 HA ARG A 78 9.142 14.862 5.756 1.00 0.00 H new ATOM 0 HB2 ARG A 78 6.924 16.714 5.522 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.560 15.308 4.541 1.00 0.00 H new ATOM 0 HG2 ARG A 78 5.769 14.774 6.758 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.245 13.852 6.550 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.225 14.932 8.304 1.00 0.00 H new ATOM 0 HD3 ARG A 78 7.943 16.490 7.552 1.00 0.00 H new ATOM 0 HE ARG A 78 6.584 15.744 9.854 1.00 0.00 H new ATOM 0 HH11 ARG A 78 5.928 17.383 6.964 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.170 17.364 7.144 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.228 15.198 9.889 1.00 0.00 H new ATOM 0 HH22 ARG A 78 3.216 16.137 8.787 1.00 0.00 H new ATOM 1263 N HIS A 79 9.957 14.371 3.328 1.00 0.00 N ATOM 1264 CA HIS A 79 10.147 13.738 1.992 1.00 0.00 C ATOM 1265 C HIS A 79 9.589 12.316 2.061 1.00 0.00 C ATOM 1266 O HIS A 79 10.033 11.513 2.857 1.00 0.00 O ATOM 1267 CB HIS A 79 11.638 13.680 1.652 1.00 0.00 C ATOM 1268 CG HIS A 79 12.224 15.066 1.693 1.00 0.00 C ATOM 1269 ND1 HIS A 79 11.681 16.284 2.014 1.00 0.00 N flip ATOM 1270 CD2 HIS A 79 13.549 15.314 1.369 1.00 0.00 C flip ATOM 1271 CE1 HIS A 79 12.652 17.276 1.894 1.00 0.00 C flip ATOM 1272 NE2 HIS A 79 13.757 16.637 1.503 1.00 0.00 N flip ATOM 0 H HIS A 79 10.773 14.350 3.940 1.00 0.00 H new ATOM 0 HA HIS A 79 9.633 14.317 1.225 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.157 13.035 2.360 1.00 0.00 H new ATOM 0 HB3 HIS A 79 11.778 13.245 0.662 1.00 0.00 H new ATOM 0 HD2 HIS A 79 14.280 14.580 1.065 1.00 0.00 H new ATOM 0 HE1 HIS A 79 12.536 18.334 2.078 1.00 0.00 H new ATOM 0 HE2 HIS A 79 14.651 17.096 1.327 1.00 0.00 H new ATOM 1280 N ILE A 80 8.611 11.994 1.260 1.00 0.00 N ATOM 1281 CA ILE A 80 8.043 10.620 1.338 1.00 0.00 C ATOM 1282 C ILE A 80 7.967 9.966 -0.046 1.00 0.00 C ATOM 1283 O ILE A 80 8.007 10.618 -1.072 1.00 0.00 O ATOM 1284 CB ILE A 80 6.631 10.677 1.930 1.00 0.00 C ATOM 1285 CG1 ILE A 80 6.705 11.007 3.423 1.00 0.00 C ATOM 1286 CG2 ILE A 80 5.954 9.320 1.738 1.00 0.00 C ATOM 1287 CD1 ILE A 80 7.169 12.452 3.597 1.00 0.00 C ATOM 0 H ILE A 80 8.187 12.611 0.567 1.00 0.00 H new ATOM 0 HA ILE A 80 8.700 10.025 1.972 1.00 0.00 H new ATOM 0 HB ILE A 80 6.055 11.452 1.424 1.00 0.00 H new ATOM 0 HG12 ILE A 80 5.729 10.868 3.887 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.395 10.328 3.924 1.00 0.00 H new ATOM 0 HG21 ILE A 80 4.948 9.353 2.157 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.897 9.089 0.674 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.534 8.549 2.246 1.00 0.00 H new ATOM 0 HD11 ILE A 80 7.223 12.691 4.659 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.154 12.575 3.147 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.461 13.123 3.110 1.00 0.00 H new ATOM 1299 N THR A 81 7.821 8.669 -0.052 1.00 0.00 N ATOM 1300 CA THR A 81 7.694 7.903 -1.322 1.00 0.00 C ATOM 1301 C THR A 81 6.775 6.710 -1.049 1.00 0.00 C ATOM 1302 O THR A 81 6.735 6.199 0.053 1.00 0.00 O ATOM 1303 CB THR A 81 9.064 7.394 -1.763 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.051 8.377 -1.465 1.00 0.00 O ATOM 1305 CG2 THR A 81 9.047 7.111 -3.268 1.00 0.00 C ATOM 0 H THR A 81 7.784 8.096 0.791 1.00 0.00 H new ATOM 0 HA THR A 81 7.288 8.538 -2.110 1.00 0.00 H new ATOM 0 HB THR A 81 9.301 6.473 -1.231 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.781 8.315 -2.116 1.00 0.00 H new ATOM 0 HG21 THR A 81 10.026 6.748 -3.581 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.292 6.356 -3.488 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.811 8.028 -3.808 1.00 0.00 H new ATOM 1313 N LEU A 82 6.029 6.263 -2.016 1.00 0.00 N ATOM 1314 CA LEU A 82 5.122 5.110 -1.752 1.00 0.00 C ATOM 1315 C LEU A 82 5.092 4.170 -2.958 1.00 0.00 C ATOM 1316 O LEU A 82 4.200 4.229 -3.780 1.00 0.00 O ATOM 1317 CB LEU A 82 3.711 5.634 -1.475 1.00 0.00 C ATOM 1318 CG LEU A 82 3.091 4.849 -0.318 1.00 0.00 C ATOM 1319 CD1 LEU A 82 3.111 5.709 0.947 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.643 4.491 -0.667 1.00 0.00 C ATOM 0 H LEU A 82 6.005 6.637 -2.965 1.00 0.00 H new ATOM 0 HA LEU A 82 5.489 4.557 -0.887 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.748 6.695 -1.229 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.093 5.535 -2.368 1.00 0.00 H new ATOM 0 HG LEU A 82 3.662 3.936 -0.147 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.670 5.151 1.773 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.140 5.969 1.194 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.537 6.620 0.777 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.198 3.931 0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.073 5.405 -0.835 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.626 3.882 -1.571 1.00 0.00 H new ATOM 1332 N TRP A 83 6.052 3.292 -3.062 1.00 0.00 N ATOM 1333 CA TRP A 83 6.061 2.339 -4.214 1.00 0.00 C ATOM 1334 C TRP A 83 4.714 1.605 -4.267 1.00 0.00 C ATOM 1335 O TRP A 83 4.396 0.813 -3.402 1.00 0.00 O ATOM 1336 CB TRP A 83 7.187 1.319 -4.029 1.00 0.00 C ATOM 1337 CG TRP A 83 8.513 2.004 -4.115 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.156 2.588 -3.078 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.372 2.180 -5.279 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.355 3.111 -3.532 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.531 2.886 -4.882 1.00 0.00 C ATOM 1342 CE3 TRP A 83 9.256 1.800 -6.628 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.541 3.204 -5.791 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 10.272 2.117 -7.546 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.411 2.818 -7.128 1.00 0.00 C ATOM 0 H TRP A 83 6.826 3.191 -2.406 1.00 0.00 H new ATOM 0 HA TRP A 83 6.221 2.888 -5.142 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.086 0.824 -3.063 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.117 0.545 -4.793 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.793 2.638 -2.062 1.00 0.00 H new ATOM 0 HE1 TRP A 83 11.026 3.602 -2.941 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.381 1.261 -6.