USER MOD reduce.3.24.130724 H: found=0, std=0, add=849, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 847 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 75 LYS NZ :NH3+ 148:sc= 0 (180deg=0) USER MOD Set 1.2: A 79 MET CE :methyl 151:sc= -0.147 (180deg=0) USER MOD Set 2.1: A 15 LYS NZ :NH3+ -166:sc= -0.951 (180deg=-1.21) USER MOD Set 2.2: A 77 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 6 LYS NZ :NH3+ -130:sc= -0.065 (180deg=0) USER MOD Set 3.2: A 20 LYS NZ :NH3+ -165:sc= -0.062 (180deg=-0.192) USER MOD Single : A 1 MET CE :methyl -143:sc= -5.16! (180deg=-8.33!) USER MOD Single : A 1 MET N :NH3+ 163:sc= 0.224 (180deg=0.146) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.11 K(o=-0.11,f=-4.5!) USER MOD Single : A 17 LYS NZ :NH3+ -112:sc= -20! (180deg=-23.4!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot -57:sc= 0.258 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 147:sc= -0.357 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -3.29 X(o=-3.3,f=-3.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -0.129 K(o=-0.13,f=-2.4!) USER MOD Single : A 56 ASN : amide:sc= -5.89! C(o=-5.9!,f=-4.1!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0.0412 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 HIS : no HD1:sc= -1.62 X(o=-1.6,f=-1.6) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 42:sc= -3.32! USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 TYR OH : rot 90:sc= 0.0133 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -0.0669 K(o=-0.067,f=-0.84) USER MOD Single : A 95 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.24) USER MOD Single : A 98 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.024) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.698 -3.488 3.072 1.00 0.00 N ATOM 2 CA MET A 1 16.855 -2.714 2.171 1.00 0.00 C ATOM 3 C MET A 1 16.544 -1.339 2.790 1.00 0.00 C ATOM 4 O MET A 1 16.460 -1.227 4.013 1.00 0.00 O ATOM 5 CB MET A 1 15.572 -3.499 1.886 1.00 0.00 C ATOM 6 CG MET A 1 15.667 -4.371 0.647 1.00 0.00 C ATOM 7 SD MET A 1 16.610 -5.882 0.929 1.00 0.00 S ATOM 8 CE MET A 1 17.460 -6.045 -0.640 1.00 0.00 C ATOM 0 H1 MET A 1 17.669 -4.491 2.799 1.00 0.00 H new ATOM 0 H2 MET A 1 18.677 -3.142 3.015 1.00 0.00 H new ATOM 0 H3 MET A 1 17.351 -3.384 4.047 1.00 0.00 H new ATOM 0 HA MET A 1 17.376 -2.543 1.229 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.339 -4.126 2.747 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.745 -2.799 1.767 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.663 -4.632 0.313 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.133 -3.802 -0.158 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.524 -7.099 -0.911 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.909 -5.505 -1.410 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.464 -5.630 -0.554 1.00 0.00 H new ATOM 18 N ASP A 2 16.386 -0.282 1.968 1.00 0.00 N ATOM 19 CA ASP A 2 16.103 1.049 2.515 1.00 0.00 C ATOM 20 C ASP A 2 15.002 1.722 1.727 1.00 0.00 C ATOM 21 O ASP A 2 15.188 2.088 0.577 1.00 0.00 O ATOM 22 CB ASP A 2 17.362 1.910 2.512 1.00 0.00 C ATOM 23 CG ASP A 2 17.458 2.803 3.733 1.00 0.00 C ATOM 24 OD1 ASP A 2 17.841 2.295 4.809 1.00 0.00 O ATOM 25 OD2 ASP A 2 17.151 4.007 3.613 1.00 0.00 O ATOM 0 H ASP A 2 16.448 -0.325 0.951 1.00 0.00 H new ATOM 0 HA ASP A 2 15.769 0.932 3.546 1.00 0.00 H new ATOM 0 HB2 ASP A 2 18.239 1.265 2.468 1.00 0.00 H new ATOM 0 HB3 ASP A 2 17.374 2.527 1.613 1.00 0.00 H new ATOM 30 N LEU A 3 13.853 1.878 2.316 1.00 0.00 N ATOM 31 CA LEU A 3 12.759 2.474 1.586 1.00 0.00 C ATOM 32 C LEU A 3 12.607 3.961 1.838 1.00 0.00 C ATOM 33 O LEU A 3 12.179 4.383 2.912 1.00 0.00 O ATOM 34 CB LEU A 3 11.481 1.735 1.967 1.00 0.00 C ATOM 35 CG LEU A 3 10.295 1.820 1.005 1.00 0.00 C ATOM 36 CD1 LEU A 3 9.435 3.030 1.314 1.00 0.00 C ATOM 37 CD2 LEU A 3 10.743 1.827 -0.447 1.00 0.00 C ATOM 0 H LEU A 3 13.645 1.610 3.278 1.00 0.00 H new ATOM 0 HA LEU A 3 12.968 2.377 0.521 1.00 0.00 H new ATOM 0 HB2 LEU A 3 11.730 0.682 2.100 1.00 0.00 H new ATOM 0 HB3 LEU A 3 11.153 2.110 2.937 1.00 0.00 H new ATOM 0 HG LEU A 3 9.692 0.924 1.152 1.00 0.00 H new ATOM 0 HD11 LEU A 3 8.598 3.069 0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 3 9.055 2.956 2.333 1.00 0.00 H new ATOM 0 HD13 LEU A 3 10.033 3.936 1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.870 1.888 -1.097 1.00 0.00 H new ATOM 0 HD22 LEU A 3 11.389 2.687 -0.624 1.00 0.00 H new ATOM 0 HD23 LEU A 3 11.292 0.911 -0.663 1.00 0.00 H new ATOM 49 N ILE A 4 12.870 4.750 0.799 1.00 0.00 N ATOM 50 CA ILE A 4 12.654 6.189 0.896 1.00 0.00 C ATOM 51 C ILE A 4 11.394 6.485 0.122 1.00 0.00 C ATOM 52 O ILE A 4 11.307 6.251 -1.084 1.00 0.00 O ATOM 53 CB ILE A 4 13.794 7.047 0.341 1.00 0.00 C ATOM 54 CG1 ILE A 4 14.412 6.402 -0.902 1.00 0.00 C ATOM 55 CG2 ILE A 4 14.844 7.300 1.416 1.00 0.00 C ATOM 56 CD1 ILE A 4 15.367 5.264 -0.602 1.00 0.00 C ATOM 0 H ILE A 4 13.225 4.426 -0.101 1.00 0.00 H new ATOM 0 HA ILE A 4 12.590 6.447 1.953 1.00 0.00 H new ATOM 0 HB ILE A 4 13.383 8.010 0.039 1.00 0.00 H new ATOM 0 HG12 ILE A 4 13.611 6.030 -1.541 1.00 0.00 H new ATOM 0 HG13 ILE A 4 14.943 7.167 -1.469 1.00 0.00 H new ATOM 0 HG21 ILE A 4 15.647 7.911 1.004 1.00 0.00 H new ATOM 0 HG22 ILE A 4 14.386 7.821 2.257 1.00 0.00 H new ATOM 0 HG23 ILE A 4 15.251 6.349 1.758 1.00 0.00 H new ATOM 0 HD11 ILE A 4 15.760 4.863 -1.536 1.00 0.00 H new ATOM 0 HD12 ILE A 4 16.191 5.632 0.010 1.00 0.00 H new ATOM 0 HD13 ILE A 4 14.838 4.478 -0.064 1.00 0.00 H new ATOM 68 N ILE A 5 10.397 6.890 0.858 1.00 0.00 N ATOM 69 CA ILE A 5 9.083 7.111 0.315 1.00 0.00 C ATOM 70 C ILE A 5 8.616 8.576 0.217 1.00 0.00 C ATOM 71 O ILE A 5 8.814 9.374 1.133 1.00 0.00 O ATOM 72 CB ILE A 5 8.125 6.295 1.165 1.00 0.00 C ATOM 73 CG1 ILE A 5 6.812 6.085 0.436 1.00 0.00 C ATOM 74 CG2 ILE A 5 7.958 6.941 2.524 1.00 0.00 C ATOM 75 CD1 ILE A 5 6.885 4.953 -0.558 1.00 0.00 C ATOM 0 H ILE A 5 10.472 7.078 1.858 1.00 0.00 H new ATOM 0 HA ILE A 5 9.108 6.800 -0.729 1.00 0.00 H new ATOM 0 HB ILE A 5 8.540 5.302 1.337 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.025 5.879 1.161 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.535 7.003 -0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.269 6.349 3.126 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.925 6.992 3.024 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.559 7.948 2.402 1.00 0.00 H new ATOM 0 HD11 ILE A 5 5.921 4.842 -1.054 1.00 0.00 H new ATOM 0 HD12 ILE A 5 7.653 5.170 -1.301 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.134 4.028 -0.038 1.00 0.00 H new ATOM 87 N LYS A 6 7.904 8.876 -0.871 1.00 0.00 N ATOM 88 CA LYS A 6 7.280 10.188 -1.078 1.00 0.00 C ATOM 89 C LYS A 6 5.783 9.920 -1.240 1.00 0.00 C ATOM 90 O LYS A 6 5.256 9.826 -2.350 1.00 0.00 O ATOM 91 CB LYS A 6 7.854 10.911 -2.296 1.00 0.00 C ATOM 92 CG LYS A 6 8.285 12.341 -2.005 1.00 0.00 C ATOM 93 CD LYS A 6 9.509 12.379 -1.100 1.00 0.00 C ATOM 94 CE LYS A 6 10.644 13.181 -1.721 1.00 0.00 C ATOM 95 NZ LYS A 6 11.938 12.450 -1.655 1.00 0.00 N ATOM 0 H LYS A 6 7.743 8.218 -1.634 1.00 0.00 H new ATOM 0 HA LYS A 6 7.477 10.849 -0.234 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.711 10.351 -2.671 1.00 0.00 H new ATOM 0 HB3 LYS A 6 7.107 10.919 -3.089 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.507 12.853 -2.941 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.464 12.881 -1.533 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.238 12.816 -0.139 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.848 11.362 -0.903 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.405 13.404 -2.761 1.00 0.00 H new ATOM 0 HE3 LYS A 6 10.739 14.136 -1.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 12.670 13.075 -1.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 11.833 11.613 -1.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 12.217 12.151 -2.611 1.00 0.00 H new ATOM 109 N GLU A 7 5.154 9.678 -0.097 1.00 0.00 N ATOM 110 CA GLU A 7 3.747 9.272 0.003 1.00 0.00 C ATOM 111 C GLU A 7 2.702 10.357 -0.268 1.00 0.00 C ATOM 112 O GLU A 7 2.784 11.467 0.258 1.00 0.00 O ATOM 113 CB GLU A 7 3.554 8.637 1.372 1.00 0.00 C ATOM 114 CG GLU A 7 4.765 7.805 1.772 1.00 0.00 C ATOM 115 CD GLU A 7 5.544 8.493 2.879 1.00 0.00 C ATOM 116 OE1 GLU A 7 5.221 8.275 4.064 1.00 0.00 O ATOM 117 OE2 GLU A 7 6.456 9.282 2.556 1.00 0.00 O ATOM 0 H GLU A 7 5.613 9.759 0.810 1.00 0.00 H new ATOM 0 HA GLU A 7 3.562 8.568 -0.808 1.00 0.00 H new ATOM 0 HB2 GLU A 7 3.383 9.416 2.116 1.00 0.00 H new ATOM 0 HB3 GLU A 7 2.665 8.007 1.361 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.441 6.819 2.106 1.00 0.00 H new ATOM 0 HG3 GLU A 7 5.410 7.652 0.907 1.00 0.00 H new ATOM 124 N LYS A 8 1.678 9.984 -1.069 1.00 0.00 N ATOM 125 CA LYS A 8 0.577 10.860 -1.385 1.00 0.00 C ATOM 126 C LYS A 8 -0.691 10.037 -1.198 1.00 0.00 C ATOM 127 O LYS A 8 -0.774 8.936 -1.720 1.00 0.00 O ATOM 128 CB LYS A 8 0.684 11.376 -2.822 1.00 0.00 C ATOM 129 CG LYS A 8 1.175 12.811 -2.918 1.00 0.00 C ATOM 130 CD LYS A 8 2.672 12.871 -3.177 1.00 0.00 C ATOM 131 CE LYS A 8 2.985 12.737 -4.659 1.00 0.00 C ATOM 132 NZ LYS A 8 2.852 14.036 -5.373 1.00 0.00 N ATOM 0 H LYS A 8 1.612 9.064 -1.504 1.00 0.00 H new ATOM 0 HA LYS A 8 0.576 11.738 -0.739 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.361 10.731 -3.381 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -0.293 11.302 -3.299 1.00 0.00 H new ATOM 0 HG2 LYS A 8 0.645 13.325 -3.720 1.00 0.00 H new ATOM 0 HG3 LYS A 8 0.943 13.339 -1.993 1.00 0.00 H new ATOM 0 HD2 LYS A 8 3.070 13.815 -2.804 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.170 12.074 -2.625 1.00 0.00 H new ATOM 0 HE2 LYS A 8 3.999 12.356 -4.783 1.00 0.00 H new ATOM 0 HE3 LYS A 8 2.313 12.005 -5.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 3.074 13.903 -6.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 1.878 14.387 -5.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 3.512 14.727 -4.962 1.00 0.00 H new ATOM 146 N ARG A 9 -1.654 10.501 -0.411 1.00 0.00 N ATOM 147 CA ARG A 9 -2.845 9.680 -0.174 1.00 0.00 C ATOM 148 C ARG A 9 -4.159 10.407 -0.405 1.00 0.00 C ATOM 149 O ARG A 9 -4.347 11.549 0.018 1.00 0.00 O ATOM 150 CB ARG A 9 -2.816 9.127 1.252 1.00 0.00 C ATOM 151 CG ARG A 9 -2.605 10.195 2.314 1.00 0.00 C ATOM 152 CD ARG A 9 -1.459 9.840 3.249 1.00 0.00 C ATOM 153 NE ARG A 9 -1.936 9.424 4.565 1.00 0.00 N ATOM 154 CZ ARG A 9 -1.173 9.397 5.655 1.00 0.00 C ATOM 155 NH1 ARG A 9 0.102 9.758 5.590 1.00 0.00 N ATOM 156 NH2 ARG A 9 -1.689 9.009 6.815 1.00 0.00 N ATOM 0 H ARG A 9 -1.643 11.406 0.060 1.00 0.00 H new ATOM 0 HA ARG A 9 -2.805 8.876 -0.909 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -3.754 8.609 1.451 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -2.020 8.387 1.330 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -2.399 11.151 1.833 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -3.521 10.320 2.892 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -0.866 9.038 2.808 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -0.800 10.701 3.358 1.00 0.00 H new ATOM 0 HE ARG A 9 -2.911 9.137 4.654 1.00 0.00 H new ATOM 0 HH11 ARG A 9 0.502 10.058 4.701 1.00 0.00 H new ATOM 0 HH12 ARG A 9 0.682 9.735 6.429 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -2.669 8.732 6.870 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -1.105 8.988 7.651 1.00 0.00 H new ATOM 170 N ASP A 10 -5.084 9.691 -1.040 1.00 0.00 N ATOM 171 CA ASP A 10 -6.420 10.201 -1.297 1.00 0.00 C ATOM 172 C ASP A 10 -7.445 9.206 -0.761 1.00 0.00 C ATOM 173 O ASP A 10 -7.559 8.051 -1.229 1.00 0.00 O ATOM 174 CB ASP A 10 -6.632 10.426 -2.797 1.00 0.00 C ATOM 175 CG ASP A 