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.417 3.745 -5.464 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 10.174 1.819 -8.579 1.00 0.00 H new ATOM 0 HH2 TRP A 83 12.188 3.060 -7.838 1.00 0.00 H new ATOM 1356 N PHE A 84 3.920 1.866 -5.273 1.00 0.00 N ATOM 1357 CA PHE A 84 2.593 1.189 -5.381 1.00 0.00 C ATOM 1358 C PHE A 84 2.744 -0.126 -6.141 1.00 0.00 C ATOM 1359 O PHE A 84 2.245 -0.270 -7.232 1.00 0.00 O ATOM 1360 CB PHE A 84 1.628 2.082 -6.158 1.00 0.00 C ATOM 1361 CG PHE A 84 0.890 2.987 -5.203 1.00 0.00 C ATOM 1362 CD1 PHE A 84 -0.304 2.553 -4.618 1.00 0.00 C ATOM 1363 CD2 PHE A 84 1.394 4.259 -4.908 1.00 0.00 C ATOM 1364 CE1 PHE A 84 -0.998 3.390 -3.738 1.00 0.00 C ATOM 1365 CE2 PHE A 84 0.701 5.098 -4.026 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.495 4.662 -3.442 1.00 0.00 C ATOM 0 H PHE A 84 4.134 2.520 -6.026 1.00 0.00 H new ATOM 0 HA PHE A 84 2.211 1.000 -4.378 1.00 0.00 H new ATOM 0 HB2 PHE A 84 2.176 2.678 -6.888 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.919 1.469 -6.715 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.691 1.571 -4.846 1.00 0.00 H new ATOM 0 HD2 PHE A 84 2.316 4.593 -5.360 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -1.921 3.055 -3.288 1.00 0.00 H new ATOM 0 HE2 PHE A 84 1.088 6.080 -3.797 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.030 5.308 -2.762 1.00 0.00 H new ATOM 1376 N TRP A 85 3.407 -1.091 -5.581 1.00 0.00 N ATOM 1377 CA TRP A 85 3.562 -2.384 -6.303 1.00 0.00 C ATOM 1378 C TRP A 85 2.227 -3.135 -6.312 1.00 0.00 C ATOM 1379 O TRP A 85 1.975 -3.983 -5.481 1.00 0.00 O ATOM 1380 CB TRP A 85 4.624 -3.237 -5.604 1.00 0.00 C ATOM 1381 CG TRP A 85 5.985 -2.778 -6.025 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.810 -2.008 -5.279 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.691 -3.045 -7.272 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.975 -1.781 -5.991 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.950 -2.399 -7.226 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.363 -3.774 -8.429 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.851 -2.477 -8.290 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.269 -3.854 -9.500 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.508 -3.204 -9.431 1.00 0.00 C ATOM 0 H TRP A 85 3.847 -1.045 -4.662 1.00 0.00 H new ATOM 0 HA TRP A 85 3.871 -2.188 -7.330 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.519 -3.155 -4.522 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.488 -4.288 -5.858 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.595 -1.632 -4.290 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.757 -1.225 -5.646 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.409 -4.275 -8.495 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.807 -1.978 -8.230 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 7.009 -4.420 -10.382 1.00 0.00 H new ATOM 0 HH2 TRP A 85 9.197 -3.265 -10.260 1.00 0.00 H new ATOM 1400 N LEU A 86 1.358 -2.836 -7.241 1.00 0.00 N ATOM 1401 CA LEU A 86 0.053 -3.549 -7.269 1.00 0.00 C ATOM 1402 C LEU A 86 0.268 -5.014 -7.640 1.00 0.00 C ATOM 1403 O LEU A 86 0.903 -5.332 -8.626 1.00 0.00 O ATOM 1404 CB LEU A 86 -0.866 -2.914 -8.306 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.694 -1.811 -7.657 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.411 -2.348 -6.411 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.767 -0.659 -7.266 1.00 0.00 C ATOM 0 H LEU A 86 1.495 -2.138 -7.972 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.401 -3.479 -6.280 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.276 -2.504 -9.125 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.524 -3.671 -8.734 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.445 -1.458 -8.364 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.999 -1.550 -5.957 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.071 -3.168 -6.696 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.674 -2.708 -5.694 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.350 0.136 -6.801 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.017 -1.019 -6.562 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.272 -0.272 -8.157 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.280 -5.906 -6.867 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.139 -7.354 -7.180 1.00 0.00 C ATOM 1421 C VAL A 87 -1.525 -7.866 -7.597 1.00 0.00 C ATOM 1422 O VAL A 87 -2.453 -7.090 -7.716 1.00 0.00 O ATOM 1423 CB VAL A 87 0.404 -8.107 -5.943 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.060 -7.112 -4.979 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.725 -8.845 -5.209 1.00 0.00 C ATOM 0 H VAL A 87 -0.822 -5.695 -6.029 1.00 0.00 H new ATOM 0 HA VAL A 87 0.570 -7.522 -7.990 1.00 0.00 H new ATOM 0 HB VAL A 87 1.137 -8.837 -6.285 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.441 -7.646 -4.109 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.883 -6.605 -5.483 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.323 -6.376 -4.659 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.316 -9.366 -4.343 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.475 -8.126 -4.879 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.186 -9.567 -5.883 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.701 -9.139 -7.834 1.00 0.00 N ATOM 1436 CA GLU A 88 -3.066 -9.584 -8.250 1.00 0.00 C ATOM 1437 C GLU A 88 -3.315 -11.089 -8.034 1.00 0.00 C ATOM 1438 O GLU A 88 -4.335 -11.602 -8.449 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.264 -9.237 -9.726 1.00 0.00 C ATOM 1440 CG GLU A 88 -3.867 -7.831 -9.840 1.00 0.00 C ATOM 1441 CD GLU A 88 -5.084 -7.876 -10.766 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -6.151 -8.232 -10.293 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -4.929 -7.552 -11.933 1.00 0.00 O ATOM 0 H GLU A 88 -0.990 -9.867 -7.762 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.785 -9.062 -7.618 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.311 -9.280 -10.253 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -3.922 -9.967 -10.198 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.159 -7.467 -8.855 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.124 -7.135 -10.230 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.440 -11.812 -7.387 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.730 -13.269 -7.176 1.00 0.00 C ATOM 1452 C ARG A 89 -1.877 -13.830 -6.032 1.00 0.00 C ATOM 1453 O ARG A 89 -0.957 -14.590 -6.234 1.00 0.00 O ATOM 1454 CB ARG A 89 -2.482 -14.054 -8.474 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.983 -14.227 -8.719 1.00 0.00 C ATOM 1456 CD ARG A 89 -0.608 -15.705 -8.574 1.00 0.00 C ATOM 1457 NE ARG A 89 -1.118 -16.466 -9.752 1.00 0.00 N ATOM 1458 CZ ARG A 89 -0.678 -17.671 -9.993 1.00 0.00 C ATOM 1459 NH1 ARG A 89 0.606 -17.896 -10.061 1.00 0.00 N ATOM 1460 NH2 ARG A 89 -1.522 -18.651 -10.167 1.00 0.00 N ATOM 0 H ARG A 89 -1.558 -11.473 -7.003 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.779 -13.378 -6.901 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.961 -15.031 -8.412 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.935 -13.530 -9.315 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.723 -13.871 -9.716 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.416 -13.626 -8.008 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.474 -15.811 -8.500 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.031 -16.110 -7.655 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.811 -16.044 -10.370 1.00 0.00 H new ATOM 0 HH11 ARG A 89 1.266 -17.130 -9.926 1.00 0.00 H new ATOM 0 HH12 ARG A 89 0.949 -18.838 -10.249 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.525 -18.475 -10.115 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -1.178 -19.593 -10.355 1.00 0.00 H new ATOM 1474 N TRP A 90 -2.185 -13.466 -4.821 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.398 -13.988 -3.670 1.00 0.00 C ATOM 1476 C TRP A 90 -1.871 -15.397 -3.302 1.00 0.00 C ATOM 1477 O TRP A 90 -2.944 -15.823 -3.683 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.580 -13.069 -2.468 1.00 0.00 C ATOM 1479 CG TRP A 90 -3.000 -13.125 -1.994 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.522 -14.130 -1.254 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -4.088 -12.166 -2.202 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.851 -13.854 -0.997 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.247 -12.662 -1.557 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -4.189 -10.932 -2.878 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.455 -11.967 -1.578 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -5.412 -10.229 -2.897 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.538 -10.748 -2.248 1.00 0.00 C ATOM 0 H TRP A 90 -2.945 -12.831 -4.577 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.346 -14.025 -3.952 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -0.907 -13.369 -1.665 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.318 -12.046 -2.738 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -2.987 -15.006 -0.919 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.466 -14.462 -0.456 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.326 -10.524 -3.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.322 -12.371 -1.077 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -5.480 -9.284 -3.416 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.471 -10.204 -2.266 1.00 0.00 H new ATOM 1498 N GLU A 91 -1.079 -16.125 -2.555 1.00 0.00 N ATOM 1499 CA GLU A 91 -1.486 -17.509 -2.157 1.00 0.00 C ATOM 1500 C GLU A 91 -2.430 -17.445 -0.950 1.00 0.00 C ATOM 1501 O GLU A 91 -2.170 -16.739 -0.005 1.00 0.00 O ATOM 1502 CB GLU A 91 -0.237 -18.338 -1.791 1.00 0.00 C ATOM 1503 CG GLU A 91 0.117 -18.162 -0.307 1.00 0.00 C ATOM 1504 CD GLU A 91 1.543 -18.660 -0.064 1.00 0.00 C ATOM 1505 OE1 GLU A 91 2.379 -18.447 -0.926 1.00 0.00 O ATOM 1506 OE2 GLU A 91 1.774 -19.249 0.980 1.00 0.00 O ATOM 0 H GLU A 91 -0.170 -15.822 -2.204 1.00 0.00 H new ATOM 0 HA GLU A 91 -2.000 -17.983 -2.993 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.419 -19.391 -2.004 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.605 -18.028 -2.410 1.00 0.00 H new ATOM 0 HG2 GLU A 91 0.033 -17.113 -0.023 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.585 -18.718 0.314 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.499 -18.206 -0.979 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.472 -18.245 0.165 1.00 0.00 C ATOM 1515 C GLY A 92 -4.619 -16.875 0.841 1.00 0.00 C ATOM 1516 O GLY A 92 -5.566 -16.158 0.600 1.00 0.00 O ATOM 0 H GLY A 92 -3.744 -18.813 -1.761 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.445 -18.577 -0.198 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.139 -18.978 0.900 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.699 -16.520 1.697 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.783 -15.204 2.400 1.00 0.00 C ATOM 1522 C GLU A 93 -2.875 -14.192 1.688 1.00 0.00 C ATOM 1523 O GLU A 93 -1.906 -14.571 1.068 1.00 0.00 O ATOM 1524 CB GLU A 93 -3.317 -15.346 3.862 1.00 0.00 C ATOM 1525 CG GLU A 93 -3.206 -16.824 4.269 1.00 0.00 C ATOM 1526 CD GLU A 93 -2.553 -16.926 5.650 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -1.333 -16.920 5.708 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -3.282 -17.009 6.624 1.00 0.00 O ATOM 0 H GLU A 93 -2.888 -17.087 1.942 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.818 -14.863 2.384 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.350 -14.858 3.987 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.019 -14.836 4.521 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.195 -17.282 4.288 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.615 -17.371 3.534 1.00 0.00 H new ATOM 1535 N PRO A 94 -3.217 -12.931 1.803 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.439 -11.831 1.192 1.00 0.00 C ATOM 1537 C PRO A 94 -1.233 -11.489 2.073 1.00 0.00 C ATOM 1538 O PRO A 94 -0.815 -12.268 2.905 1.00 0.00 O ATOM 1539 CB PRO A 94 -3.408 -10.648 1.200 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.504 -10.979 2.241 1.00 0.00 C ATOM 1541 CD PRO A 94 -4.419 -12.489 2.532 1.00 0.00 C ATOM 0 HA PRO A 94 -2.067 -12.084 0.199 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.890 -9.725 1.463 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.845 -10.498 0.212 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -4.353 -10.403 3.154 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -5.490 -10.717 1.857 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -4.331 -12.684 3.601 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -5.310 -13.012 2.185 1.00 0.00 H new ATOM 1549 N TRP A 95 -0.697 -10.304 1.916 1.00 0.00 N ATOM 1550 CA TRP A 95 0.453 -9.879 2.762 1.00 0.00 C ATOM 1551 C TRP A 95 0.911 -8.476 2.357 1.00 0.00 C ATOM 1552 O TRP A 95 1.070 -8.167 1.196 1.00 0.00 O ATOM 1553 CB TRP A 95 1.610 -10.880 2.635 1.00 0.00 C ATOM 1554 CG TRP A 95 2.232 -10.839 1.278 1.00 0.00 C ATOM 1555 CD1 TRP A 95 1.643 -10.370 0.159 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.550 -11.322 0.879 1.00 0.00 C ATOM 1557 NE1 TRP A 95 2.522 -10.511 -0.899 1.00 0.00 N ATOM 1558 CE2 TRP A 95 3.711 -11.098 -0.507 1.00 0.00 C ATOM 1559 CE3 TRP A 95 4.613 -11.923 1.581 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 4.888 -11.459 -1.174 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 5.793 -12.287 0.910 1.00 0.00 C ATOM 1562 CH2 TRP A 95 5.929 -12.055 -0.463 1.00 0.00 C ATOM 0 H TRP A 95 -1.010 -9.612 1.235 1.00 0.00 H new ATOM 0 HA TRP A 95 0.133 -9.856 3.804 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.366 -10.659 3.388 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.244 -11.887 2.837 1.00 0.00 H new ATOM 0 HD1 TRP A 95 0.649 -9.953 0.099 1.00 0.00 H new ATOM 0 HE1 TRP A 95 2.318 -10.217 -1.854 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.521 -12.105 2.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.989 -11.277 -2.234 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 6.601 -12.749 1.458 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.839 -12.337 -0.972 1.00 0.00 H new ATOM 1573 N GLY A 96 1.108 -7.614 3.313 1.00 0.00 N ATOM 1574 CA GLY A 96 1.550 -6.231 2.980 1.00 0.00 C ATOM 1575 C GLY A 96 1.086 -5.263 4.066 1.00 0.00 C ATOM 1576 O GLY A 96 1.800 -4.356 4.443 1.00 0.00 O ATOM 0 H GLY A 96 0.983 -7.805 4.307 1.00 0.00 H new ATOM 0 HA2 GLY A 96 2.636 -6.198 2.891 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.142 -5.932 2.015 1.00 0.00 H new ATOM 1580 N LYS A 97 -0.110 -5.441 4.560 1.00 0.00 N ATOM 1581 CA LYS A 97 -0.624 -4.518 5.619 1.00 0.00 C ATOM 1582 C LYS A 97 0.493 -4.213 6.617 1.00 0.00 C ATOM 1583 O LYS A 97 0.873 -5.046 7.416 1.00 0.00 O ATOM 1584 CB LYS A 97 -1.820 -5.132 6.373 1.00 0.00 C ATOM 1585 CG LYS A 97 -1.999 -6.614 6.025 1.00 0.00 C ATOM 1586 CD LYS A 97 -0.724 -7.388 6.361 1.00 0.00 C ATOM 1587 CE LYS A 97 -0.904 -8.094 7.706 1.00 0.00 C ATOM 1588 NZ LYS A 97 0.428 -8.492 8.243 1.00 0.00 N ATOM 0 H LYS A 97 -0.753 -6.182 4.279 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.959 -3.602 5.132 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.669 -5.025 7.447 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.729 -4.585 6.123 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -2.842 -7.027 6.579 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -2.231 -6.722 4.965 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.510 -8.117 5.580 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.127 -6.709 6.404 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -1.409 -7.433 8.411 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -1.536 -8.974 7.