10 -6.109 11.771 -3.258 1.00 0.00 C ATOM 176 OD1 ASP A 10 -6.341 12.775 -2.553 1.00 0.00 O ATOM 177 OD2 ASP A 10 -5.463 11.821 -4.327 1.00 0.00 O ATOM 0 H ASP A 10 -4.925 8.745 -1.388 1.00 0.00 H new ATOM 0 HA ASP A 10 -6.542 11.159 -0.792 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -6.132 9.634 -3.355 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -7.695 10.355 -3.026 1.00 0.00 H new ATOM 182 N ASN A 11 -8.212 9.623 0.228 1.00 0.00 N ATOM 183 CA ASN A 11 -9.179 8.711 0.767 1.00 0.00 C ATOM 184 C ASN A 11 -10.600 9.125 0.423 1.00 0.00 C ATOM 185 O ASN A 11 -11.106 10.130 0.923 1.00 0.00 O ATOM 186 CB ASN A 11 -9.024 8.643 2.286 1.00 0.00 C ATOM 187 CG ASN A 11 -9.084 10.011 2.936 1.00 0.00 C ATOM 188 OD1 ASN A 11 -8.340 10.920 2.565 1.00 0.00 O ATOM 189 ND2 ASN A 11 -9.971 10.164 3.912 1.00 0.00 N ATOM 0 H ASN A 11 -8.183 10.549 0.654 1.00 0.00 H new ATOM 0 HA ASN A 11 -8.998 7.732 0.323 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -9.810 8.012 2.701 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -8.073 8.169 2.530 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -10.056 11.062 4.387 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -10.567 9.383 4.186 1.00 0.00 H new ATOM 196 N PRO A 12 -11.277 8.326 -0.413 1.00 0.00 N ATOM 197 CA PRO A 12 -12.642 8.543 -0.809 1.00 0.00 C ATOM 198 C PRO A 12 -13.532 7.538 -0.080 1.00 0.00 C ATOM 199 O PRO A 12 -13.600 7.548 1.150 1.00 0.00 O ATOM 200 CB PRO A 12 -12.541 8.248 -2.303 1.00 0.00 C ATOM 201 CG PRO A 12 -11.560 7.111 -2.380 1.00 0.00 C ATOM 202 CD PRO A 12 -10.774 7.119 -1.078 1.00 0.00 C ATOM 0 HA PRO A 12 -13.065 9.523 -0.588 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.508 7.971 -2.722 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -12.190 9.117 -2.859 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -12.079 6.161 -2.513 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -10.894 7.232 -3.234 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -10.959 6.222 -0.486 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -9.699 7.170 -1.253 1.00 0.00 H new ATOM 210 N ILE A 13 -14.175 6.643 -0.819 1.00 0.00 N ATOM 211 CA ILE A 13 -14.999 5.618 -0.208 1.00 0.00 C ATOM 212 C ILE A 13 -14.132 4.565 0.486 1.00 0.00 C ATOM 213 O ILE A 13 -14.471 4.065 1.559 1.00 0.00 O ATOM 214 CB ILE A 13 -15.859 4.896 -1.274 1.00 0.00 C ATOM 215 CG1 ILE A 13 -14.991 3.885 -2.046 1.00 0.00 C ATOM 216 CG2 ILE A 13 -16.493 5.906 -2.222 1.00 0.00 C ATOM 217 CD1 ILE A 13 -15.656 3.266 -3.255 1.00 0.00 C ATOM 0 H ILE A 13 -14.140 6.609 -1.838 1.00 0.00 H new ATOM 0 HA ILE A 13 -15.641 6.114 0.520 1.00 0.00 H new ATOM 0 HB ILE A 13 -16.664 4.355 -0.776 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -14.077 4.384 -2.368 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.695 3.088 -1.364 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.094 5.381 -2.965 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -17.129 6.587 -1.656 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -15.710 6.474 -2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -14.967 2.569 -3.732 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -16.554 2.733 -2.943 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.927 4.050 -3.963 1.00 0.00 H new ATOM 229 N LEU A 14 -13.046 4.186 -0.193 1.00 0.00 N ATOM 230 CA LEU A 14 -12.154 3.136 0.290 1.00 0.00 C ATOM 231 C LEU A 14 -10.785 3.607 0.799 1.00 0.00 C ATOM 232 O LEU A 14 -9.885 2.782 0.945 1.00 0.00 O ATOM 233 CB LEU A 14 -11.988 2.071 -0.797 1.00 0.00 C ATOM 234 CG LEU A 14 -11.047 2.410 -1.959 1.00 0.00 C ATOM 235 CD1 LEU A 14 -11.004 3.908 -2.244 1.00 0.00 C ATOM 236 CD2 LEU A 14 -9.653 1.877 -1.669 1.00 0.00 C ATOM 0 H LEU A 14 -12.765 4.595 -1.084 1.00 0.00 H new ATOM 0 HA LEU A 14 -12.640 2.724 1.174 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.629 1.157 -0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -12.972 1.851 -1.210 1.00 0.00 H new ATOM 0 HG LEU A 14 -11.437 1.927 -2.855 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -10.325 4.101 -3.074 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.003 4.258 -2.503 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.653 4.437 -1.358 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.990 2.122 -2.499 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -9.273 2.332 -0.754 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.696 0.795 -1.545 1.00 0.00 H new ATOM 248 N LYS A 15 -10.619 4.892 1.113 1.00 0.00 N ATOM 249 CA LYS A 15 -9.339 5.368 1.662 1.00 0.00 C ATOM 250 C LYS A 15 -8.110 4.872 0.874 1.00 0.00 C ATOM 251 O LYS A 15 -7.221 4.247 1.454 1.00 0.00 O ATOM 252 CB LYS A 15 -9.233 4.985 3.141 1.00 0.00 C ATOM 253 CG LYS A 15 -9.191 3.491 3.416 1.00 0.00 C ATOM 254 CD LYS A 15 -10.595 2.907 3.542 1.00 0.00 C ATOM 255 CE LYS A 15 -10.906 2.499 4.975 1.00 0.00 C ATOM 256 NZ LYS A 15 -10.822 1.024 5.161 1.00 0.00 N ATOM 0 H LYS A 15 -11.334 5.611 1.002 1.00 0.00 H new ATOM 0 HA LYS A 15 -9.335 6.453 1.563 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -8.334 5.441 3.555 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -10.082 5.414 3.674 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -8.657 2.986 2.611 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -8.634 3.304 4.334 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -11.327 3.641 3.205 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -10.689 2.040 2.888 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -10.208 2.991 5.653 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -11.905 2.843 5.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -11.263 0.763 6.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -11.320 0.547 4.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -9.824 0.731 5.165 1.00 0.00 H new ATOM 270 N ARG A 16 -8.065 5.113 -0.443 1.00 0.00 N ATOM 271 CA ARG A 16 -6.941 4.640 -1.261 1.00 0.00 C ATOM 272 C ARG A 16 -5.855 5.693 -1.360 1.00 0.00 C ATOM 273 O ARG A 16 -6.143 6.883 -1.349 1.00 0.00 O ATOM 274 CB ARG A 16 -7.422 4.270 -2.664 1.00 0.00 C ATOM 275 CG ARG A 16 -6.410 3.467 -3.464 1.00 0.00 C ATOM 276 CD ARG A 16 -6.461 3.819 -4.942 1.00 0.00 C ATOM 277 NE ARG A 16 -7.469 3.039 -5.657 1.00 0.00 N ATOM 278 CZ ARG A 16 -7.753 3.198 -6.947 1.00 0.00 C ATOM 279 NH1 ARG A 16 -7.110 4.107 -7.667 1.00 0.00 N ATOM 280 NH2 ARG A 16 -8.684 2.445 -7.517 1.00 0.00 N ATOM 0 H ARG A 16 -8.782 5.624 -0.958 1.00 0.00 H new ATOM 0 HA ARG A 16 -6.526 3.757 -0.775 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -8.345 3.696 -2.583 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -7.661 5.183 -3.209 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -5.408 3.656 -3.079 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.606 2.402 -3.336 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -6.678 4.881 -5.054 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -5.483 3.644 -5.390 1.00 0.00 H new ATOM 0 HE ARG A 16 -7.986 2.330 -5.136 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -6.394 4.689 -7.232 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -7.332 4.225 -8.656 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -9.181 1.745 -6.966 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -8.903 2.566 -8.506 1.00 0.00 H new ATOM 294 N LYS A 17 -4.598 5.277 -1.454 1.00 0.00 N ATOM 295 CA LYS A 17 -3.525 6.269 -1.547 1.00 0.00 C ATOM 296 C LYS A 17 -2.504 5.929 -2.637 1.00 0.00 C ATOM 297 O LYS A 17 -2.408 4.776 -3.076 1.00 0.00 O ATOM 298 CB LYS A 17 -2.885 6.475 -0.178 1.00 0.00 C ATOM 299 CG LYS A 17 -2.335 5.213 0.450 1.00 0.00 C ATOM 300 CD LYS A 17 -0.816 5.209 0.445 1.00 0.00 C ATOM 301 CE LYS A 17 -0.242 4.964 -0.946 1.00 0.00 C ATOM 302 NZ LYS A 17 -0.883 3.862 -1.646 1.00 0.00 N ATOM 0 H LYS A 17 -4.300 4.302 -1.468 1.00 0.00 H new ATOM 0 HA LYS A 17 -3.964 7.218 -1.857 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -2.077 7.201 -0.273 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -3.625 6.908 0.494 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -2.697 5.127 1.474 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -2.705 4.343 -0.093 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.451 6.164 0.823 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -0.455 4.438 1.126 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -0.346 5.872 -1.540 1.00 0.00 H new ATOM 0 HE3 LYS A 17 0.825 4.760 -0.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -0.208 3.077 -1.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -1.709 3.539 -1.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -1.190 4.180 -2.587 1.00 0.00 H new ATOM 316 N GLU A 18 -1.745 6.953 -3.074 1.00 0.00 N ATOM 317 CA GLU A 18 -0.732 6.796 -4.111 1.00 0.00 C ATOM 318 C GLU A 18 0.562 7.436 -3.644 1.00 0.00 C ATOM 319 O GLU A 18 0.641 8.649 -3.466 1.00 0.00 O ATOM 320 CB GLU A 18 -1.183 7.418 -5.436 1.00 0.00 C ATOM 321 CG GLU A 18 -2.405 8.316 -5.319 1.00 0.00 C ATOM 322 CD GLU A 18 -2.524 9.294 -6.471 1.00 0.00 C ATOM 323 OE1 GLU A 18 -1.648 10.175 -6.595 1.00 0.00 O ATOM 324 OE2 GLU A 18 -3.494 9.175 -7.251 1.00 0.00 O ATOM 0 H GLU A 18 -1.824 7.904 -2.714 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.577 5.731 -4.286 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.359 7.997 -5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.400 6.619 -6.145 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.302 7.698 -5.278 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.356 8.870 -4.381 1.00 0.00 H new ATOM 331 N ILE A 19 1.551 6.613 -3.416 1.00 0.00 N ATOM 332 CA ILE A 19 2.830 7.080 -2.919 1.00 0.00 C ATOM 333 C ILE A 19 3.984 6.531 -3.736 1.00 0.00 C ATOM 334 O ILE A 19 3.897 5.445 -4.301 1.00 0.00 O ATOM 335 CB ILE A 19 3.031 6.752 -1.427 1.00 0.00 C ATOM 336 CG1 ILE A 19 3.513 5.336 -1.235 1.00 0.00 C ATOM 337 CG2 ILE A 19 1.753 6.981 -0.633 1.00 0.00 C ATOM 338 CD1 ILE A 19 2.709 4.324 -1.990 1.00 0.00 C ATOM 0 H ILE A 19 1.500 5.605 -3.566 1.00 0.00 H new ATOM 0 HA ILE A 19 2.819 8.165 -3.024 1.00 0.00 H new ATOM 0 HB ILE A 19 3.797 7.430 -1.051 1.00 0.00 H new ATOM 0 HG12 ILE A 19 4.554 5.269 -1.550 1.00 0.00 H new ATOM 0 HG13 ILE A 19 3.485 5.092 -0.173 1.00 0.00 H new ATOM 0 HG21 ILE A 19 1.928 6.741 0.416 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.452 8.025 -0.721 1.00 0.00 H new ATOM 0 HG23 ILE A 19 0.962 6.342 -1.025 1.00 0.00 H new ATOM 0 HD11 ILE A 19 3.112 3.328 -1.805 1.00 0.00 H new ATOM 0 HD12 ILE A 19 1.671 4.363 -1.659 1.00 0.00 H new ATOM 0 HD13 ILE A 19 2.758 4.543 -3.057 1.00 0.00 H new ATOM 350 N LYS A 20 5.050 7.297 -3.813 1.00 0.00 N ATOM 351 CA LYS A 20 6.223 6.888 -4.587 1.00 0.00 C ATOM 352 C LYS A 20 7.262 6.254 -3.656 1.00 0.00 C ATOM 353 O LYS A 20 7.408 6.684 -2.513 1.00 0.00 O ATOM 354 CB LYS A 20 6.826 8.109 -5.250 1.00 0.00 C ATOM 355 CG LYS A 20 7.748 8.852 -4.312 1.00 0.00 C ATOM 356 CD LYS A 20 9.177 8.359 -4.461 1.00 0.00 C ATOM 357 CE LYS A 20 10.175 9.506 -4.453 1.00 0.00 C ATOM 358 NZ LYS A 20 11.088 9.438 -3.279 1.00 0.00 N ATOM 0 H LYS A 20 5.138 8.204 -3.355 1.00 0.00 H new ATOM 0 HA LYS A 20 5.926 6.161 -5.343 1.00 0.00 H new ATOM 0 HB2 LYS A 20 7.378 7.806 -6.139 1.00 0.00 H new ATOM 0 HB3 LYS A 20 6.029 8.775 -5.581 1.00 0.00 H new ATOM 0 HG2 LYS A 20 7.703 9.921 -4.521 1.00 0.00 H new ATOM 0 HG3 LYS A 20 7.416 8.714 -3.283 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.410 7.669 -3.650 1.00 0.00 H new ATOM 0 HD3 LYS A 20 9.273 7.800 -5.392 1.00 0.00 H new ATOM 0 HE2 LYS A 20 10.762 9.483 -5.371 1.00 0.00 H new ATOM 0 HE3 LYS A 20 9.638 10.455 -4.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.575 10.350 -3.