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 0.315 -9.300 8.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 1.053 -8.762 7.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.847 -7.693 8.760 1.00 0.00 H new ATOM 1602 N GLU A 98 1.020 -3.020 6.580 1.00 0.00 N ATOM 1603 CA GLU A 98 2.109 -2.661 7.530 1.00 0.00 C ATOM 1604 C GLU A 98 1.492 -2.379 8.899 1.00 0.00 C ATOM 1605 O GLU A 98 1.163 -1.254 9.220 1.00 0.00 O ATOM 1606 CB GLU A 98 2.838 -1.416 7.023 1.00 0.00 C ATOM 1607 CG GLU A 98 3.760 -0.863 8.117 1.00 0.00 C ATOM 1608 CD GLU A 98 5.060 -1.673 8.159 1.00 0.00 C ATOM 1609 OE1 GLU A 98 5.023 -2.845 7.813 1.00 0.00 O ATOM 1610 OE2 GLU A 98 6.075 -1.103 8.523 1.00 0.00 O ATOM 0 H GLU A 98 0.744 -2.280 5.934 1.00 0.00 H new ATOM 0 HA GLU A 98 2.822 -3.482 7.610 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.421 -1.663 6.136 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.114 -0.656 6.728 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.981 0.187 7.923 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.260 -0.910 9.085 1.00 0.00 H new ATOM 1617 N GLY A 99 1.318 -3.390 9.703 1.00 0.00 N ATOM 1618 CA GLY A 99 0.705 -3.169 11.041 1.00 0.00 C ATOM 1619 C GLY A 99 -0.678 -2.544 10.856 1.00 0.00 C ATOM 1620 O GLY A 99 -1.146 -1.784 11.680 1.00 0.00 O ATOM 0 H GLY A 99 1.572 -4.355 9.493 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.623 -4.114 11.578 1.00 0.00 H new ATOM 0 HA3 GLY A 99 1.337 -2.515 11.642 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.332 -2.860 9.771 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.684 -2.290 9.513 1.00 0.00 C ATOM 1626 C GLN A 100 -3.675 -3.433 9.251 1.00 0.00 C ATOM 1627 O GLN A 100 -3.270 -4.566 9.072 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.615 -1.355 8.296 1.00 0.00 C ATOM 1629 CG GLN A 100 -2.672 -2.167 6.998 1.00 0.00 C ATOM 1630 CD GLN A 100 -2.731 -1.214 5.803 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -2.232 -0.109 5.868 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -3.324 -1.598 4.704 1.00 0.00 N ATOM 0 H GLN A 100 -0.985 -3.492 9.049 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.021 -1.721 10.380 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.442 -0.646 8.326 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -1.694 -0.772 8.328 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -1.796 -2.811 6.920 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.546 -2.818 7.002 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -3.743 -2.526 4.648 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -3.367 -0.970 3.902 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.943 -3.100 9.249 1.00 0.00 N ATOM 1642 CA PRO A 101 -6.021 -4.080 9.016 1.00 0.00 C ATOM 1643 C PRO A 101 -6.152 -4.403 7.520 1.00 0.00 C ATOM 1644 O PRO A 101 -7.245 -4.491 6.997 1.00 0.00 O ATOM 1645 CB PRO A 101 -7.289 -3.368 9.500 1.00 0.00 C ATOM 1646 CG PRO A 101 -6.925 -1.879 9.736 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.412 -1.729 9.505 1.00 0.00 C ATOM 0 HA PRO A 101 -5.834 -5.023 9.530 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -8.084 -3.456 8.760 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.657 -3.823 10.419 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.482 -1.236 9.055 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.190 -1.576 10.749 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.202 -1.073 8.660 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -4.918 -1.296 10.375 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.058 -4.581 6.826 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.149 -4.898 5.373 1.00 0.00 C ATOM 1657 C GLY A 102 -6.226 -5.961 5.165 1.00 0.00 C ATOM 1658 O GLY A 102 -6.183 -7.024 5.753 1.00 0.00 O ATOM 0 H GLY A 102 -4.111 -4.521 7.201 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.392 -3.999 4.806 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.188 -5.258 5.005 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.196 -5.682 4.341 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.281 -6.676 4.104 1.00 0.00 C ATOM 1664 C GLU A 103 -8.772 -6.572 2.661 1.00 0.00 C ATOM 1665 O GLU A 103 -8.828 -5.499 2.092 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.441 -6.413 5.077 1.00 0.00 C ATOM 1667 CG GLU A 103 -10.254 -5.186 4.639 1.00 0.00 C ATOM 1668 CD GLU A 103 -11.694 -5.618 4.349 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -12.166 -6.519 5.022 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -12.300 -5.043 3.460 1.00 0.00 O ATOM 0 H GLU A 103 -7.285 -4.809 3.821 1.00 0.00 H new ATOM 0 HA GLU A 103 -7.895 -7.681 4.273 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.090 -7.288 5.121 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.050 -6.255 6.082 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.239 -4.426 5.421 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -9.809 -4.738 3.750 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.129 -7.676 2.054 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.613 -7.607 0.649 1.00 0.00 C ATOM 1679 C TRP A 104 -10.722 -6.572 0.579 1.00 0.00 C ATOM 1680 O TRP A 104 -11.552 -6.477 1.463 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.160 -8.962 0.192 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.317 -10.057 0.766 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -8.040 -10.319 0.403 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.660 -11.030 1.794 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.578 -11.395 1.139 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.539 -11.868 2.011 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.821 -11.268 2.551 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.571 -12.905 2.946 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -10.857 -12.310 3.492 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -9.733 -13.125 3.690 1.00 0.00 C ATOM 0 H TRP A 104 -9.106 -8.608 2.467 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.784 -7.335 -0.004 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.195 -9.077 0.515 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.158 -9.019 -0.897 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.474 -9.777 -0.340 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.642 -11.791 1.049 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.691 -10.645 2.408 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.704 -13.532 3.093 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -11.755 -12.485 4.066 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -9.766 -13.923 4.417 1.00 0.00 H new ATOM 1701 N MET A 105 -10.750 -5.791 -0.454 1.00 0.00 N ATOM 1702 CA MET A 105 -11.818 -4.764 -0.559 1.00 0.00 C ATOM 1703 C MET A 105 -12.317 -4.704 -1.992 1.00 0.00 C ATOM 1704 O MET A 105 -11.631 -4.225 -2.872 1.00 0.00 O ATOM 1705 CB MET A 105 -11.264 -3.392 -0.158 1.00 0.00 C ATOM 1706 CG MET A 105 -12.380 -2.493 0.404 1.00 0.00 C ATOM 1707 SD MET A 105 -13.950 -2.777 -0.466 1.00 0.00 S ATOM 1708 CE MET A 105 -14.627 -1.111 -0.282 1.00 0.00 C ATOM 0 H MET A 105 -10.086 -5.816 -1.228 1.00 0.00 H new ATOM 0 HA MET A 105 -12.638 -5.029 0.108 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.480 -3.516 0.589 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.806 -2.913 -1.023 1.00 0.00 H new ATOM 0 HG2 MET A 105 -12.509 -2.691 1.468 1.00 0.00 H new ATOM 0 HG3 MET A 105 -12.091 -1.446 0.307 1.00 0.00 H new ATOM 0 HE1 MET A 105 -15.316 -0.906 -1.102 1.00 0.00 H new ATOM 0 HE2 MET A 105 -15.159 -1.037 0.666 1.00 0.00 H new ATOM 0 HE3 MET A 105 -13.815 -0.384 -0.300 1.00 0.00 H new ATOM 1718 N SER A 106 -13.511 -5.172 -2.234 1.00 0.00 N ATOM 1719 CA SER A 106 -14.061 -5.131 -3.613 1.00 0.00 C ATOM 1720 C SER A 106 -14.624 -3.733 -3.894 1.00 0.00 C ATOM 1721 O SER A 106 -15.720 -3.582 -4.396 1.00 0.00 O ATOM 1722 CB SER A 106 -15.182 -6.164 -3.746 1.00 0.00 C ATOM 1723 OG SER A 106 -15.465 -6.722 -2.469 1.00 0.00 O ATOM 0 H SER A 106 -14.128 -5.581 -1.533 1.00 0.00 H new ATOM 0 HA SER A 106 -13.269 -5.358 -4.327 1.00 0.00 H new ATOM 0 HB2 SER A 106 -16.076 -5.695 -4.156 1.00 0.00 H new ATOM 0 HB3 SER A 106 -14.886 -6.950 -4.441 1.00 0.00 H new ATOM 0 HG SER A 106 -15.966 -6.073 -1.932 1.00 0.00 H new ATOM 1729 N LEU A 107 -13.881 -2.710 -3.567 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.365 -1.322 -3.806 1.00 0.00 C ATOM 1731 C LEU A 107 -14.507 -1.099 -5.321 1.00 0.00 C ATOM 1732 O LEU A 107 -15.140 -0.166 -5.772 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.388 -0.348 -3.106 1.00 0.00 C ATOM 1734 CG LEU A 107 -12.610 0.558 -4.069 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -11.861 -0.273 -5.113 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -13.555 1.547 -4.747 1.00 0.00 C ATOM 0 H LEU A 107 -12.956 -2.778 -3.143 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.352 -1.142 -3.381 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -13.950 0.276 -2.411 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -12.678 -0.925 -2.514 1.00 0.00 H new ATOM 0 HG LEU A 107 -11.874 1.119 -3.493 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -11.317 0.391 -5.785 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -11.158 -0.938 -4.612 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -12.574 -0.865 -5.687 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -12.989 2.183 -5.427 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -14.313 1.000 -5.308 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -14.039 2.165 -3.991 1.00 0.00 H new ATOM 1748 N VAL A 108 -13.963 -1.997 -6.103 1.00 0.00 N ATOM 1749 CA VAL A 108 -14.094 -1.904 -7.589 1.00 0.00 C ATOM 1750 C VAL A 108 -13.496 -0.601 -8.087 1.00 0.00 C ATOM 1751 O VAL A 108 -13.903 0.469 -7.677 1.00 0.00 O ATOM 1752 CB VAL A 108 -15.573 -1.965 -7.980 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -15.708 -2.571 -9.379 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -16.333 -2.833 -6.976 1.00 0.00 C ATOM 0 H VAL A 108 -13.428 -2.799 -5.771 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.559 -2.739 -8.042 1.00 0.00 H new ATOM 0 HB VAL A 108 -15.989 -0.957 -7.978 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.761 -2.614 -9.657 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.168 -1.953 -10.097 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -15.291 -3.578 -9.381 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -17.386 -2.876 -7.255 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.916 -3.840 -6.977 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -16.239 -2.403 -5.979 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.528 -0.683 -8.966 1.00 0.00 N ATOM 1765 CA GLY A 109 -11.885 0.552 -9.493 1.00 0.00 C ATOM 1766 C GLY A 109 -11.764 1.557 -8.356 1.00 0.00 C ATOM 1767 O GLY A 109 -12.519 2.505 -8.278 1.00 0.00 O ATOM 0 H GLY A 109 -12.157 -1.556 -9.340 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -10.901 0.322 -9.901 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.478 0.970 -10.307 1.00 0.00 H new ATOM 1771 N LEU A 110 -10.848 1.328 -7.454 1.00 0.00 N ATOM 1772 CA LEU A 110 -10.697 2.243 -6.293 1.00 0.00 C ATOM 1773 C LEU A 110 -10.916 3.689 -6.738 1.00 0.00 C ATOM 1774 O LEU A 110 -10.801 4.014 -7.904 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.299 2.109 -5.707 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.411 1.936 -4.196 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.096 1.400 -3.629 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -9.737 3.295 -3.578 1.00 0.00 C ATOM 0 H LEU A 110 -10.197 0.543 -7.474 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.437 1.977 -5.538 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.786 1.254 -6.147 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -8.705 2.992 -5.942 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.200 1.222 -3.960 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.187 1.280 -2.549 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -7.870 0.435 -4.083 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.292 2.102 -3.850 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -9.821 3.192 -2.496 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -8.942 4.002 -3.814 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.681 3.662 -3.982 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.249 4.558 -5.826 1.00 0.00 N ATOM 1791 CA ASN A 111 -11.499 5.972 -6.209 1.00 0.00 C ATOM 1792 C ASN A 111 -11.254 6.894 -5.013 1.00 0.00 C ATOM 1793 O ASN A 111 -11.551 6.556 -3.889 1.00 0.00 O ATOM 1794 CB ASN A 111 -12.958 6.085 -6.638 1.00 0.00 C ATOM 1795 CG ASN A 111 -13.057 6.669 -8.048 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -12.812 5.983 -9.021 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -13.421 7.912 -8.202 1.00 0.00 N ATOM 0 H ASN A 111 -11.358 4.350 -4.834 1.00 0.00 H new ATOM 0 HA ASN A 111 -10.829 6.265 -7.017 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -13.428 5.102 -6.611 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -13.502 6.718 -5.937 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -13.500 8.308 -9.139 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -13.627 8.488 -7.386 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.725 8.061 -5.253 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.482 9.015 -4.134 1.00 0.00 C ATOM 1806 C ALA A 112 -11.710 9.025 -3.229 1.00 0.00 C ATOM 1807 O ALA A 112 -11.620 9.277 -2.045 1.00 0.00 O ATOM 1808 CB ALA A 112 -10.255 10.420 -4.695 1.00 0.00 C ATOM 0 H ALA A 112 -10.450 8.396 -6.176 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.601 8.709 -3.570 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -10.078 11.115 -3.874 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.389 