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.537 9.230 -2.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.791 8.687 -3.429 1.00 0.00 H new ATOM 372 N TYR A 21 7.941 5.196 -4.112 1.00 0.00 N ATOM 373 CA TYR A 21 8.897 4.507 -3.238 1.00 0.00 C ATOM 374 C TYR A 21 10.221 4.066 -3.904 1.00 0.00 C ATOM 375 O TYR A 21 10.269 3.752 -5.094 1.00 0.00 O ATOM 376 CB TYR A 21 8.176 3.285 -2.650 1.00 0.00 C ATOM 377 CG TYR A 21 8.305 2.018 -3.484 1.00 0.00 C ATOM 378 CD1 TYR A 21 8.272 2.068 -4.874 1.00 0.00 C ATOM 379 CD2 TYR A 21 8.453 0.776 -2.881 1.00 0.00 C ATOM 380 CE1 TYR A 21 8.388 0.919 -5.634 1.00 0.00 C ATOM 381 CE2 TYR A 21 8.569 -0.377 -3.635 1.00 0.00 C ATOM 382 CZ TYR A 21 8.536 -0.301 -5.010 1.00 0.00 C ATOM 383 OH TYR A 21 8.651 -1.446 -5.763 1.00 0.00 O ATOM 0 H TYR A 21 7.852 4.807 -5.051 1.00 0.00 H new ATOM 0 HA TYR A 21 9.209 5.226 -2.481 1.00 0.00 H new ATOM 0 HB2 TYR A 21 8.570 3.091 -1.653 1.00 0.00 H new ATOM 0 HB3 TYR A 21 7.119 3.523 -2.534 1.00 0.00 H new ATOM 0 HD1 TYR A 21 8.154 3.021 -5.368 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.478 0.709 -1.803 1.00 0.00 H new ATOM 0 HE1 TYR A 21 8.363 0.977 -6.712 1.00 0.00 H new ATOM 0 HE2 TYR A 21 8.685 -1.334 -3.148 1.00 0.00 H new ATOM 0 HH TYR A 21 8.749 -2.219 -5.169 1.00 0.00 H new ATOM 393 N VAL A 22 11.269 3.957 -3.069 1.00 0.00 N ATOM 394 CA VAL A 22 12.591 3.445 -3.487 1.00 0.00 C ATOM 395 C VAL A 22 13.138 2.566 -2.368 1.00 0.00 C ATOM 396 O VAL A 22 13.197 2.988 -1.222 1.00 0.00 O ATOM 397 CB VAL A 22 13.668 4.528 -3.831 1.00 0.00 C ATOM 398 CG1 VAL A 22 15.081 4.077 -3.425 1.00 0.00 C ATOM 399 CG2 VAL A 22 13.680 4.823 -5.317 1.00 0.00 C ATOM 0 H VAL A 22 11.226 4.221 -2.085 1.00 0.00 H new ATOM 0 HA VAL A 22 12.413 2.906 -4.418 1.00 0.00 H new ATOM 0 HB VAL A 22 13.398 5.422 -3.269 1.00 0.00 H new ATOM 0 HG11 VAL A 22 15.799 4.856 -3.681 1.00 0.00 H new ATOM 0 HG12 VAL A 22 15.110 3.895 -2.351 1.00 0.00 H new ATOM 0 HG13 VAL A 22 15.337 3.160 -3.956 1.00 0.00 H new ATOM 0 HG21 VAL A 22 14.436 5.578 -5.532 1.00 0.00 H new ATOM 0 HG22 VAL A 22 13.911 3.911 -5.867 1.00 0.00 H new ATOM 0 HG23 VAL A 22 12.701 5.192 -5.623 1.00 0.00 H new ATOM 409 N LEU A 23 13.570 1.368 -2.713 1.00 0.00 N ATOM 410 CA LEU A 23 14.137 0.458 -1.776 1.00 0.00 C ATOM 411 C LEU A 23 15.610 0.398 -2.082 1.00 0.00 C ATOM 412 O LEU A 23 16.000 0.151 -3.223 1.00 0.00 O ATOM 413 CB LEU A 23 13.504 -0.935 -1.954 1.00 0.00 C ATOM 414 CG LEU A 23 13.980 -2.032 -0.988 1.00 0.00 C ATOM 415 CD1 LEU A 23 12.985 -2.223 0.151 1.00 0.00 C ATOM 416 CD2 LEU A 23 14.183 -3.352 -1.734 1.00 0.00 C ATOM 0 H LEU A 23 13.530 1.009 -3.667 1.00 0.00 H new ATOM 0 HA LEU A 23 13.959 0.779 -0.749 1.00 0.00 H new ATOM 0 HB2 LEU A 23 12.424 -0.835 -1.851 1.00 0.00 H new ATOM 0 HB3 LEU A 23 13.697 -1.270 -2.973 1.00 0.00 H new ATOM 0 HG LEU A 23 14.933 -1.716 -0.564 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.344 -3.004 0.821 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.882 -1.290 0.704 1.00 0.00 H new ATOM 0 HD13 LEU A 23 12.016 -2.512 -0.257 1.00 0.00 H new ATOM 0 HD21 LEU A 23 14.520 -4.117 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 23 13.241 -3.663 -2.186 1.00 0.00 H new ATOM 0 HD23 LEU A 23 14.933 -3.218 -2.514 1.00 0.00 H new ATOM 428 N LYS A 24 16.430 0.631 -1.090 1.00 0.00 N ATOM 429 CA LYS A 24 17.843 0.603 -1.313 1.00 0.00 C ATOM 430 C LYS A 24 18.343 -0.711 -0.809 1.00 0.00 C ATOM 431 O LYS A 24 18.183 -1.058 0.350 1.00 0.00 O ATOM 432 CB LYS A 24 18.521 1.761 -0.579 1.00 0.00 C ATOM 433 CG LYS A 24 17.817 3.096 -0.777 1.00 0.00 C ATOM 434 CD LYS A 24 18.375 4.169 0.147 1.00 0.00 C ATOM 435 CE LYS A 24 18.320 5.541 -0.500 1.00 0.00 C ATOM 436 NZ LYS A 24 19.656 6.196 -0.532 1.00 0.00 N ATOM 0 H LYS A 24 16.144 0.839 -0.133 1.00 0.00 H new ATOM 0 HA LYS A 24 18.071 0.715 -2.373 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.560 1.533 0.486 1.00 0.00 H new ATOM 0 HB3 LYS A 24 19.551 1.847 -0.924 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.927 3.415 -1.813 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.750 2.976 -0.592 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.807 4.181 1.077 1.00 0.00 H new ATOM 0 HD3 LYS A 24 19.406 3.928 0.406 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.938 5.447 -1.516 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.620 6.172 0.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.574 7.130 -0.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 20.011 6.309 0.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 20.318 5.607 -1.076 1.00 0.00 H new ATOM 450 N PHE A 25 18.914 -1.464 -1.707 1.00 0.00 N ATOM 451 CA PHE A 25 19.372 -2.771 -1.361 1.00 0.00 C ATOM 452 C PHE A 25 20.884 -2.855 -1.362 1.00 0.00 C ATOM 453 O PHE A 25 21.553 -2.387 -2.282 1.00 0.00 O ATOM 454 CB PHE A 25 18.746 -3.763 -2.333 1.00 0.00 C ATOM 455 CG PHE A 25 18.820 -3.348 -3.778 1.00 0.00 C ATOM 456 CD1 PHE A 25 17.811 -2.587 -4.352 1.00 0.00 C ATOM 457 CD2 PHE A 25 19.896 -3.725 -4.562 1.00 0.00 C ATOM 458 CE1 PHE A 25 17.881 -2.212 -5.680 1.00 0.00 C ATOM 459 CE2 PHE A 25 19.970 -3.352 -5.891 1.00 0.00 C ATOM 460 CZ PHE A 25 18.961 -2.593 -6.450 1.00 0.00 C ATOM 0 H PHE A 25 19.071 -1.193 -2.678 1.00 0.00 H new ATOM 0 HA PHE A 25 19.064 -3.012 -0.344 1.00 0.00 H new ATOM 0 HB2 PHE A 25 19.241 -4.727 -2.219 1.00 0.00 H new ATOM 0 HB3 PHE A 25 17.700 -3.908 -2.062 1.00 0.00 H new ATOM 0 HD1 PHE A 25 16.963 -2.285 -3.755 1.00 0.00 H new ATOM 0 HD2 PHE A 25 20.688 -4.318 -4.130 1.00 0.00 H new ATOM 0 HE1 PHE A 25 17.090 -1.620 -6.116 1.00 0.00 H new ATOM 0 HE2 PHE A 25 20.816 -3.654 -6.491 1.00 0.00 H new ATOM 0 HZ PHE A 25 19.017 -2.298 -7.487 1.00 0.00 H new ATOM 470 N ASP A 26 21.409 -3.455 -0.303 1.00 0.00 N ATOM 471 CA ASP A 26 22.852 -3.604 -0.149 1.00 0.00 C ATOM 472 C ASP A 26 23.210 -4.937 0.500 1.00 0.00 C ATOM 473 O ASP A 26 22.622 -5.320 1.510 1.00 0.00 O ATOM 474 CB ASP A 26 23.416 -2.453 0.685 1.00 0.00 C ATOM 475 CG ASP A 26 24.921 -2.533 0.844 1.00 0.00 C ATOM 476 OD1 ASP A 26 25.627 -2.579 -0.187 1.00 0.00 O ATOM 477 OD2 ASP A 26 25.397 -2.545 1.999 1.00 0.00 O ATOM 0 H ASP A 26 20.860 -3.846 0.462 1.00 0.00 H new ATOM 0 HA ASP A 26 23.296 -3.582 -1.144 1.00 0.00 H new ATOM 0 HB2 ASP A 26 23.154 -1.505 0.214 1.00 0.00 H new ATOM 0 HB3 ASP A 26 22.949 -2.460 1.670 1.00 0.00 H new ATOM 482 N SER A 27 24.181 -5.635 -0.102 1.00 0.00 N ATOM 483 CA SER A 27 24.650 -6.938 0.379 1.00 0.00 C ATOM 484 C SER A 27 23.947 -8.045 -0.383 1.00 0.00 C ATOM 485 O SER A 27 23.170 -8.817 0.180 1.00 0.00 O ATOM 486 CB SER A 27 24.438 -7.103 1.892 1.00 0.00 C ATOM 487 OG SER A 27 23.130 -7.569 2.187 1.00 0.00 O ATOM 0 H SER A 27 24.664 -5.310 -0.939 1.00 0.00 H new ATOM 0 HA SER A 27 25.723 -6.998 0.199 1.00 0.00 H new ATOM 0 HB2 SER A 27 25.173 -7.803 2.289 1.00 0.00 H new ATOM 0 HB3 SER A 27 24.606 -6.148 2.390 1.00 0.00 H new ATOM 0 HG SER A 27 22.470 -6.953 1.807 1.00 0.00 H new ATOM 493 N SER A 28 24.204 -8.100 -1.685 1.00 0.00 N ATOM 494 CA SER A 28 23.573 -9.089 -2.538 1.00 0.00 C ATOM 495 C SER A 28 22.074 -8.835 -2.567 1.00 0.00 C ATOM 496 O SER A 28 21.498 -8.369 -1.582 1.00 0.00 O ATOM 497 CB SER A 28 23.861 -10.504 -2.034 1.00 0.00 C ATOM 498 OG SER A 28 25.252 -10.709 -1.853 1.00 0.00 O ATOM 0 H SER A 28 24.845 -7.470 -2.168 1.00 0.00 H new ATOM 0 HA SER A 28 23.979 -9.003 -3.546 1.00 0.00 H new ATOM 0 HB2 SER A 28 23.340 -10.670 -1.091 1.00 0.00 H new ATOM 0 HB3 SER A 28 23.473 -11.233 -2.745 1.00 0.00 H new ATOM 0 HG SER A 28 25.409 -11.620 -1.529 1.00 0.00 H new ATOM 504 N ARG A 29 21.445 -9.125 -3.691 1.00 0.00 N ATOM 505 CA ARG A 29 20.013 -8.900 -3.816 1.00 0.00 C ATOM 506 C ARG A 29 19.245 -9.899 -2.972 1.00 0.00 C ATOM 507 O ARG A 29 19.185 -11.088 -3.285 1.00 0.00 O ATOM 508 CB ARG A 29 19.587 -9.026 -5.277 1.00 0.00 C ATOM 509 CG ARG A 29 18.099 -9.290 -5.470 1.00 0.00 C ATOM 510 CD ARG A 29 17.273 -8.033 -5.245 1.00 0.00 C ATOM 511 NE ARG A 29 16.628 -7.578 -6.473 1.00 0.00 N ATOM 512 CZ ARG A 29 15.706 -8.279 -7.130 1.00 0.00 C ATOM 513 NH1 ARG A 29 15.310 -9.462 -6.675 1.00 0.00 N ATOM 514 NH2 ARG A 29 15.176 -7.793 -8.245 1.00 0.00 N ATOM 0 H ARG A 29 21.894 -9.512 -4.521 1.00 0.00 H new ATOM 0 HA ARG A 29 19.790 -7.893 -3.463 1.00 0.00 H new ATOM 0 HB2 ARG A 29 19.854 -8.109 -5.802 1.00 0.00 H new ATOM 0 HB3 ARG A 29 20.152 -9.835 -5.741 1.00 0.00 H new ATOM 0 HG2 ARG A 29 17.923 -9.666 -6.478 1.00 0.00 H new ATOM 0 HG3 ARG A 29 17.774 -10.068 -4.779 1.00 0.00 H new ATOM 0 HD2 ARG A 29 16.514 -8.228 -4.487 1.00 0.00 H new ATOM 0 HD3 ARG A 29 17.915 -7.242 -4.857 1.00 0.00 H new ATOM 0 HE ARG A 29 16.899 -6.670 -6.850 1.00 0.00 H new ATOM 0 HH11 ARG A 29 15.713 -9.839 -5.817 1.00 0.00 H new ATOM 0 HH12 ARG A 29 14.603 -9.993 -7.183 1.00 0.00 H new ATOM 0 HH21 ARG A 29 15.475 -6.884 -8.598 1.00 0.00 H new ATOM 0 HH22 ARG A 29 14.470 -8.329 -8.750 1.00 0.00 H new ATOM 528 N THR A 30 18.656 -9.399 -1.902 1.00 0.00 N ATOM 529 CA THR A 30 17.880 -10.229 -1.003 1.00 0.00 C ATOM 530 C THR A 30 16.437 -9.738 -0.902 1.00 0.00 C ATOM 531 O THR A 30 16.166 -8.710 -0.279 1.00 0.00 O ATOM 532 CB THR A 30 18.572 -10.254 0.353 1.00 0.00 C ATOM 533 OG1 THR A 30 18.153 -11.370 1.117 1.00 0.00 O ATOM 534 CG2 THR A 30 18.349 -9.008 1.188 1.00 0.00 C ATOM 0 H THR A 30 18.701 -8.416 -1.634 1.00 0.00 H new ATOM 0 HA THR A 30 17.827 -11.246 -1.392 1.00 0.00 H new ATOM 0 HB THR A 30 19.634 -10.313 0.117 1.00 0.00 H new ATOM 0 HG1 THR A 30 18.612 -11.365 1.983 1.00 0.00 H new ATOM 0 HG21 THR A 30 18.875 -9.107 2.137 1.00 0.00 H new ATOM 0 HG22 THR A 30 18.728 -8.138 0.652 1.00 0.00 H new ATOM 0 HG23 THR A 30 17.283 -8.882 1.376 1.00 0.00 H new ATOM 542 N PRO A 31 15.482 -10.456 -1.513 1.00 0.00 N ATOM 543 CA PRO A 31 14.081 -10.069 -1.478 1.00 0.00 C ATOM 544 C PRO A 31 13.351 -10.660 -0.279 1.00 0.00 C ATOM 545 O PRO A 31 13.385 -11.870 -0.058 1.00 0.00 O ATOM 546 CB PRO A 31 13.549 -10.668 -2.775 1.00 0.00 C ATOM 547 CG PRO A 31 14.354 -11.913 -2.974 1.00 0.00 C ATOM 548 CD PRO A 31 15.688 -11.690 -2.292 1.00 0.00 C ATOM 0 HA PRO A 31 13.942 -8.992 -1.388 1.00 0.00 H new ATOM 0 HB2 PRO A 31 12.485 -10.892 -2.701 1.00 0.00 H new ATOM 0 HB3 PRO A 31 13.672 -9.978 -3.610 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.842 -12.776 -2.548 1.00 0.00 H new ATOM 0 HG3 PRO A 31 14.493 -12.117 -4.036 1.00 0.00 H new ATOM 0 HD2 PRO A 31 15.954 -12.529 -1.649 1.00 0.00 H new ATOM 0 HD3 PRO A 31 16.494 -11.576 -3.017 1.00 0.00 H new ATOM 556 N SER A 32 12.680 -9.806 0.489 1.00 0.00 N ATOM 557 CA SER A 32 11.934 -10.269 1.651 1.00 0.00 C ATOM 558 C SER A 32 10.479 -9.833 1.549 1.00 0.00 C ATOM 559 O SER A 32 10.180 -8.815 0.937 1.00 0.00 O ATOM 560 CB SER A 32 12.562 -9.685 2.924 1.00 0.00 C ATOM 561 OG SER A 32 12.480 -10.601 4.002 1.00 0.00 O ATOM 0 H SER A 32 12.638 -8.800 0.329 1.00 0.00 H new ATOM 0 HA SER A 32 11.972 -11.358 1.690 1.00 0.00 H new ATOM 0 HB2 SER A 32 13.606 -9.434 2.735 1.00 0.00 H new ATOM 0 HB3 SER A 32 12.054 -8.758 3.191 1.00 0.00 H new ATOM 0 HG SER A 32 13.265 -10.497 4.580 1.00 0.00 H new ATOM 567 N ARG A 33 9.575 -10.594 2.156 1.00 0.00 N ATOM 568 CA ARG A 33 8.159 -10.238 2.124 1.00 0.00 C ATOM 569 C ARG A 33 7.853 -9.060 3.048 1.00 0.00 C ATOM 570 O ARG A 33 7.202 -8.093 2.654 1.00 0.00 O ATOM 571 CB ARG A 33 7.290 -11.442 2.503 1.00 0.00 C ATOM 572 CG ARG A 33 7.787 -12.210 3.721 1.00 0.00 C ATOM 573 CD ARG A 33 8.044 -13.673 3.394 1.00 0.00 C ATOM 574 NE ARG A 33 7.582 -14.562 4.455 1.00 0.00 N ATOM 575 CZ ARG A 33 6.311 -14.925 4.617 1.00 0.00 C ATOM 576 NH1 ARG A 33 5.374 -14.476 3.790 1.00 0.00 N ATOM 577 NH2 ARG A 33 5.976 -15.739 5.608 1.00 0.00 N ATOM 0 H ARG A 33 9.791 -11.449 