10.412 -5.357 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -11.136 10.735 -5.254 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.858 8.738 -3.784 1.00 0.00 N ATOM 1815 CA ASP A 113 -14.106 8.710 -2.970 1.00 0.00 C ATOM 1816 C ASP A 113 -13.808 8.022 -1.637 1.00 0.00 C ATOM 1817 O ASP A 113 -14.051 8.562 -0.579 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.179 7.926 -3.727 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.455 8.763 -3.825 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -16.543 9.566 -4.739 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -17.324 8.585 -2.987 1.00 0.00 O ATOM 0 H ASP A 113 -12.984 8.521 -4.773 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.461 9.724 -2.788 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.822 7.672 -4.725 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.387 6.987 -3.214 1.00 0.00 H new ATOM 1826 N ASP A 114 -13.271 6.838 -1.690 1.00 0.00 N ATOM 1827 CA ASP A 114 -12.932 6.105 -0.441 1.00 0.00 C ATOM 1828 C ASP A 114 -11.441 6.299 -0.137 1.00 0.00 C ATOM 1829 O ASP A 114 -10.957 5.934 0.915 1.00 0.00 O ATOM 1830 CB ASP A 114 -13.216 4.619 -0.646 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.725 4.375 -0.592 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.274 4.421 0.497 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -15.306 4.142 -1.639 1.00 0.00 O ATOM 0 H ASP A 114 -13.050 6.342 -2.553 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.529 6.484 0.389 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.818 4.291 -1.606 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.714 4.033 0.124 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.714 6.861 -1.065 1.00 0.00 N ATOM 1839 CA PHE A 115 -9.253 7.077 -0.869 1.00 0.00 C ATOM 1840 C PHE A 115 -9.009 8.476 -0.268 1.00 0.00 C ATOM 1841 O PHE A 115 -9.615 9.438 -0.694 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.573 6.991 -2.242 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.768 5.720 -2.373 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -7.138 5.169 -1.262 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -7.644 5.103 -3.620 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -6.384 3.999 -1.385 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -6.890 3.932 -3.749 1.00 0.00 C ATOM 1848 CZ PHE A 115 -6.259 3.380 -2.630 1.00 0.00 C ATOM 0 H PHE A 115 -11.076 7.184 -1.962 1.00 0.00 H new ATOM 0 HA PHE A 115 -8.849 6.325 -0.191 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.328 7.030 -3.028 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.922 7.854 -2.383 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -7.232 5.648 -0.299 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -8.130 5.530 -4.485 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -5.899 3.574 -0.519 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -6.795 3.454 -4.713 1.00 0.00 H new ATOM 0 HZ PHE A 115 -5.676 2.476 -2.729 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.122 8.549 0.701 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.781 9.823 1.367 1.00 0.00 C ATOM 1860 C PRO A 116 -7.040 10.750 0.392 1.00 0.00 C ATOM 1861 O PRO A 116 -6.403 10.288 -0.530 1.00 0.00 O ATOM 1862 CB PRO A 116 -6.857 9.420 2.527 1.00 0.00 C ATOM 1863 CG PRO A 116 -6.682 7.883 2.478 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.395 7.378 1.217 1.00 0.00 C ATOM 0 HA PRO A 116 -8.664 10.362 1.709 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -5.891 9.918 2.437 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.286 9.726 3.481 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.625 7.618 2.453 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.106 7.420 3.369 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -6.682 7.001 0.484 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.077 6.560 1.449 1.00 0.00 H new ATOM 1872 N PRO A 117 -7.148 12.033 0.626 1.00 0.00 N ATOM 1873 CA PRO A 117 -6.493 13.046 -0.225 1.00 0.00 C ATOM 1874 C PRO A 117 -4.966 12.933 -0.130 1.00 0.00 C ATOM 1875 O PRO A 117 -4.262 13.138 -1.098 1.00 0.00 O ATOM 1876 CB PRO A 117 -6.961 14.394 0.341 1.00 0.00 C ATOM 1877 CG PRO A 117 -7.855 14.103 1.574 1.00 0.00 C ATOM 1878 CD PRO A 117 -7.933 12.578 1.747 1.00 0.00 C ATOM 0 HA PRO A 117 -6.751 12.922 -1.277 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -6.106 15.007 0.625 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -7.518 14.952 -0.412 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -7.438 14.568 2.467 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -8.851 14.523 1.432 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -7.521 12.267 2.707 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -8.965 12.228 1.715 1.00 0.00 H new ATOM 1886 N ALA A 118 -4.453 12.619 1.032 1.00 0.00 N ATOM 1887 CA ALA A 118 -2.972 12.502 1.199 1.00 0.00 C ATOM 1888 C ALA A 118 -2.355 11.836 -0.031 1.00 0.00 C ATOM 1889 O ALA A 118 -1.375 12.305 -0.578 1.00 0.00 O ATOM 1890 CB ALA A 118 -2.666 11.648 2.428 1.00 0.00 C ATOM 0 H ALA A 118 -4.997 12.438 1.875 1.00 0.00 H new ATOM 0 HA ALA A 118 -2.551 13.500 1.321 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -1.586 11.562 2.551 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -3.096 12.117 3.313 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.097 10.655 2.298 1.00 0.00 H new ATOM 1896 N ASN A 119 -2.920 10.748 -0.469 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.364 10.052 -1.661 1.00 0.00 C ATOM 1898 C ASN A 119 -3.177 10.448 -2.894 1.00 0.00 C ATOM 1899 O ASN A 119 -3.716 9.618 -3.594 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.434 8.540 -1.451 1.00 0.00 C ATOM 1901 CG ASN A 119 -1.033 8.013 -1.132 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.585 7.051 -1.719 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -0.314 8.612 -0.222 1.00 0.00 N ATOM 0 H ASN A 119 -3.742 10.310 -0.054 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.323 10.340 -1.806 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -3.119 8.305 -0.636 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.824 8.054 -2.345 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.623 8.271 -0.006 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.689 9.421 0.273 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.270 11.721 -3.147 1.00 0.00 N ATOM 1911 CA GLU A 120 -4.045 12.221 -4.320 1.00 0.00 C ATOM 1912 C GLU A 120 -3.358 11.862 -5.651 1.00 0.00 C ATOM 1913 O GLU A 120 -4.012 11.421 -6.571 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.156 13.742 -4.224 1.00 0.00 C ATOM 1915 CG GLU A 120 -5.621 14.143 -4.042 1.00 0.00 C ATOM 1916 CD GLU A 120 -5.811 15.595 -4.490 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -5.074 16.026 -5.360 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -6.689 16.249 -3.952 1.00 0.00 O ATOM 0 H GLU A 120 -2.835 12.451 -2.582 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.028 11.751 -4.303 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.562 14.107 -3.386 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.752 14.203 -5.125 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.265 13.484 -4.625 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -5.913 14.032 -2.998 1.00 0.00 H new ATOM 1925 N PRO A 121 -2.070 12.103 -5.734 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.299 11.849 -6.970 1.00 0.00 C ATOM 1927 C PRO A 121 -1.490 10.430 -7.508 1.00 0.00 C ATOM 1928 O PRO A 121 -1.585 10.228 -8.703 1.00 0.00 O ATOM 1929 CB PRO A 121 0.161 12.100 -6.574 1.00 0.00 C ATOM 1930 CG PRO A 121 0.161 12.729 -5.160 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.272 12.641 -4.615 1.00 0.00 C ATOM 0 HA PRO A 121 -1.633 12.496 -7.781 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.725 11.167 -6.578 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.643 12.766 -7.290 1.00 0.00 H new ATOM 0 HG2 PRO A 121 0.853 12.200 -4.505 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.492 13.767 -5.202 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.324 11.989 -3.743 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.637 13.620 -4.304 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.537 9.446 -6.666 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.708 8.059 -7.177 1.00 0.00 C ATOM 1941 C VAL A 122 -3.179 7.654 -7.072 1.00 0.00 C ATOM 1942 O VAL A 122 -3.689 6.922 -7.896 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.833 7.116 -6.350 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.464 5.721 -6.286 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.551 7.013 -6.994 1.00 0.00 C ATOM 0 H VAL A 122 -1.465 9.536 -5.652 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.406 8.003 -8.223 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.746 7.513 -5.339 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.829 5.061 -5.694 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.449 5.788 -5.824 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.563 5.320 -7.295 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.177 6.341 -6.406 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.453 6.624 -8.007 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.011 8.001 -7.028 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.861 8.116 -6.069 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.294 7.752 -5.932 1.00 0.00 C ATOM 1957 C ILE A 123 -6.024 8.221 -7.183 1.00 0.00 C ATOM 1958 O ILE A 123 -7.003 7.641 -7.594 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.881 8.435 -4.697 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -5.459 7.656 -3.451 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.408 8.455 -4.790 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -5.720 8.502 -2.207 1.00 0.00 C ATOM 0 H ILE A 123 -3.492 8.727 -5.340 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.404 6.674 -5.818 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.514 9.460 -4.639 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -6.014 6.720 -3.390 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.402 7.397 -3.512 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.820 8.943 -3.907 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.711 9.003 -5.682 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.782 7.433 -4.848 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -5.419 7.946 -1.319 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.146 9.426 -2.268 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.782 8.739 -2.144 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.533 9.267 -7.787 1.00 0.00 N ATOM 1975 CA ALA A 124 -6.163 9.803 -9.024 1.00 0.00 C ATOM 1976 C ALA A 124 -6.159 8.719 -10.097 1.00 0.00 C ATOM 1977 O ALA A 124 -7.059 8.613 -10.907 1.00 0.00 O ATOM 1978 CB ALA A 124 -5.342 10.993 -9.512 1.00 0.00 C ATOM 0 H ALA A 124 -4.710 9.780 -7.471 1.00 0.00 H new ATOM 0 HA ALA A 124 -7.188 10.112 -8.820 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.791 11.398 -10.419 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.324 11.763 -8.741 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -4.323 10.669 -9.725 1.00 0.00 H new ATOM 1984 N LYS A 125 -5.132 7.928 -10.105 1.00 0.00 N ATOM 1985 CA LYS A 125 -5.011 6.846 -11.117 1.00 0.00 C ATOM 1986 C LYS A 125 -5.904 5.661 -10.746 1.00 0.00 C ATOM 1987 O LYS A 125 -6.472 5.018 -11.607 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.555 6.406 -11.179 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.682 7.644 -11.374 1.00 0.00 C ATOM 1990 CD LYS A 125 -3.164 8.423 -12.601 1.00 0.00 C ATOM 1991 CE LYS A 125 -3.079 7.531 -13.841 1.00 0.00 C ATOM 1992 NZ LYS A 125 -2.733 8.364 -15.029 1.00 0.00 N ATOM 0 H LYS A 125 -4.357 7.984 -9.444 1.00 0.00 H new ATOM 0 HA LYS A 125 -5.332 7.216 -12.091 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -3.277 5.887 -10.262 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -3.406 5.704 -12.000 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.727 8.277 -10.488 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.640 7.350 -11.503 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -4.190 8.758 -12.451 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -2.554 9.316 -12.740 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -2.326 6.757 -13.694 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -4.030 7.024 -14.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.675 7.758 -15.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -3.467 9.087 -15.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -1.816 8.828 -14.872 1.00 0.00 H new ATOM 2006 N LEU A 126 -6.053 5.361 -9.482 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.937 4.219 -9.111 1.00 0.00 C ATOM 2008 C LEU A 126 -8.355 4.613 -9.480 1.00 0.00 C ATOM 2009 O LEU A 126 -9.152 3.812 -9.914 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.863 3.932 -7.606 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.460 3.432 -7.187 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.427 3.650 -8.300 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -5.009 4.203 -5.946 1.00 0.00 C ATOM 0 H LEU A 126 -5.609 5.848 -8.703 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.622 3.318 -9.637 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -7.108 4.837 -7.050 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.610 3.184 -7.341 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.528 2.363 -6.983 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.454 3.287 -7.969 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.734 3.105 -9.193 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.358 4.713 -8.530 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.021 3.858 -5.642 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.967 5.268 -6.175 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.717 4.034 -5.135 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.657 5.866 -9.339 1.00 0.00 N ATOM 2026 CA LYS A 127 -10.003 6.353 -9.713 1.00 0.00 C ATOM 2027 C LYS A 127 -10.358 5.751 -11.069 1.00 0.00 C ATOM 2028 O LYS A 127 -11.507 5.547 -11.407 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.938 7.867 -9.862 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.198 8.465 -8.666 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.800 9.829 -8.305 1.00 0.00 C ATOM 2032 CE LYS A 127 -11.314 9.699 -8.131 1.00 0.00 C ATOM 2033 NZ LYS A 127 -11.834 10.853 -7.343 1.00 0.00 N ATOM 0 H LYS A 127 -8.023 6.579 -8.978 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.741 6.076 -8.960 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.427 8.130 -10.788 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.945 8.281 -9.924 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.266 7.791 -7.812 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.140 8.576 -8.901 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -9.350 10.203 -7.385 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.576 10.554 -9.087 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -11.800 9.665 -9.106 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -11.552 8.764 -7.