2.669 1.00 0.00 H new ATOM 0 HA ARG A 33 7.923 -9.936 1.104 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.274 -11.097 2.694 1.00 0.00 H new ATOM 0 HB3 ARG A 33 7.241 -12.123 1.653 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.705 -11.753 4.091 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.051 -12.139 4.522 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.541 -13.930 2.462 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.111 -13.826 3.233 1.00 0.00 H new ATOM 0 HE ARG A 33 8.273 -14.927 5.111 1.00 0.00 H new ATOM 0 HH11 ARG A 33 5.626 -13.850 3.026 1.00 0.00 H new ATOM 0 HH12 ARG A 33 4.402 -14.758 3.919 1.00 0.00 H new ATOM 0 HH21 ARG A 33 6.692 -16.087 6.246 1.00 0.00 H new ATOM 0 HH22 ARG A 33 5.003 -16.017 5.732 1.00 0.00 H new ATOM 591 N GLU A 34 8.320 -9.172 4.287 1.00 0.00 N ATOM 592 CA GLU A 34 8.102 -8.152 5.310 1.00 0.00 C ATOM 593 C GLU A 34 8.982 -6.918 5.140 1.00 0.00 C ATOM 594 O GLU A 34 8.504 -5.793 5.252 1.00 0.00 O ATOM 595 CB GLU A 34 8.334 -8.756 6.696 1.00 0.00 C ATOM 596 CG GLU A 34 7.360 -8.253 7.750 1.00 0.00 C ATOM 597 CD GLU A 34 7.403 -9.076 9.023 1.00 0.00 C ATOM 598 OE1 GLU A 34 7.268 -10.314 8.934 1.00 0.00 O ATOM 599 OE2 GLU A 34 7.570 -8.482 10.108 1.00 0.00 O ATOM 0 H GLU A 34 8.861 -9.973 4.612 1.00 0.00 H new ATOM 0 HA GLU A 34 7.070 -7.818 5.199 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.255 -9.841 6.628 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.351 -8.530 7.016 1.00 0.00 H new ATOM 0 HG2 GLU A 34 7.590 -7.214 7.985 1.00 0.00 H new ATOM 0 HG3 GLU A 34 6.349 -8.272 7.344 1.00 0.00 H new ATOM 606 N GLU A 35 10.281 -7.132 4.949 1.00 0.00 N ATOM 607 CA GLU A 35 11.225 -6.019 4.867 1.00 0.00 C ATOM 608 C GLU A 35 10.891 -5.011 3.768 1.00 0.00 C ATOM 609 O GLU A 35 10.783 -3.823 4.054 1.00 0.00 O ATOM 610 CB GLU A 35 12.640 -6.555 4.650 1.00 0.00 C ATOM 611 CG GLU A 35 13.013 -7.693 5.586 1.00 0.00 C ATOM 612 CD GLU A 35 14.509 -7.917 5.667 1.00 0.00 C ATOM 613 OE1 GLU A 35 15.238 -6.956 5.988 1.00 0.00 O ATOM 614 OE2 GLU A 35 14.952 -9.056 5.405 1.00 0.00 O ATOM 0 H GLU A 35 10.702 -8.056 4.849 1.00 0.00 H new ATOM 0 HA GLU A 35 11.153 -5.486 5.815 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.735 -6.898 3.620 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.352 -5.740 4.782 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.627 -7.479 6.583 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.530 -8.610 5.247 1.00 0.00 H new ATOM 621 N ILE A 36 10.720 -5.455 2.529 1.00 0.00 N ATOM 622 CA ILE A 36 10.404 -4.514 1.454 1.00 0.00 C ATOM 623 C ILE A 36 8.955 -4.052 1.538 1.00 0.00 C ATOM 624 O ILE A 36 8.669 -2.866 1.592 1.00 0.00 O ATOM 625 CB ILE A 36 10.683 -5.112 0.052 1.00 0.00 C ATOM 626 CG1 ILE A 36 10.351 -4.094 -1.043 1.00 0.00 C ATOM 627 CG2 ILE A 36 9.895 -6.393 -0.161 1.00 0.00 C ATOM 628 CD1 ILE A 36 10.545 -4.627 -2.447 1.00 0.00 C ATOM 0 H ILE A 36 10.791 -6.432 2.245 1.00 0.00 H new ATOM 0 HA ILE A 36 11.061 -3.655 1.590 1.00 0.00 H new ATOM 0 HB ILE A 36 11.745 -5.352 -0.005 1.00 0.00 H new ATOM 0 HG12 ILE A 36 9.316 -3.772 -0.926 1.00 0.00 H new ATOM 0 HG13 ILE A 36 10.977 -3.212 -0.909 1.00 0.00 H new ATOM 0 HG21 ILE A 36 10.109 -6.791 -1.153 1.00 0.00 H new ATOM 0 HG22 ILE A 36 10.180 -7.126 0.594 1.00 0.00 H new ATOM 0 HG23 ILE A 36 8.829 -6.182 -0.077 1.00 0.00 H new ATOM 0 HD11 ILE A 36 10.291 -3.851 -3.169 1.00 0.00 H new ATOM 0 HD12 ILE A 36 11.585 -4.923 -2.583 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.899 -5.491 -2.601 1.00 0.00 H new ATOM 640 N LYS A 37 8.055 -5.007 1.548 1.00 0.00 N ATOM 641 CA LYS A 37 6.610 -4.737 1.614 1.00 0.00 C ATOM 642 C LYS A 37 6.208 -3.918 2.817 1.00 0.00 C ATOM 643 O LYS A 37 5.548 -2.889 2.669 1.00 0.00 O ATOM 644 CB LYS A 37 5.819 -6.045 1.579 1.00 0.00 C ATOM 645 CG LYS A 37 4.433 -5.901 0.970 1.00 0.00 C ATOM 646 CD LYS A 37 3.867 -7.249 0.551 1.00 0.00 C ATOM 647 CE LYS A 37 4.299 -7.625 -0.860 1.00 0.00 C ATOM 648 NZ LYS A 37 5.033 -8.922 -0.889 1.00 0.00 N ATOM 0 H LYS A 37 8.289 -5.999 1.511 1.00 0.00 H new ATOM 0 HA LYS A 37 6.371 -4.138 0.735 1.00 0.00 H new ATOM 0 HB2 LYS A 37 6.382 -6.785 1.010 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.723 -6.429 2.595 1.00 0.00 H new ATOM 0 HG2 LYS A 37 3.764 -5.432 1.692 1.00 0.00 H new ATOM 0 HG3 LYS A 37 4.481 -5.240 0.104 1.00 0.00 H new ATOM 0 HD2 LYS A 37 4.199 -8.017 1.250 1.00 0.00 H new ATOM 0 HD3 LYS A 37 2.779 -7.219 0.603 1.00 0.00 H new ATOM 0 HE2 LYS A 37 3.421 -7.690 -1.503 1.00 0.00 H new ATOM 0 HE3 LYS A 37 4.935 -6.839 -1.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 5.310 -9.142 -1.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 5.884 -8.853 -0.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 4.418 -9.677 -0.525 1.00 0.00 H new ATOM 662 N GLU A 38 6.567 -4.347 4.000 1.00 0.00 N ATOM 663 CA GLU A 38 6.182 -3.591 5.164 1.00 0.00 C ATOM 664 C GLU A 38 6.903 -2.248 5.194 1.00 0.00 C ATOM 665 O GLU A 38 6.266 -1.203 5.268 1.00 0.00 O ATOM 666 CB GLU A 38 6.407 -4.409 6.429 1.00 0.00 C ATOM 667 CG GLU A 38 7.645 -4.024 7.233 1.00 0.00 C ATOM 668 CD GLU A 38 7.761 -4.800 8.531 1.00 0.00 C ATOM 669 OE1 GLU A 38 6.722 -5.287 9.026 1.00 0.00 O ATOM 670 OE2 GLU A 38 8.890 -4.924 9.052 1.00 0.00 O ATOM 0 H GLU A 38 7.110 -5.191 4.181 1.00 0.00 H new ATOM 0 HA GLU A 38 5.115 -3.373 5.113 1.00 0.00 H new ATOM 0 HB2 GLU A 38 5.531 -4.309 7.069 1.00 0.00 H new ATOM 0 HB3 GLU A 38 6.483 -5.461 6.155 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.535 -4.199 6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.614 -2.957 7.453 1.00 0.00 H new ATOM 677 N LEU A 39 8.223 -2.249 5.101 1.00 0.00 N ATOM 678 CA LEU A 39 8.942 -0.987 5.108 1.00 0.00 C ATOM 679 C LEU A 39 8.429 -0.063 3.996 1.00 0.00 C ATOM 680 O LEU A 39 8.439 1.156 4.152 1.00 0.00 O ATOM 681 CB LEU A 39 10.459 -1.225 5.061 1.00 0.00 C ATOM 682 CG LEU A 39 11.208 -0.627 3.877 1.00 0.00 C ATOM 683 CD1 LEU A 39 12.642 -0.309 4.266 1.00 0.00 C ATOM 684 CD2 LEU A 39 11.174 -1.577 2.694 1.00 0.00 C ATOM 0 H LEU A 39 8.804 -3.084 5.022 1.00 0.00 H new ATOM 0 HA LEU A 39 8.747 -0.467 6.046 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.895 -0.825 5.977 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.635 -2.301 5.067 1.00 0.00 H new ATOM 0 HG LEU A 39 10.715 0.301 3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 39 13.165 0.118 3.410 1.00 0.00 H new ATOM 0 HD12 LEU A 39 12.646 0.407 5.088 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.145 -1.224 4.580 1.00 0.00 H new ATOM 0 HD21 LEU A 39 11.714 -1.135 1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.645 -2.520 2.971 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.139 -1.759 2.403 1.00 0.00 H new ATOM 696 N ILE A 40 7.954 -0.637 2.883 1.00 0.00 N ATOM 697 CA ILE A 40 7.416 0.183 1.798 1.00 0.00 C ATOM 698 C ILE A 40 6.019 0.703 2.107 1.00 0.00 C ATOM 699 O ILE A 40 5.813 1.892 2.042 1.00 0.00 O ATOM 700 CB ILE A 40 7.464 -0.502 0.422 1.00 0.00 C ATOM 701 CG1 ILE A 40 6.528 -1.691 0.350 1.00 0.00 C ATOM 702 CG2 ILE A 40 8.893 -0.922 0.102 1.00 0.00 C ATOM 703 CD1 ILE A 40 6.609 -2.413 -0.976 1.00 0.00 C ATOM 0 H ILE A 40 7.932 -1.643 2.715 1.00 0.00 H new ATOM 0 HA ILE A 40 8.085 1.041 1.733 1.00 0.00 H new ATOM 0 HB ILE A 40 7.126 0.218 -0.324 1.00 0.00 H new ATOM 0 HG12 ILE A 40 6.768 -2.387 1.154 1.00 0.00 H new ATOM 0 HG13 ILE A 40 5.505 -1.354 0.514 1.00 0.00 H new ATOM 0 HG21 ILE A 40 8.920 -1.407 -0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.536 -0.042 0.088 1.00 0.00 H new ATOM 0 HG23 ILE A 40 9.247 -1.618 0.863 1.00 0.00 H new ATOM 0 HD11 ILE A 40 5.918 -3.256 -0.974 1.00 0.00 H new ATOM 0 HD12 ILE A 40 6.342 -1.727 -1.780 1.00 0.00 H new ATOM 0 HD13 ILE A 40 7.625 -2.776 -1.131 1.00 0.00 H new ATOM 715 N ALA A 41 5.062 -0.159 2.455 1.00 0.00 N ATOM 716 CA ALA A 41 3.698 0.313 2.770 1.00 0.00 C ATOM 717 C ALA A 41 3.692 1.216 3.983 1.00 0.00 C ATOM 718 O ALA A 41 3.090 2.299 4.001 1.00 0.00 O ATOM 719 CB ALA A 41 2.771 -0.846 3.071 1.00 0.00 C ATOM 0 H ALA A 41 5.194 -1.168 2.527 1.00 0.00 H new ATOM 0 HA ALA A 41 3.355 0.858 1.890 1.00 0.00 H new ATOM 0 HB1 ALA A 41 1.775 -0.466 3.299 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.718 -1.504 2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.151 -1.403 3.927 1.00 0.00 H new ATOM 725 N LYS A 42 4.354 0.737 5.010 1.00 0.00 N ATOM 726 CA LYS A 42 4.420 1.442 6.258 1.00 0.00 C ATOM 727 C LYS A 42 4.938 2.836 6.000 1.00 0.00 C ATOM 728 O LYS A 42 4.274 3.817 6.349 1.00 0.00 O ATOM 729 CB LYS A 42 5.264 0.610 7.222 1.00 0.00 C ATOM 730 CG LYS A 42 4.771 -0.845 7.272 1.00 0.00 C ATOM 731 CD LYS A 42 5.306 -1.600 8.474 1.00 0.00 C ATOM 732 CE LYS A 42 4.478 -2.850 8.754 1.00 0.00 C ATOM 733 NZ LYS A 42 3.710 -2.733 10.024 1.00 0.00 N ATOM 0 H LYS A 42 4.859 -0.149 4.999 1.00 0.00 H new ATOM 0 HA LYS A 42 3.445 1.571 6.728 1.00 0.00 H new ATOM 0 HB2 LYS A 42 6.308 0.633 6.910 1.00 0.00 H new ATOM 0 HB3 LYS A 42 5.220 1.047 8.220 1.00 0.00 H new ATOM 0 HG2 LYS A 42 3.681 -0.855 7.297 1.00 0.00 H new ATOM 0 HG3 LYS A 42 5.074 -1.359 6.360 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.344 -1.881 8.298 1.00 0.00 H new ATOM 0 HD3 LYS A 42 5.295 -0.950 9.349 1.00 0.00 H new ATOM 0 HE2 LYS A 42 3.789 -3.022 7.927 1.00 0.00 H new ATOM 0 HE3 LYS A 42 5.136 -3.717 8.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 3.160 -3.602 10.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.369 -2.594 10.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 3.063 -1.921 9.965 1.00 0.00 H new ATOM 747 N HIS A 43 6.044 2.921 5.276 1.00 0.00 N ATOM 748 CA HIS A 43 6.579 4.207 4.870 1.00 0.00 C ATOM 749 C HIS A 43 5.567 4.893 3.979 1.00 0.00 C ATOM 750 O HIS A 43 5.293 6.078 4.111 1.00 0.00 O ATOM 751 CB HIS A 43 7.853 4.024 4.069 1.00 0.00 C ATOM 752 CG HIS A 43 9.079 3.825 4.907 1.00 0.00 C ATOM 753 ND1 HIS A 43 9.158 2.888 5.917 1.00 0.00 N ATOM 754 CD2 HIS A 43 10.278 4.452 4.884 1.00 0.00 C ATOM 755 CE1 HIS A 43 10.351 2.949 6.479 1.00 0.00 C ATOM 756 NE2 HIS A 43 11.050 3.888 5.871 1.00 0.00 N ATOM 0 H HIS A 43 6.585 2.116 4.960 1.00 0.00 H new ATOM 0 HA HIS A 43 6.789 4.797 5.762 1.00 0.00 H new ATOM 0 HB2 HIS A 43 7.734 3.165 3.409 1.00 0.00 H new ATOM 0 HB3 HIS A 43 7.998 4.897 3.433 1.00 0.00 H new ATOM 0 HD1 HIS A 43 8.411 2.248 6.187 1.00 0.00 H new ATOM 0 HD2 HIS A 43 10.573 5.247 4.215 1.00 0.00 H new ATOM 0 HE1 HIS A 43 10.696 2.335 7.297 1.00 0.00 H new ATOM 765 N GLU A 44 5.003 4.099 3.075 1.00 0.00 N ATOM 766 CA GLU A 44 4.000 4.564 2.134 1.00 0.00 C ATOM 767 C GLU A 44 2.895 5.316 2.849 1.00 0.00 C ATOM 768 O GLU A 44 2.087 6.001 2.223 1.00 0.00 O ATOM 769 CB GLU A 44 3.461 3.405 1.311 1.00 0.00 C ATOM 770 CG GLU A 44 4.452 2.894 0.258 1.00 0.00 C ATOM 771 CD GLU A 44 4.162 1.489 -0.248 1.00 0.00 C ATOM 772 OE1 GLU A 44 3.072 1.259 -0.799 1.00 0.00 O ATOM 773 OE2 GLU A 44 5.046 0.624 -0.127 1.00 0.00 O ATOM 0 H GLU A 44 5.233 3.110 2.977 1.00 0.00 H new ATOM 0 HA GLU A 44 4.469 5.265 1.443 1.00 0.00 H new ATOM 0 HB2 GLU A 44 3.198 2.585 1.980 1.00 0.00 H new ATOM 0 HB3 GLU A 44 2.543 3.718 0.814 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.449 3.580 -0.589 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.456 2.915 0.681 1.00 0.00 H new ATOM 780 N GLY A 45 2.877 5.195 4.166 1.00 0.00 N ATOM 781 CA GLY A 45 1.882 5.876 4.942 1.00 0.00 C ATOM 782 C GLY A 45 0.782 4.920 5.309 1.00 0.00 C ATOM 783 O GLY A 45 -0.373 5.312 5.472 1.00 0.00 O ATOM 0 H GLY A 45 3.537 4.635 4.706 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.332 6.291 5.844 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.475 6.713 4.375 1.00 0.00 H new ATOM 787 