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -12.391 10.501 -6.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.037 11.420 -6.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -12.438 11.444 -7.950 1.00 0.00 H new ATOM 2047 N ARG A 128 -9.348 5.493 -11.849 1.00 0.00 N ATOM 2048 CA ARG A 128 -9.548 4.928 -13.206 1.00 0.00 C ATOM 2049 C ARG A 128 -9.511 3.395 -13.155 1.00 0.00 C ATOM 2050 O ARG A 128 -10.201 2.738 -13.908 1.00 0.00 O ATOM 2051 CB ARG A 128 -8.414 5.419 -14.108 1.00 0.00 C ATOM 2052 CG ARG A 128 -7.898 6.785 -13.630 1.00 0.00 C ATOM 2053 CD ARG A 128 -7.574 7.659 -14.844 1.00 0.00 C ATOM 2054 NE ARG A 128 -8.474 8.846 -14.857 1.00 0.00 N ATOM 2055 CZ ARG A 128 -8.201 9.864 -15.627 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -7.428 10.822 -15.196 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -8.700 9.922 -16.831 1.00 0.00 N ATOM 0 H ARG A 128 -8.373 5.654 -11.596 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.516 5.248 -13.591 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.599 4.695 -14.105 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -8.767 5.497 -15.136 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -8.648 7.272 -13.007 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -7.008 6.655 -13.014 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -6.533 7.979 -14.807 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -7.699 7.085 -15.762 1.00 0.00 H new ATOM 0 HE ARG A 128 -9.304 8.863 -14.264 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -7.036 10.777 -14.256 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -7.216 11.617 -15.799 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -9.303 9.172 -17.170 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -8.487 10.717 -17.433 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.690 2.840 -12.284 1.00 0.00 N ATOM 2072 CA LEU A 129 -8.547 1.345 -12.153 1.00 0.00 C ATOM 2073 C LEU A 129 -9.662 0.604 -12.896 1.00 0.00 C ATOM 2074 O LEU A 129 -10.673 0.319 -12.276 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.596 0.953 -10.676 1.00 0.00 C ATOM 2076 CG LEU A 129 -7.231 0.446 -10.226 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -6.132 1.373 -10.745 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -7.193 0.407 -8.696 1.00 0.00 C ATOM 2079 OXT LEU A 129 -9.486 0.337 -14.073 1.00 0.00 O ATOM 0 H LEU A 129 -8.100 3.373 -11.645 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.590 1.064 -12.594 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.891 1.812 -10.073 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -9.349 0.181 -10.521 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.065 -0.555 -10.625 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.160 1.003 -10.419 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.163 1.400 -11.834 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.288 2.378 -10.353 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.219 0.045 -8.365 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -7.360 1.409 -8.302 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.972 -0.262 -8.330 1.00 0.00 H new TER 2091 LEU A 129 HETATM 2092 MG MG A 132 7.154 -3.723 6.915 1.00 0.00 MG HETATM 2093 PG APC A 130 6.793 0.140 11.201 1.00 0.00 P HETATM 2094 O1G APC A 130 7.783 0.244 12.466 1.00 0.00 O HETATM 2095 O2G APC A 130 6.683 -1.258 10.730 1.00 0.00 O HETATM 2096 O3G APC A 130 5.332 0.710 11.564 1.00 0.00 O HETATM 2097 PB APC A 130 8.746 1.384 9.396 1.00 0.00 P HETATM 2098 O1B APC A 130 9.850 1.268 10.564 1.00 0.00 O HETATM 2099 O2B APC A 130 9.029 0.383 8.343 1.00 0.00 O HETATM 2100 O3B APC A 130 7.282 1.089 9.995 1.00 0.00 O HETATM 2101 PA APC A 130 10.052 3.405 9.179 1.00 0.00 P HETATM 2102 O1A APC A 130 11.160 2.614 8.598 1.00 0.00 O HETATM 2103 O2A APC A 130 10.041 3.626 10.643 1.00 0.00 O HETATM 2104 C3A APC A 130 8.778 2.745 8.809 1.00 0.00 C HETATM 2105 O5' APC A 130 10.111 4.865 8.495 1.00 0.00 O HETATM 2106 C5' APC A 130 9.092 5.311 7.595 1.00 0.00 C HETATM 2107 C4' APC A 130 8.168 6.331 8.259 1.00 0.00 C HETATM 2108 O4' APC A 130 7.732 7.337 7.325 1.00 0.00 O HETATM 2109 C3' APC A 130 6.931 5.652 8.801 1.00 0.00 C HETATM 2110 O3' APC A 130 7.016 5.468 10.219 1.00 0.00 O HETATM 2111 C2' APC A 130 5.772 6.542 8.435 1.00 0.00 C HETATM 2112 O2' APC A 130 5.202 7.150 9.594 1.00 0.00 O HETATM 2113 C1' APC A 130 6.324 7.591 7.484 1.00 0.00 C HETATM 2114 N9 APC A 130 5.606 7.513 6.199 1.00 0.00 N HETATM 2115 C8 APC A 130 5.425 6.453 5.375 1.00 0.00 C HETATM 2116 N7 APC A 130 4.657 6.616 4.353 1.00 0.00 N HETATM 2117 C5 APC A 130 4.280 7.952 4.493 1.00 0.00 C HETATM 2118 C6 APC A 130 3.464 8.788 3.729 1.00 0.00 C HETATM 2119 N6 APC A 130 2.843 8.385 2.620 1.00 0.00 N HETATM 2120 N1 APC A 130 3.317 10.057 4.142 1.00 0.00 N HETATM 2121 C2 APC A 130 3.939 10.482 5.242 1.00 0.00 C HETATM 2122 N3 APC A 130 4.727 9.776 6.046 1.00 0.00 N HETATM 2123 C4 APC A 130 4.859 8.509 5.610 1.00 0.00 C HETATM 0 HO3' APC A 130 6.202 5.028 10.541 1.00 0.00 H new HETATM 0 HO2' APC A 130 5.674 6.837 10.394 1.00 0.00 H new HETATM 0 HN62 APC A 130 2.257 9.037 2.098 1.00 0.00 H new HETATM 0 HN61 APC A 130 2.954 7.425 2.294 1.00 0.00 H new HETATM 0 H5'2 APC A 130 9.553 5.756 6.713 1.00 0.00 H new HETATM 0 H5'1 APC A 130 8.507 4.457 7.253 1.00 0.00 H new HETATM 0 H3A2 APC A 130 8.685 2.689 7.724 1.00 0.00 H new HETATM 0 H3A1 APC A 130 7.933 3.330 9.171 1.00 0.00 H new HETATM 0 H8 APC A 130 5.911 5.497 5.569 1.00 0.00 H new HETATM 0 H4' APC A 130 8.741 6.795 9.062 1.00 0.00 H new HETATM 0 H3' APC A 130 6.813 4.655 8.376 1.00 0.00 H new HETATM 0 H2' APC A 130 4.972 5.969 7.967 1.00 0.00 H new HETATM 0 H2 APC A 130 3.784 11.526 5.512 1.00 0.00 H new HETATM 0 H1' APC A 130 6.184 8.599 7.875 1.00 0.00 H new HETATM 2139 CO CON A 131 9.672 1.158 12.668 1.00 0.00 CO HETATM 2140 N1 CON A 131 11.552 2.094 12.891 1.00 0.00 N HETATM 2141 N2 CON A 131 9.504 1.021 14.768 1.00 0.00 N HETATM 2142 N3 CON A 131 8.741 3.052 12.706 1.00 0.00 N HETATM 2143 N4 CON A 131 10.609 -0.732 12.621 1.00 0.00 N HETATM 2156 O HOH A 133 8.766 -2.518 7.542 1.00 0.00 O HETATM 2159 O HOH A 134 7.152 -4.545 8.866 1.00 0.00 O