N VAL A 46 1.135 3.635 5.347 1.00 0.00 N ATOM 788 CA VAL A 46 0.138 2.601 5.592 1.00 0.00 C ATOM 789 C VAL A 46 0.696 1.320 6.214 1.00 0.00 C ATOM 790 O VAL A 46 1.896 1.114 6.261 1.00 0.00 O ATOM 791 CB VAL A 46 -0.568 2.278 4.274 1.00 0.00 C ATOM 792 CG1 VAL A 46 -1.855 3.086 4.158 1.00 0.00 C ATOM 793 CG2 VAL A 46 0.361 2.568 3.094 1.00 0.00 C ATOM 0 H VAL A 46 2.086 3.292 5.214 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.557 3.002 6.329 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.823 1.218 4.258 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.350 2.849 3.216 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -2.516 2.838 4.988 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -1.620 4.150 4.187 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -0.152 2.334 2.161 1.00 0.00 H new ATOM 0 HG22 VAL A 46 0.640 3.622 3.101 1.00 0.00 H new ATOM 0 HG23 VAL A 46 1.258 1.955 3.178 1.00 0.00 H new ATOM 803 N ASP A 47 -0.204 0.453 6.674 1.00 0.00 N ATOM 804 CA ASP A 47 0.182 -0.822 7.287 1.00 0.00 C ATOM 805 C ASP A 47 0.556 -1.881 6.242 1.00 0.00 C ATOM 806 O ASP A 47 0.553 -1.621 5.040 1.00 0.00 O ATOM 807 CB ASP A 47 -0.960 -1.360 8.141 1.00 0.00 C ATOM 808 CG ASP A 47 -1.696 -0.269 8.899 1.00 0.00 C ATOM 809 OD1 ASP A 47 -1.046 0.447 9.689 1.00 0.00 O ATOM 810 OD2 ASP A 47 -2.920 -0.130 8.699 1.00 0.00 O ATOM 0 H ASP A 47 -1.211 0.609 6.635 1.00 0.00 H new ATOM 0 HA ASP A 47 1.060 -0.624 7.902 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -1.666 -1.891 7.502 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -0.565 -2.086 8.852 1.00 0.00 H new ATOM 815 N LYS A 48 0.877 -3.082 6.735 1.00 0.00 N ATOM 816 CA LYS A 48 1.261 -4.217 5.893 1.00 0.00 C ATOM 817 C LYS A 48 0.089 -4.754 5.066 1.00 0.00 C ATOM 818 O LYS A 48 0.286 -5.334 4.003 1.00 0.00 O ATOM 819 CB LYS A 48 1.842 -5.339 6.756 1.00 0.00 C ATOM 820 CG LYS A 48 2.296 -6.551 5.958 1.00 0.00 C ATOM 821 CD LYS A 48 1.345 -7.723 6.133 1.00 0.00 C ATOM 822 CE LYS A 48 1.527 -8.386 7.488 1.00 0.00 C ATOM 823 NZ LYS A 48 1.040 -9.794 7.487 1.00 0.00 N ATOM 0 H LYS A 48 0.877 -3.294 7.733 1.00 0.00 H new ATOM 0 HA LYS A 48 2.016 -3.857 5.194 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.689 -4.949 7.321 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.092 -5.653 7.482 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.361 -6.289 4.902 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.297 -6.843 6.276 1.00 0.00 H new ATOM 0 HD2 LYS A 48 0.316 -7.377 6.030 1.00 0.00 H new ATOM 0 HD3 LYS A 48 1.516 -8.454 5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 48 2.582 -8.367 7.763 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.989 -7.816 8.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.182 -10.211 8.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 0.028 -9.811 7.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.570 -10.344 6.782 1.00 0.00 H new ATOM 837 N GLU A 49 -1.125 -4.581 5.560 1.00 0.00 N ATOM 838 CA GLU A 49 -2.304 -5.065 4.840 1.00 0.00 C ATOM 839 C GLU A 49 -2.553 -4.202 3.602 1.00 0.00 C ATOM 840 O GLU A 49 -2.891 -4.698 2.530 1.00 0.00 O ATOM 841 CB GLU A 49 -3.533 -5.043 5.754 1.00 0.00 C ATOM 842 CG GLU A 49 -3.584 -6.196 6.743 1.00 0.00 C ATOM 843 CD GLU A 49 -2.283 -6.378 7.501 1.00 0.00 C ATOM 844 OE1 GLU A 49 -1.714 -5.364 7.958 1.00 0.00 O ATOM 845 OE2 GLU A 49 -1.831 -7.534 7.636 1.00 0.00 O ATOM 0 H GLU A 49 -1.325 -4.116 6.445 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.124 -6.093 4.524 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -3.547 -4.103 6.305 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.432 -5.065 5.138 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.392 -6.024 7.454 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.820 -7.117 6.209 1.00 0.00 H new ATOM 852 N LEU A 50 -2.392 -2.904 3.793 1.00 0.00 N ATOM 853 CA LEU A 50 -2.590 -1.894 2.782 1.00 0.00 C ATOM 854 C LEU A 50 -1.448 -1.804 1.777 1.00 0.00 C ATOM 855 O LEU A 50 -1.311 -0.780 1.129 1.00 0.00 O ATOM 856 CB LEU A 50 -2.757 -0.527 3.475 1.00 0.00 C ATOM 857 CG LEU A 50 -3.119 -0.539 4.972 1.00 0.00 C ATOM 858 CD1 LEU A 50 -3.583 0.840 5.413 1.00 0.00 C ATOM 859 CD2 LEU A 50 -4.191 -1.574 5.285 1.00 0.00 C ATOM 0 H LEU A 50 -2.109 -2.516 4.693 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.481 -2.175 2.220 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.827 0.028 3.356 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.530 0.029 2.944 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.220 -0.812 5.525 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.836 0.817 6.473 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.785 1.563 5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.462 1.130 4.837 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.419 -1.551 6.351 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -5.093 -1.347 4.716 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.830 -2.566 5.012 1.00 0.00 H new ATOM 871 N VAL A 51 -0.614 -2.832 1.628 1.00 0.00 N ATOM 872 CA VAL A 51 0.488 -2.704 0.674 1.00 0.00 C ATOM 873 C VAL A 51 0.237 -3.369 -0.674 1.00 0.00 C ATOM 874 O VAL A 51 0.231 -4.593 -0.792 1.00 0.00 O ATOM 875 CB VAL A 51 1.780 -3.328 1.230 1.00 0.00 C ATOM 876 CG1 VAL A 51 2.989 -2.526 0.786 1.00 0.00 C ATOM 877 CG2 VAL A 51 1.719 -3.460 2.744 1.00 0.00 C ATOM 0 H VAL A 51 -0.671 -3.720 2.127 1.00 0.00 H new ATOM 0 HA VAL A 51 0.579 -1.628 0.525 1.00 0.00 H new ATOM 0 HB VAL A 51 1.879 -4.335 0.824 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.895 -2.981 1.188 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.040 -2.517 -0.303 1.00 0.00 H new ATOM 0 HG13 VAL A 51 2.902 -1.504 1.154 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.646 -3.904 3.108 1.00 0.00 H new ATOM 0 HG22 VAL A 51 1.589 -2.474 3.190 1.00 0.00 H new ATOM 0 HG23 VAL A 51 0.879 -4.097 3.020 1.00 0.00 H new ATOM 887 N ILE A 52 0.163 -2.535 -1.705 1.00 0.00 N ATOM 888 CA ILE A 52 0.065 -2.997 -3.080 1.00 0.00 C ATOM 889 C ILE A 52 1.068 -2.215 -3.919 1.00 0.00 C ATOM 890 O ILE A 52 0.824 -1.051 -4.224 1.00 0.00 O ATOM 891 CB ILE A 52 -1.353 -2.846 -3.677 1.00 0.00 C ATOM 892 CG1 ILE A 52 -2.005 -1.544 -3.207 1.00 0.00 C ATOM 893 CG2 ILE A 52 -2.205 -4.058 -3.315 1.00 0.00 C ATOM 894 CD1 ILE A 52 -3.482 -1.438 -3.532 1.00 0.00 C ATOM 0 H ILE A 52 0.169 -1.520 -1.609 1.00 0.00 H new ATOM 0 HA ILE A 52 0.285 -4.064 -3.090 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.274 -2.798 -4.763 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.874 -1.453 -2.129 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.482 -0.703 -3.663 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.202 -3.942 -3.740 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -1.743 -4.960 -3.715 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.280 -4.139 -2.231 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.868 -0.487 -3.165 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.622 -1.495 -4.611 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.020 -2.256 -3.053 1.00 0.00 H new ATOM 906 N VAL A 53 2.183 -2.818 -4.308 1.00 0.00 N ATOM 907 CA VAL A 53 3.149 -2.077 -5.115 1.00 0.00 C ATOM 908 C VAL A 53 3.553 -2.860 -6.365 1.00 0.00 C ATOM 909 O VAL A 53 4.185 -3.914 -6.287 1.00 0.00 O ATOM 910 CB VAL A 53 4.407 -1.666 -4.288 1.00 0.00 C ATOM 911 CG1 VAL A 53 4.043 -1.298 -2.850 1.00 0.00 C ATOM 912 CG2 VAL A 53 5.463 -2.757 -4.285 1.00 0.00 C ATOM 0 H VAL A 53 2.438 -3.781 -4.090 1.00 0.00 H new ATOM 0 HA VAL A 53 2.653 -1.161 -5.436 1.00 0.00 H new ATOM 0 HB VAL A 53 4.821 -0.785 -4.779 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.945 -1.018 -2.307 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.347 -0.459 -2.854 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.577 -2.154 -2.362 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.322 -2.431 -3.698 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.048 -3.664 -3.846 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.779 -2.961 -5.308 1.00 0.00 H new ATOM 922 N ASP A 54 3.172 -2.320 -7.520 1.00 0.00 N ATOM 923 CA ASP A 54 3.481 -2.933 -8.807 1.00 0.00 C ATOM 924 C ASP A 54 4.411 -2.049 -9.626 1.00 0.00 C ATOM 925 O ASP A 54 4.440 -0.832 -9.446 1.00 0.00 O ATOM 926 CB ASP A 54 2.194 -3.206 -9.588 1.00 0.00 C ATOM 927 CG ASP A 54 1.330 -4.263 -8.927 1.00 0.00 C ATOM 928 OD1 ASP A 54 1.094 -4.156 -7.705 1.00 0.00 O ATOM 929 OD2 ASP A 54 0.893 -5.197 -9.629 1.00 0.00 O ATOM 0 H ASP A 54 2.644 -1.450 -7.589 1.00 0.00 H new ATOM 0 HA ASP A 54 3.989 -3.878 -8.616 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.625 -2.281 -9.680 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.447 -3.527 -10.599 1.00 0.00 H new ATOM 934 N ASN A 55 5.157 -2.668 -10.533 1.00 0.00 N ATOM 935 CA ASN A 55 6.076 -1.934 -11.389 1.00 0.00 C ATOM 936 C ASN A 55 7.132 -1.211 -10.565 1.00 0.00 C ATOM 937 O ASN A 55 6.851 -0.699 -9.481 1.00 0.00 O ATOM 938 CB ASN A 55 5.314 -0.932 -12.257 1.00 0.00 C ATOM 939 CG ASN A 55 5.930 -0.773 -13.634 1.00 0.00 C ATOM 940 OD1 ASN A 55 6.964 -1.369 -13.937 1.00 0.00 O ATOM 941 ND2 ASN A 55 5.294 0.033 -14.476 1.00 0.00 N ATOM 0 H ASN A 55 5.143 -3.675 -10.693 1.00 0.00 H new ATOM 0 HA ASN A 55 6.578 -2.654 -12.036 1.00 0.00 H new ATOM 0 HB2 ASN A 55 4.279 -1.258 -12.361 1.00 0.00 H new ATOM 0 HB3 ASN A 55 5.294 0.036 -11.757 1.00 0.00 H new ATOM 0 HD21 ASN A 55 5.660 0.179 -15.417 1.00 0.00 H new ATOM 0 HD22 ASN A 55 4.440 0.507 -14.182 1.00 0.00 H new ATOM 948 N ASN A 56 8.349 -1.180 -11.083 1.00 0.00 N ATOM 949 CA ASN A 56 9.453 -0.527 -10.394 1.00 0.00 C ATOM 950 C ASN A 56 10.351 0.229 -11.371 1.00 0.00 C ATOM 951 O ASN A 56 11.155 -0.374 -12.082 1.00 0.00 O ATOM 952 CB ASN A 56 10.279 -1.561 -9.627 1.00 0.00 C ATOM 953 CG ASN A 56 10.599 -2.784 -10.463 1.00 0.00 C ATOM 954 OD1 ASN A 56 9.855 -3.764 -10.461 1.00 0.00 O ATOM 955 ND2 ASN A 56 11.714 -2.734 -11.183 1.00 0.00 N ATOM 0 H ASN A 56 8.599 -1.599 -11.979 1.00 0.00 H new ATOM 0 HA ASN A 56 9.030 0.193 -9.694 1.00 0.00 H new ATOM 0 HB2 ASN A 56 11.208 -1.102 -9.290 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.733 -1.868 -8.735 1.00 0.00 H new ATOM 0 HD21 ASN A 56 11.982 -3.528 -11.764 1.00 0.00 H new ATOM 0 HD22 ASN A 56 12.302 -1.901 -11.155 1.00 0.00 H new ATOM 962 N LYS A 57 10.229 1.554 -11.384 1.00 0.00 N ATOM 963 CA LYS A 57 11.052 2.382 -12.256 1.00 0.00 C ATOM 964 C LYS A 57 12.447 2.504 -11.654 1.00 0.00 C ATOM 965 O LYS A 57 12.620 3.076 -10.586 1.00 0.00 O ATOM 966 CB LYS A 57 10.420 3.774 -12.429 1.00 10.00 C ATOM 967 CG LYS A 57 10.492 4.652 -11.180 1.00 0.00 C ATOM 968 CD LYS A 57 9.227 5.485 -10.998 1.00 0.00 C ATOM 969 CE LYS A 57 9.469 6.694 -10.098 1.00 0.00 C ATOM 970 NZ LYS A 57 8.860 7.931 -10.662 1.00 0.00 N ATOM 0 H LYS A 57 9.571 2.074 -10.803 1.00 0.00 H new ATOM 0 HA LYS A 57 11.119 1.917 -13.239 1.00 0.00 H new ATOM 0 HB2 LYS A 57 10.919 4.288 -13.251 1.00 10.00 H new ATOM 0 HB3 LYS A 57 9.375 3.654 -12.716 1.00 10.00 H new ATOM 0 HG2 LYS A 57 10.642 4.023 -10.302 1.00 0.00 H new ATOM 0 HG3 LYS A 57 11.356 5.313 -11.250 1.00 0.00 H new ATOM 0 HD2 LYS A 57 8.871 5.822 -11.971 1.00 0.00 H new ATOM 0 HD3 LYS A 57 8.441 4.864 -10.568 1.00 0.00 H new ATOM 0 HE2 LYS A 57 9.052 6.501 -9.110 1.00 0.00 H new ATOM 0 HE3 LYS A 57 10.541 6.843 -9.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 9.045 8.731 -10.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 9.276 8.129 -11.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 7.833 7.798 -10.762 1.00 0.00 H new ATOM 984 N GLN A 58 13.438 1.940 -12.325 1.00 0.00 N ATOM 985 CA GLN A 58 14.803 1.968 -11.815 1.00 0.00 C ATOM 986 C GLN A 58 15.606 3.139 -12.372 1.00 0.00 C ATOM 987 O GLN A 58 15.672 3.344 -13.585 1.00 0.00 O ATOM 988 CB GLN A 58 15.512 0.655 -12.146 1.00 0.00 C ATOM 989 CG GLN A 58 16.620 0.299 -11.167 1.00 0.00 C ATOM 990 CD GLN A 58 17.644 -0.646 -11.768 1.00 0.00 C ATOM 991 OE1 GLN A 58 18.774 -0.250 -12.062 1.00 0.00 O ATOM 992 NE2 GLN A 58 17.255 -1.901 -11.952 1.00 0.00 N ATOM 0 H GLN A 58 13.327 1.460 -13.218 1.00 0.00 H new ATOM 0 HA GLN A 58 14.741 2.096 -10.734 1.00 0.00 H new ATOM 0 HB2 GLN A 58 14.778 -0.151 -12.161 1.00 0.00 H new ATOM 0 HB3 GLN A 58 15.932 0.721 -13.149 1.00 0.00 H new ATOM 0 HG2 GLN A 58 17.119 1.211 -10.841 1.00 0.00 H new ATOM 0 HG3 GLN A 58 16.183 -0.160 -10.280 1.00 0.00 H new ATOM 0 HE21 GLN A 58 16.310 -2.185 -11.694 1.00 0.00 H new ATOM 0 HE22 GLN A 58 17.901 -2.582 -12.351 1.00 0.00 H new ATOM 1001 N LEU A 59 16.253 3.873 -11.474 1.00 0.00 N ATOM 1002 CA LEU A 59 17.102 4.993 -11.857 1.00 0.00 C ATOM 1003 C LEU A 59 18.513 4.700 -11.381 1.00 0.00 C ATOM 1004 O LEU A 59 18.770 4.621 -10.180 1.00 0.00 O ATOM 1005 CB LEU A 59 16.612 6.333 -11.278 1.00 0.00 C ATOM 1006 CG LEU A 59 15.403 6.271 -10.342 1.00 0.00 C ATOM 1007 CD1 LEU A 59 14.196 5.677 -11.056 1.00 0.00 C ATOM 1008 CD2 LEU A 59 15.739 5.478 -9.087 1.00 0.00 C ATOM 0 H LEU A 59 16.204 3.710 -10.468 1.00 0.00 H new ATOM 0 HA LEU A 59 17.069 5.097 -12.942 1.00 0.00 H new ATOM 0 HB2 LEU A 59 17.439 6.794 -10.737 1.00 0.00 H new ATOM 0 HB3 LEU A 59 16.367 6.994 -12.109 1.00 0.00 H new ATOM 0 HG LEU A 59 15.148 7.288 -10.043 1.00 0.00 H new ATOM 0 HD11 LEU A 59 13.349 5.643 -10.371 1.00 0.00 H new ATOM 0 HD12 LEU A 59 13.942 6.295 -11.917 1.00 0.00 H new ATOM 0 HD13 LEU A 59 14.432 4.667 -11.391 1.00 0.00 H new ATOM 0 HD21 LEU A 59 14.867 5.445 -8.433 1.00 0.00 H new ATOM 0 HD22 LEU A 59 16.024 4.463 -9.363 1.00 0.00 H new ATOM 0 HD23 LEU A 59 16.566 5.958 -8.564 1.00 0.00 H new ATOM 1020 N THR A 60 19.412 4.489 -12.324 1.00 0.00 N ATOM 1021 CA THR A 60 20.784 4.150 -11.996 1.00 0.00 C ATOM 1022 C THR A 60 21.540 5.295 -11.358 1.00 0.00 C ATOM 1023 O THR A 60 21.079 6.436 -11.329 1.00 0.00 O ATOM 1024 CB THR A 60 21.512 3.667 -13.235 1.00 0.00 C ATOM 1025 OG1 THR A 60 21.103 4.397 -14.379 1.00 0.00 O ATOM 1026 CG2 THR A 60 21.260 2.209 -13.500 1.00 0.00 C ATOM 0 H THR A 60 19.217 4.546 -13.324 1.00 0.00 H new ATOM 0 HA THR A 60 20.743 3.351 -11.256 1.00 0.00 H new ATOM 0 HB THR A 60 22.574 3.822 -13.046 1.00 0.00 H new ATOM 0 HG1 THR A 60 21.587 4.070 -15.166 1.00 0.00 H new ATOM 0 HG21 THR A 60 21.800 1.903 -14.396 1.00 0.00 H new ATOM 0 HG22 THR A 60 21.605 1.620 -12.650 1.00 0.00 H new ATOM 0 HG23 THR A 60 20.192 2.045 -13.646 1.00 0.00 H new ATOM 1034 N GLY A 61 22.712 4.962 -10.837 1.00 0.00 N ATOM 1035 CA GLY A 61 23.545 5.940 -10.187 1.00 0.00 C ATOM 1036 C GLY A 61 24.085 5.432 -8.862 1.00 0.00 C ATOM 1037 O GLY A 61 25.066 5.961 -8.338 1.00 0.00 O ATOM 0 H GLY A 61 23.100 4.019 -10.856 1.00 0.00 H new ATOM 0 HA2 GLY A 61 24.376 6.202 -10.842 1.00 0.00 H new ATOM 0 HA3 GLY A 61 22.972 6.852 -10.020 1.00 0.00 H new ATOM 1041 N LYS A 62 23.443 4.397 -8.323 1.00 0.00 N ATOM 1042 CA LYS A 62 23.859 3.806 -7.056 1.00 0.00 C ATOM 1043 C LYS A 62 23.646 2.287 -7.074 1.00 0.00 C ATOM 1044 O LYS A 62 24.563 1.537 -7.405 1.00 0.00 O ATOM 1045 CB LYS A 62 23.093 4.447 -5.893 1.00 0.00 C ATOM 1046 CG LYS A 62 23.409 3.832 -4.538 1.00 0.00 C ATOM 1047 CD LYS A 62 23.331 4.865 -3.428 1.00 0.00 C ATOM 1048 CE LYS A 62 23.640 4.251 -2.073 1.00 0.00 C ATOM 1049 NZ LYS A 62 25.075 4.400 -1.710 1.00 0.00 N ATOM 0 H LYS A 62 22.630 3.950 -8.747 1.00 0.00 H new ATOM 0 HA LYS A 62 24.923 3.998 -6.916 1.00 0.00 H new ATOM 0 HB2 LYS A 62 23.324 5.512 -5.861 1.00 0.00 H new ATOM 0 HB3 LYS A 62 22.023 4.358 -6.082 1.00 0.00 H new ATOM 0 HG2 LYS A 62 22.709 3.022 -4.333 1.00 0.00 H new ATOM 0 HG3 LYS A 62 24.407 3.394 -4.560 1.00 0.00 H new ATOM 0 HD2 LYS A 62 24.034 5.673 -3.631 1.00 0.00 H new ATOM 0 HD3 LYS A 62 22.335 5.307 -3.410 1.00 0.00 H new ATOM 0 HE2 LYS A 62 23.022 4.725 -1.310 1.00 0.00 H new ATOM 0 HE3 LYS A 62 23.377 3.193 -2.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 25.244 3.968 -0.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 25.665 3.926 -2.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 25.321 5.410 -1.673 1.00 0.00 H new ATOM 1063 N HIS A 63 22.434 1.845 -6.723 1.00 0.00 N ATOM 1064 CA HIS A 63 22.102 0.415 -6.703 1.00 0.00 C ATOM 1065 C HIS A 63 20.811 0.169 -5.921 1.00 0.00 C ATOM 1066 O HIS A 63 20.702 -0.807 -5.179 1.00 0.00 O ATOM 1067 CB HIS A 63 23.246 -0.400 -6.083 1.00 0.00 C ATOM 1068 CG HIS A 63 24.084 -1.119 -7.095 1.00 0.00 C ATOM 1069 ND1 HIS A 63 23.549 -1.873 -8.117 1.00 0.00 N ATOM 1070 CD2 HIS A 63 25.429 -1.198 -7.236 1.00 0.00 C ATOM 1071 CE1 HIS A 63 24.527 -2.384 -8.844 1.00 0.00 C ATOM 1072 NE2 HIS A 63 25.677 -1.988 -8.331 1.00 0.00 N ATOM 0 H HIS A 63 21.665 2.457 -6.449 1.00 0.00 H new ATOM 0 HA HIS A 63 21.957 0.092 -7.734 1.00 0.00 H new ATOM 0 HB2 HIS A 63 23.884 0.267 -5.503 1.00 0.00 H new ATOM 0 HB3 HIS A 63 22.828 -1.127 -5.387 1.00 0.00 H new ATOM 0 HD2 HIS A 63 26.168 -0.727 -6.605 1.00 0.00 H new ATOM 0 HE1 HIS A 63 24.406 -3.018 -9.710 1.00 0.00 H new ATOM 0 HE2 HIS A 63 26.601 -2.230 -8.690 1.00 0.00 H new ATOM 1081 N GLU A 64 19.845 1.068 -6.074 1.00 0.00 N ATOM 1082 CA GLU A 64 18.591 0.979 -5.387 1.00 0.00 C ATOM 1083 C GLU A 64 17.477 1.078 -6.410 1.00 0.00 C ATOM 1084 O GLU A 64 17.707 1.542 -7.528 1.00 0.00 O ATOM 1085 CB GLU A 64 18.548 2.051 -4.316 1.00 0.00 C ATOM 1086 CG GLU A 64 19.767 1.955 -3.402 1.00 0.00 C ATOM 1087 CD GLU A 64 20.152 3.284 -2.780 1.00 0.00 C ATOM 1088 OE1 GLU A 64 19.618 4.322 -3.223 1.00 0.00 O ATOM 1089 OE2 GLU A 64 20.986 3.286 -1.853 1.00 0.00 O ATOM 0 H GLU A 64 19.925 1.880 -6.686 1.00 0.00 H new ATOM 0 HA GLU A 64 18.463 0.025 -4.875 1.00 0.00 H new ATOM 0 HB2 GLU A 64 18.514 3.036 -4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 64 17.637 1.946 -3.727 1.00 0.00 H new ATOM 0 HG2 GLU A 64 19.563 1.235 -2.609 1.00 0.00 H new ATOM 0 HG3 GLU A 64 20.612 1.570 -3.973 1.00 0.00 H new ATOM 1096 N ILE A 65 16.301 0.575 -6.084 1.00 0.00 N ATOM 1097 CA ILE A 65 15.226 0.554 -7.060 1.00 0.00 C ATOM 1098 C ILE A 65 14.106 1.506 -6.689 1.00 0.00 C ATOM 1099 O ILE A 65 13.748 1.664 -5.525 1.00 0.00 O ATOM 1100 CB ILE A 65 14.649 -0.874 -7.187 1.00 0.00 C ATOM 1101 CG1 ILE A 65 13.983 -1.074 -8.546 1.00 0.00 C ATOM 1102 CG2 ILE A 65 13.664 -1.157 -6.068 1.00 0.00 C ATOM 1103 CD1 ILE A 65 13.424 -2.466 -8.735 1.00 0.00 C ATOM 0 H ILE A 65 16.068 0.183 -5.172 1.00 0.00 H new ATOM 0 HA ILE A 65 15.650 0.875 -8.011 1.00 0.00 H new ATOM 0 HB ILE A 65 15.476 -1.579 -7.105 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.178 -0.348 -8.660 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.709 -0.871 -9.333 1.00 0.00 H new ATOM 0 HG21 ILE A 65 13.270 -2.167 -6.177 1.00 0.00 H new ATOM 0 HG22 ILE A 65 14.170 -1.066 -5.107 1.00 0.00 H new ATOM 0 HG23 ILE A 65 12.844 -0.441 -6.116 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.964 -2.543 -9.720 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.229 -3.196 -8.652 1.00 0.00 H new ATOM 0 HD13 ILE A 65 12.675 -2.664 -7.969 1.00 0.00 H new ATOM 1115 N GLU A 66 13.598 2.162 -7.722 1.00 0.00 N ATOM 1116 CA GLU A 66 12.547 3.151 -7.590 1.00 0.00 C ATOM 1117 C GLU A 66 11.297 2.705 -8.326 1.00 0.00 C ATOM 1118 O GLU A 66 11.341 1.788 -9.144 1.00 0.00 O ATOM 1119 CB GLU A 66 13.036 4.489 -8.156 1.00 0.00 C ATOM 1120 CG GLU A 66 12.020 5.607 -8.061 1.00 0.00 C ATOM 1121 CD GLU A 66 12.651 6.979 -8.174 1.00 0.00 C ATOM 1122 OE1 GLU A 66 13.322 7.405 -7.209 1.00 0.00 O ATOM 1123 OE2 GLU A 66 12.474 7.631 -9.224 1.00 0.00 O ATOM 0 H GLU A 66 13.909 2.019 -8.683 1.00 0.00 H new ATOM 0 HA GLU A 66 12.301 3.267 -6.534 1.00 0.00 H new ATOM 0 HB2 GLU A 66 13.940 4.788 -7.625 1.00 0.00 H new ATOM 0 HB3 GLU A 66 13.311 4.350 -9.201 1.00 0.00 H new ATOM 0 HG2 GLU A 66 11.278 5.486 -8.850 1.00 0.00 H new ATOM 0 HG3 GLU A 66 11.490 5.532 -7.111 1.00 0.00 H new ATOM 1130 N GLY A 67 10.187 3.349 -8.022 1.00 0.00 N ATOM 1131 CA GLY A 67 8.941 3.003 -8.663 1.00 0.00 C ATOM 1132 C GLY A 67 7.766 3.692 -8.028 1.00 0.00 C ATOM 1133 O GLY A 67 7.914 4.734 -7.385 1.00 0.00 O ATOM 0 H GLY A 67 10.125 4.107 -7.342 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.990 3.271 -9.718 1.00 0.00 H new ATOM 0 HA3 GLY A 67 8.797 1.924 -8.615 1.00 0.00 H new ATOM 1137 N TYR A 68 6.596 3.103 -8.184 1.00 0.00 N ATOM 1138 CA TYR A 68 5.401 3.670 -7.607 1.00 0.00 C ATOM 1139 C TYR A 68 4.745 2.657 -6.697 1.00 0.00 C ATOM 1140 O TYR A 68 4.603 1.481 -7.036 1.00 0.00 O ATOM 1141 CB TYR A 68 4.427 4.104 -8.706 1.00 0.00 C ATOM 1142 CG TYR A 68 4.362 5.601 -8.900 1.00 0.00 C ATOM 1143 CD1 TYR A 68 3.506 6.384 -8.135 1.00 0.00 C ATOM 1144 CD2 TYR A 68 5.157 6.233 -9.849 1.00 0.00 C ATOM 1145 CE1 TYR A 68 3.444 7.752 -8.311 1.00 0.00 C ATOM 1146 CE2 TYR A 68 5.101 7.602 -10.028 1.00 0.00 C ATOM 1147 CZ TYR A 68 4.242 8.357 -9.257 1.00 0.00 C ATOM 1148 OH TYR A 68 4.186 9.721 -9.433 1.00 0.00 O ATOM 0 H TYR A 68 6.452 2.237 -8.703 1.00 0.00 H new ATOM 0 HA TYR A 68 5.674 4.550 -7.025 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.721 3.637 -9.646 1.00 0.00 H new ATOM 0 HB3 TYR A 68 3.431 3.734 -8.464 1.00 0.00 H new ATOM 0 HD1 TYR A 68 2.879 5.915 -7.391 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.829 5.645 -10.456 1.00 0.00 H new ATOM 0 HE1 TYR A 68 2.772 8.346 -7.709 1.00 0.00 H new ATOM 0 HE2 TYR A 68 5.727 8.079 -10.768 1.00 0.00 H new ATOM 0 HH TYR A 68 4.813 9.986 -10.138 1.00 0.00 H new ATOM 1158 N THR A 69 4.363 3.130 -5.530 1.00 0.00 N ATOM 1159 CA THR A 69 3.732 2.294 -4.528 1.00 0.00 C ATOM 1160 C THR A 69 2.254 2.683 -4.377 1.00 0.00 C ATOM 1161 O THR A 69 1.894 3.853 -4.511 1.00 0.00 O ATOM 1162 CB THR A 69 4.511 2.435 -3.202 1.00 0.00 C ATOM 1163 OG1 THR A 69 5.279 3.625 -3.191 1.00 0.00 O ATOM 1164 CG2 THR A 69 5.468 1.306 -2.929 1.00 0.00 C ATOM 0 H THR A 69 4.480 4.103 -5.248 1.00 0.00 H new ATOM 0 HA THR A 69 3.758 1.247 -4.830 1.00 0.00 H new ATOM 0 HB THR A 69 3.738 2.436 -2.434 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.752 4.358 -3.572 1.00 0.00 H new ATOM 0 HG21 THR A 69 5.975 1.480 -1.980 1.00 0.00 H new ATOM 0 HG22 THR A 69 4.918 0.366 -2.879 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.205 1.252 -3.730 1.00 0.00 H new ATOM 1172 N LYS A 70 1.404 1.697 -4.116 1.00 0.00 N ATOM 1173 CA LYS A 70 -0.034 1.932 -3.956 1.00 0.00 C ATOM 1174 C LYS A 70 -0.546 1.162 -2.749 1.00 0.00 C ATOM 1175 O LYS A 70 0.036 0.149 -2.363 1.00 0.00 O ATOM 1176 CB LYS A 70 -0.791 1.542 -5.198 1.00 0.00 C ATOM 1177 CG LYS A 70 -1.903 2.508 -5.570 1.00 0.00 C ATOM 1178 CD LYS A 70 -2.270 2.397 -7.043 1.00 0.00 C ATOM 1179 CE LYS A 70 -3.719 1.976 -7.229 1.00 0.00 C ATOM 1180 NZ LYS A 70 -4.086 1.875 -8.668 1.00 0.00 N ATOM 0 H LYS A 70 1.683 0.722 -4.010 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.197 2.998 -3.795 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.091 1.471 -6.031 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.218 0.549 -5.055 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.782 2.305 -4.959 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -1.589 3.528 -5.348 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.104 3.356 -7.533 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -1.615 1.673 -7.528 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.883 1.014 -6.744 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.373 2.696 -6.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.081 1.586 -8.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.954 2.800 -9.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.479 1.169 -9.132 1.00 0.00 H new ATOM 1194 N ILE A 71 -1.566 1.690 -2.086 1.00 0.00 N ATOM 1195 CA ILE A 71 -2.035 1.065 -0.863 1.00 0.00 C ATOM 1196 C ILE A 71 -3.537 0.956 -0.695 1.00 0.00 C ATOM 1197 O ILE A 71 -4.300 1.879 -1.051 1.00 0.00 O ATOM 1198 CB ILE A 71 -1.411 1.774 0.343 1.00 0.00 C ATOM 1199 CG1 ILE A 71 -0.011 1.209 0.549 1.00 0.00 C ATOM 1200 CG2 ILE A 71 -2.256 1.639 1.598 1.00 0.00 C ATOM 1201 CD1 ILE A 71 1.074 2.218 0.317 1.00 0.00 C ATOM 0 H ILE A 71 -2.072 2.529 -2.368 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.706 0.028 -0.933 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.359 2.844 0.141 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.072 0.823 1.565 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.136 0.365 -0.125 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.769 2.159 2.423 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -3.239 2.076 1.424 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.368 0.584 1.850 1.00 0.00 H new ATOM 0 HD11 ILE A 71 2.046 1.752 0.480 1.00 0.00 H new ATOM 0 HD12 ILE A 71 1.016 2.586 -0.707 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.951 3.051 1.009 1.00 0.00 H new ATOM 1213 N TYR A 72 -3.922 -0.171 -0.060 1.00 0.00 N ATOM 1214 CA TYR A 72 -5.322 -0.443 0.272 1.00 0.00 C ATOM 1215 C TYR A 72 -5.506 -0.597 1.794 1.00 0.00 C ATOM 1216 O TYR A 72 -4.944 -1.504 2.444 1.00 0.00 O ATOM 1217 CB TYR A 72 -5.864 -1.671 -0.473 1.00 0.00 C ATOM 1218 CG TYR A 72 -5.084 -2.955 -0.277 1.00 0.00 C ATOM 1219 CD1 TYR A 72 -3.737 -3.042 -0.609 1.00 0.00 C ATOM 1220 CD2 TYR A 72 -5.706 -4.090 0.224 1.00 0.00 C ATOM 1221 CE1 TYR A 72 -3.038 -4.222 -0.447 1.00 0.00 C ATOM 1222 CE2 TYR A 72 -5.012 -5.273 0.391 1.00 0.00 C ATOM 1223 CZ TYR A 72 -3.679 -5.333 0.053 1.00 0.00 C ATOM 1224 OH TYR A 72 -2.985 -6.510 0.217 1.00 0.00 O ATOM 0 H TYR A 72 -3.275 -0.904 0.230 1.00 0.00 H new ATOM 0 HA TYR A 72 -5.904 0.417 -0.060 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.893 -1.841 -0.156 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.892 -1.444 -1.539 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -3.229 -2.173 -1.000 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -6.752 -4.048 0.488 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -1.992 -4.273 -0.712 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -5.512 -6.145 0.784 1.00 0.00 H new ATOM 0 HH TYR A 72 -2.586 -6.533 1.112 1.00 0.00 H new ATOM 1234 N ALA A 73 -6.282 0.329 2.359 1.00 0.00 N ATOM 1235 CA ALA A 73 -6.549 0.356 3.794 1.00 0.00 C ATOM 1236 C ALA A 73 -7.782 -0.465 4.179 1.00 0.00 C ATOM 1237 O ALA A 73 -8.020 -0.715 5.360 1.00 0.00 O ATOM 1238 CB ALA A 73 -6.714 1.793 4.259 1.00 0.00 C ATOM 0 H ALA A 73 -6.740 1.076 1.837 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.694 -0.101 4.291 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.913 1.808 5.331 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -5.800 2.350 4.052 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -7.547 2.254 3.729 1.00 0.00 H new ATOM 1244 N ASP A 74 -8.577 -0.857 3.190 1.00 0.00 N ATOM 1245 CA ASP A 74 -9.793 -1.624 3.451 1.00 0.00 C ATOM 1246 C ASP A 74 -9.493 -3.085 3.783 1.00 0.00 C ATOM 1247 O ASP A 74 -10.388 -3.832 4.176 1.00 0.00 O ATOM 1248 CB ASP A 74 -10.730 -1.546 2.244 1.00 0.00 C ATOM 1249 CG ASP A 74 -12.042 -2.268 2.479 1.00 0.00 C ATOM 1250 OD1 ASP A 74 -12.455 -2.382 3.652 1.00 0.00 O ATOM 1251 OD2 ASP A 74 -12.657 -2.718 1.491 1.00 0.00 O ATOM 0 H ASP A 74 -8.404 -0.659 2.205 1.00 0.00 H new ATOM 0 HA ASP A 74 -10.276 -1.182 4.322 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -10.931 -0.500 2.012 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -10.233 -1.976 1.374 1.00 0.00 H new ATOM 1256 N LYS A 75 -8.239 -3.496 3.617 1.00 0.00 N ATOM 1257 CA LYS A 75 -7.850 -4.875 3.900 1.00 0.00 C ATOM 1258 C LYS A 75 -7.990 -5.213 5.386 1.00 0.00 C ATOM 1259 O LYS A 75 -8.668 -6.176 5.744 1.00 0.00 O ATOM 1260 CB LYS A 75 -6.414 -5.126 3.434 1.00 0.00 C ATOM 1261 CG LYS A 75 -5.896 -6.517 3.765 1.00 0.00 C ATOM 1262 CD LYS A 75 -6.610 -7.586 2.955 1.00 0.00 C ATOM 1263 CE LYS A 75 -5.650 -8.667 2.486 1.00 0.00 C ATOM 1264 NZ LYS A 75 -5.083 -9.439 3.627 1.00 0.00 N ATOM 0 H LYS A 75 -7.479 -2.899 3.290 1.00 0.00 H new ATOM 0 HA LYS A 75 -8.527 -5.527 3.349 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -6.360 -4.975 2.356 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -5.758 -4.386 3.892 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.825 -6.564 3.567 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -6.032 -6.713 4.828 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -7.398 -8.036 3.559 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -7.093 -7.128 2.092 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.170 -9.346 1.811 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.839 -8.211 1.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.907 -10.420 3.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -4.189 -9.003 3.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -5.757 -9.434 4.419 1.00 0.00 H new ATOM 1278 N PRO A 76 -7.348 -4.433 6.277 1.00 0.00 N ATOM 1279 CA PRO A 76 -7.413 -4.676 7.722 1.00 0.00 C ATOM 1280 C PRO A 76 -8.823 -4.519 8.273 1.00 0.00 C ATOM 1281 O PRO A 76 -9.290 -5.351 9.047 1.00 0.00 O ATOM 1282 CB PRO A 76 -6.489 -3.610 8.317 1.00 0.00 C ATOM 1283 CG PRO A 76 -6.409 -2.551 7.275 1.00 0.00 C ATOM 1284 CD PRO A 76 -6.511 -3.266 5.959 1.00 0.00 C ATOM 0 HA PRO A 76 -7.119 -5.696 7.970 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -6.890 -3.216 9.251 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -5.504 -4.020 8.540 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -7.215 -1.827 7.390 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -5.472 -1.999 7.349 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -6.968 -2.639 5.194 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -5.531 -3.563 5.584 1.00 0.00 H new ATOM 1292 N SER A 77 -9.499 -3.450 7.866 1.00 0.00 N ATOM 1293 CA SER A 77 -10.860 -3.194 8.324 1.00 0.00 C ATOM 1294 C SER A 77 -11.762 -4.383 8.016 1.00 0.00 C ATOM 1295 O SER A 77 -12.538 -4.825 8.865 1.00 0.00 O ATOM 1296 CB SER A 77 -11.416 -1.931 7.664 1.00 0.00 C ATOM 1297 OG SER A 77 -11.181 -0.788 8.469 1.00 0.00 O ATOM 0 H SER A 77 -9.129 -2.750 7.223 1.00 0.00 H new ATOM 0 HA SER A 77 -10.835 -3.046 9.404 1.00 0.00 H new ATOM 0 HB2 SER A 77 -10.952 -1.793 6.687 1.00 0.00 H new ATOM 0 HB3 SER A 77 -12.487 -2.047 7.495 1.00 0.00 H new ATOM 0 HG SER A 77 -11.544 0.006 8.024 1.00 0.00 H new ATOM 1303 N ALA A 78 -11.652 -4.896 6.796 1.00 0.00 N ATOM 1304 CA ALA A 78 -12.452 -6.033 6.369 1.00 0.00 C ATOM 1305 C ALA A 78 -11.987 -7.327 7.032 1.00 0.00 C ATOM 1306 O ALA A 78 -12.788 -8.058 7.610 1.00 0.00 O ATOM 1307 CB ALA A 78 -12.405 -6.169 4.855 1.00 0.00 C ATOM 0 H ALA A 78 -11.014 -4.540 6.085 1.00 0.00 H new ATOM 0 HA ALA A 78 -13.481 -5.853 6.680 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -13.008 -7.024 4.548 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -12.800 -5.263 4.396 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -11.374 -6.318 4.535 1.00 0.00 H new ATOM 1313 N MET A 79 -10.689 -7.610 6.934 1.00 0.00 N ATOM 1314 CA MET A 79 -10.124 -8.827 7.510 1.00 0.00 C ATOM 1315 C MET A 79 -10.250 -8.846 9.032 1.00 0.00 C ATOM 1316 O MET A 79 -10.333 -9.912 9.639 1.00 0.00 O ATOM 1317 CB MET A 79 -8.655 -8.966 7.111 1.00 0.00 C ATOM 1318 CG MET A 79 -8.145 -10.398 7.159 1.00 0.00 C ATOM 1319 SD MET A 79 -8.843 -11.427 5.854 1.00 0.00 S ATOM 1320 CE MET A 79 -7.434 -11.588 4.761 1.00 0.00 C ATOM 0 H MET A 79 -10.010 -7.013 6.461 1.00 0.00 H new ATOM 0 HA MET A 79 -10.692 -9.670 7.116 1.00 0.00 H new ATOM 0 HB2 MET A 79 -8.522 -8.575 6.102 1.00 0.00 H new ATOM 0 HB3 MET A 79 -8.047 -8.350 7.774 1.00 0.00 H new ATOM 0 HG2 MET A 79 -7.058 -10.396 7.073 1.00 0.00 H new ATOM 0 HG3 MET A 79 -8.387 -10.834 8.128 1.00 0.00 H new ATOM 0 HE1 MET A 79 -7.494 -12.536 4.227 1.00 0.00 H new ATOM 0 HE2 MET A 79 -7.434 -10.767 4.044 1.00 0.00 H new ATOM 0 HE3 MET A 79 -6.515 -11.558 5.346 1.00 0.00 H new ATOM 1330 N LEU A 80 -10.252 -7.669 9.645 1.00 0.00 N ATOM 1331 CA LEU A 80 -10.356 -7.568 11.097 1.00 0.00 C ATOM 1332 C LEU A 80 -11.792 -7.761 11.574 1.00 0.00 C ATOM 1333 O LEU A 80 -12.031 -8.345 12.631 1.00 0.00 O ATOM 1334 CB LEU A 80 -9.836 -6.206 11.570 1.00 0.00 C ATOM 1335 CG LEU A 80 -10.098 -5.882 13.043 1.00 0.00 C ATOM 1336 CD1 LEU A 80 -8.975 -5.026 13.608 1.00 0.00 C ATOM 1337 CD2 LEU A 80 -11.437 -5.179 13.203 1.00 0.00 C ATOM 0 H LEU A 80 -10.183 -6.773 9.162 1.00 0.00 H new ATOM 0 HA LEU A 80 -9.747 -8.363 11.526 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.762 -6.164 11.391 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -10.292 -5.428 10.957 1.00 0.00 H new ATOM 0 HG LEU A 80 -10.131 -6.818 13.601 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -9.178 -4.805 14.656 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -8.031 -5.565 13.527 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -8.910 -4.094 13.047 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -11.607 -4.956 14.256 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -11.431 -4.251 12.632 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -12.234 -5.826 12.836 1.00 0.00 H new ATOM 1349 N TYR A 81 -12.743 -7.240 10.809 1.00 0.00 N ATOM 1350 CA TYR A 81 -14.152 -7.331 11.177 1.00 0.00 C ATOM 1351 C TYR A 81 -14.899 -8.425 10.411 1.00 0.00 C ATOM 1352 O TYR A 81 -16.118 -8.546 10.544 1.00 0.00 O ATOM 1353 CB TYR A 81 -14.832 -5.980 10.942 1.00 0.00 C ATOM 1354 CG TYR A 81 -16.072 -5.773 11.781 1.00 0.00 C ATOM 1355 CD1 TYR A 81 -15.983 -5.290 13.080 1.00 0.00 C ATOM 1356 CD2 TYR A 81 -17.334 -6.059 11.274 1.00 0.00 C ATOM 1357 CE1 TYR A 81 -17.112 -5.099 13.850 1.00 0.00 C ATOM 1358 CE2 TYR A 81 -18.470 -5.868 12.038 1.00 0.00 C ATOM 1359 CZ TYR A 81 -18.353 -5.389 13.326 1.00 0.00 C ATOM 1360 OH TYR A 81 -19.482 -5.200 14.091 1.00 0.00 O ATOM 0 H TYR A 81 -12.566 -6.751 9.932 1.00 0.00 H new ATOM 0 HA TYR A 81 -14.191 -7.599 12.233 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -14.121 -5.182 11.157 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -15.098 -5.895 9.888 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -15.013 -5.060 13.495 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -17.429 -6.437 10.267 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -17.023 -4.724 14.859 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -19.444 -6.093 11.629 1.00 0.00 H new ATOM 0 HH TYR A 81 -20.275 -5.451 13.572 1.00 0.00 H new ATOM 1370 N GLU A 82 -14.192 -9.209 9.600 1.00 0.00 N ATOM 1371 CA GLU A 82 -14.852 -10.257 8.825 1.00 0.00 C ATOM 1372 C GLU A 82 -14.868 -11.613 9.551 1.00 0.00 C ATOM 1373 O GLU A 82 -15.894 -11.981 10.123 1.00 0.00 O ATOM 1374 CB GLU A 82 -14.224 -10.382 7.434 1.00 0.00 C ATOM 1375 CG GLU A 82 -14.836 -9.449 6.404 1.00 0.00 C ATOM 1376 CD GLU A 82 -14.072 -9.442 5.093 1.00 0.00 C ATOM 1377 OE1 GLU A 82 -13.211 -10.328 4.902 1.00 0.00 O ATOM 1378 OE2 GLU A 82 -14.336 -8.553 4.257 1.00 0.00 O ATOM 0 H GLU A 82 -13.183 -9.142 9.464 1.00 0.00 H new ATOM 0 HA GLU A 82 -15.893 -9.956 8.710 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -13.156 -10.178 7.507 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -14.329 -11.410 7.088 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -15.868 -9.747 6.217 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -14.865 -8.437 6.808 1.00 0.00 H new ATOM 1385 N PRO A 83 -13.767 -12.400 9.530 1.00 0.00 N ATOM 1386 CA PRO A 83 -13.740 -13.716 10.177 1.00 0.00 C ATOM 1387 C PRO A 83 -13.304 -13.685 11.641 1.00 0.00 C ATOM 1388 O PRO A 83 -13.693 -14.551 12.425 1.00 0.00 O ATOM 1389 CB PRO A 83 -12.696 -14.448 9.348 1.00 0.00 C ATOM 1390 CG PRO A 83 -11.693 -13.391 9.034 1.00 0.00 C ATOM 1391 CD PRO A 83 -12.478 -12.111 8.860 1.00 0.00 C ATOM 0 HA PRO A 83 -14.731 -14.169 10.206 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -12.249 -15.272 9.904 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -13.129 -14.872 8.442 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -10.963 -13.295 9.838 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -11.139 -13.635 8.128 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -11.969 -11.263 9.318 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -12.619 -11.867 7.807 1.00 0.00 H new ATOM 1399 N ASP A 84 -12.477 -12.711 12.006 1.00 0.00 N ATOM 1400 CA ASP A 84 -11.985 -12.617 13.379 1.00 0.00 C ATOM 1401 C ASP A 84 -12.714 -11.545 14.184 1.00 0.00 C ATOM 1402 O ASP A 84 -12.598 -11.504 15.410 1.00 0.00 O ATOM 1403 CB ASP A 84 -10.484 -12.328 13.377 1.00 0.00 C ATOM 1404 CG ASP A 84 -10.151 -11.009 12.706 1.00 0.00 C ATOM 1405 OD1 ASP A 84 -11.003 -10.497 11.950 1.00 0.00 O ATOM 1406 OD2 ASP A 84 -9.039 -10.491 12.936 1.00 0.00 O ATOM 0 H ASP A 84 -12.135 -11.982 11.379 1.00 0.00 H new ATOM 0 HA ASP A 84 -12.179 -13.576 13.858 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -10.118 -12.313 14.404 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -9.962 -13.136 12.864 1.00 0.00 H new ATOM 1411 N TYR A 85 -13.460 -10.678 13.504 1.00 0.00 N ATOM 1412 CA TYR A 85 -14.192 -9.612 14.183 1.00 0.00 C ATOM 1413 C TYR A 85 -13.262 -8.811 15.097 1.00 0.00 C ATOM 1414 O TYR A 85 -12.079 -9.129 15.224 1.00 0.00 O ATOM 1415 CB TYR A 85 -15.348 -10.197 14.997 1.00 0.00 C ATOM 1416 CG TYR A 85 -16.657 -10.241 14.241 1.00 0.00 C ATOM 1417 CD1 TYR A 85 -16.936 -11.275 13.358 1.00 0.00 C ATOM 1418 CD2 TYR A 85 -17.613 -9.247 14.411 1.00 0.00 C ATOM 1419 CE1 TYR A 85 -18.132 -11.320 12.665 1.00 0.00 C ATOM 1420 CE2 TYR A 85 -18.811 -9.284 13.723 1.00 0.00 C ATOM 1421 CZ TYR A 85 -19.066 -10.322 12.852 1.00 0.00 C ATOM 1422 OH TYR A 85 -20.256 -10.362 12.163 1.00 0.00 O ATOM 0 H TYR A 85 -13.573 -10.692 12.490 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.595 -8.940 13.425 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.085 -11.207 15.312 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -15.480 -9.605 15.903 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -16.207 -12.058 13.210 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -17.417 -8.432 15.092 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.334 -12.132 11.982 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -19.544 -8.504 13.867 1.00 0.00 H new ATOM 0 HH TYR A 85 -20.803 -9.587 12.409 1.00 0.00 H new ATOM 1432 N GLU A 86 -13.799 -7.772 15.729 1.00 0.00 N ATOM 1433 CA GLU A 86 -13.009 -6.934 16.628 1.00 0.00 C ATOM 1434 C GLU A 86 -13.826 -5.753 17.142 1.00 0.00 C ATOM 1435 O GLU A 86 -15.025 -5.651 16.877 1.00 0.00 O ATOM 1436 CB GLU A 86 -11.747 -6.424 15.923 1.00 0.00 C ATOM 1437 CG GLU A 86 -10.482 -6.583 16.750 1.00 0.00 C ATOM 1438 CD GLU A 86 -9.321 -7.128 15.942 1.00 0.00 C ATOM 1439 OE1 GLU A 86 -9.492 -8.179 15.287 1.00 0.00 O ATOM 1440 OE2 GLU A 86 -8.239 -6.504 15.960 1.00 0.00 O ATOM 0 H GLU A 86 -14.775 -7.490 15.637 1.00 0.00 H new ATOM 0 HA GLU A 86 -12.717 -7.549 17.479 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -11.625 -6.960 14.981 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -11.880 -5.371 15.676 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -10.204 -5.617 17.172 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -10.682 -7.251 17.588 1.00 0.00 H new ATOM 1447 N LEU A 87 -13.169 -4.862 17.879 1.00 0.00 N ATOM 1448 CA LEU A 87 -13.832 -3.685 18.430 1.00 0.00 C ATOM 1449 C LEU A 87 -13.885 -2.559 17.404 1.00 0.00 C ATOM 1450 O LEU A 87 -14.806 -1.745 17.414 1.00 0.00 O ATOM 1451 CB LEU A 87 -13.106 -3.205 19.690 1.00 0.00 C ATOM 1452 CG LEU A 87 -12.621 -4.315 20.626 1.00 0.00 C ATOM 1453 CD1 LEU A 87 -11.380 -3.871 21.383 1.00 0.00 C ATOM 1454 CD2 LEU A 87 -13.724 -4.715 21.593 1.00 0.00 C ATOM 0 H LEU A 87 -12.178 -4.933 18.108 1.00 0.00 H new ATOM 0 HA LEU A 87 -14.853 -3.965 18.690 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -12.247 -2.605 19.389 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.774 -2.548 20.247 1.00 0.00 H new ATOM 0 HG LEU A 87 -12.361 -5.185 20.023 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.050 -4.673 22.043 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.586 -3.635 20.674 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -11.612 -2.986 21.975 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -13.362 -5.505 22.251 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -14.016 -3.851 22.190 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -14.586 -5.076 21.032 1.00 0.00 H new ATOM 1466 N ILE A 88 -12.890 -2.526 16.518 1.00 0.00 N ATOM 1467 CA ILE A 88 -12.803 -1.508 15.472 1.00 0.00 C ATOM 1468 C ILE A 88 -12.207 -0.202 16.007 1.00 0.00 C ATOM 1469 O ILE A 88 -12.270 0.836 15.346 1.00 0.00 O ATOM 1470 CB ILE A 88 -14.185 -1.238 14.813 1.00 0.00 C ATOM 1471 CG1 ILE A 88 -14.033 -1.138 13.294 1.00 0.00 C ATOM 1472 CG2 ILE A 88 -14.847 0.022 15.364 1.00 0.00 C ATOM 1473 CD1 ILE A 88 -14.310 -2.437 12.572 1.00 0.00 C ATOM 0 H ILE A 88 -12.125 -3.201 16.505 1.00 0.00 H new ATOM 0 HA ILE A 88 -12.135 -1.902 14.706 1.00 0.00 H new ATOM 0 HB ILE A 88 -14.835 -2.078 15.057 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -14.711 -0.372 12.919 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -13.020 -0.810 13.059 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -15.810 0.171 14.875 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -14.999 -0.087 16.438 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -14.206 0.883 15.173 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -14.183 -2.291 11.499 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -13.615 -3.202 12.919 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -15.332 -2.756 12.776 1.00 0.00 H new ATOM 1485 N ARG A 89 -11.626 -0.261 17.204 1.00 0.00 N ATOM 1486 CA ARG A 89 -11.020 0.917 17.815 1.00 0.00 C ATOM 1487 C ARG A 89 -9.542 0.677 18.113 1.00 0.00 C ATOM 1488 O ARG A 89 -8.997 1.214 19.077 1.00 0.00 O ATOM 1489 CB ARG A 89 -11.764 1.286 19.101 1.00 0.00 C ATOM 1490 CG ARG A 89 -12.637 2.522 18.963 1.00 0.00 C ATOM 1491 CD ARG A 89 -14.017 2.175 18.426 1.00 0.00 C ATOM 1492 NE ARG A 89 -14.877 3.349 18.328 1.00 0.00 N ATOM 1493 CZ ARG A 89 -14.800 4.245 17.347 1.00 0.00 C ATOM 1494 NH1 ARG A 89 -13.902 4.106 16.380 1.00 0.00 N ATOM 1495 NH2 ARG A 89 -15.623 5.286 17.331 1.00 0.00 N ATOM 0 H ARG A 89 -11.563 -1.109 17.767 1.00 0.00 H new ATOM 0 HA ARG A 89 -11.096 1.745 17.110 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -12.386 0.444 19.406 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -11.038 1.451 19.897 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.735 3.009 19.933 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -12.155 3.236 18.295 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -13.918 1.715 17.443 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -14.484 1.437 19.078 1.00 0.00 H new ATOM 0 HE ARG A 89 -15.579 3.492 19.054 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -13.266 3.309 16.386 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -13.848 4.796 15.631 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -16.316 5.400 18.071 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -15.563 5.972 16.579 1.00 0.00 H new ATOM 1509 N ASN A 90 -8.900 -0.134 17.279 1.00 0.00 N ATOM 1510 CA ASN A 90 -7.486 -0.446 17.453 1.00 0.00 C ATOM 1511 C ASN A 90 -6.616 0.466 16.594 1.00 0.00 C ATOM 1512 O ASN A 90 -5.502 0.823 16.977 1.00 0.00 O ATOM 1513 CB ASN A 90 -7.217 -1.908 17.099 1.00 0.00 C ATOM 1514 CG ASN A 90 -5.814 -2.345 17.469 1.00 0.00 C ATOM 1515 OD1 ASN A 90 -5.082 -2.890 16.642 1.00 0.00 O ATOM 1516 ND2 ASN A 90 -5.429 -2.110 18.719 1.00 0.00 N ATOM 0 H ASN A 90 -9.336 -0.587 16.476 1.00 0.00 H new ATOM 0 HA ASN A 90 -7.231 -0.280 18.500 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -7.939 -2.542 17.613 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -7.370 -2.054 16.030 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -4.495 -2.384 19.025 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -6.067 -1.656 19.372 1.00 0.00 H new ATOM 1523 N GLY A 91 -7.131 0.840 15.427 1.00 0.00 N ATOM 1524 CA GLY A 91 -6.388 1.706 14.530 1.00 0.00 C ATOM 1525 C GLY A 91 -6.381 3.149 14.991 1.00 0.00 C ATOM 1526 O GLY A 91 -7.429 3.709 15.316 1.00 0.00 O ATOM 0 H GLY A 91 -8.050 0.559 15.086 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -5.361 1.348 14.452 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -6.823 1.649 13.532 1.00 0.00 H new ATOM 1530 N LEU A 92 -5.198 3.754 15.021 1.00 0.00 N ATOM 1531 CA LEU A 92 -5.058 5.141 15.446 1.00 0.00 C ATOM 1532 C LEU A 92 -3.937 5.837 14.678 1.00 0.00 C ATOM 1533 O LEU A 92 -2.920 5.224 14.356 1.00 0.00 O ATOM 1534 CB LEU A 92 -4.782 5.212 16.950 1.00 0.00 C ATOM 1535 CG LEU A 92 -3.483 4.539 17.402 1.00 0.00 C ATOM 1536 CD1 LEU A 92 -2.748 5.414 18.406 1.00 0.00 C ATOM 1537 CD2 LEU A 92 -3.771 3.169 17.998 1.00 0.00 C ATOM 0 H LEU A 92 -4.322 3.304 14.756 1.00 0.00 H new ATOM 0 HA LEU A 92 -5.995 5.655 15.231 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.754 6.260 17.250 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -5.616 4.751 17.479 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.843 4.407 16.529 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.828 4.919 18.715 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.507 6.372 17.946 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.382 5.579 19.277 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.836 2.706 18.314 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.431 3.278 18.859 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.253 2.540 17.249 1.00 0.00 H new ATOM 1549 N LYS A 93 -4.133 7.118 14.392 1.00 0.00 N ATOM 1550 CA LYS A 93 -3.139 7.898 13.664 1.00 0.00 C ATOM 1551 C LYS A 93 -3.097 9.336 14.173 1.00 0.00 C ATOM 1552 O LYS A 93 -3.145 10.286 13.391 1.00 0.00 O ATOM 1553 CB LYS A 93 -3.443 7.880 12.164 1.00 0.00 C ATOM 1554 CG LYS A 93 -2.833 6.692 11.435 1.00 0.00 C ATOM 1555 CD LYS A 93 -2.217 7.107 10.109 1.00 0.00 C ATOM 1556 CE LYS A 93 -1.618 5.915 9.378 1.00 0.00 C ATOM 1557 NZ LYS A 93 -0.143 5.832 9.565 1.00 0.00 N ATOM 0 H LYS A 93 -4.970 7.639 14.653 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.162 7.445 13.833 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -4.523 7.868 12.021 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.072 8.801 11.715 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.070 6.231 12.063 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -3.601 5.938 11.260 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.977 7.575 9.483 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.444 7.855 10.284 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -2.082 4.997 9.739 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.845 5.990 8.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 0.226 5.007 9.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.303 6.697 9.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.074 5.735 10.578 1.00 0.00 H new ATOM 1571 N GLN A 94 -3.002 9.487 15.491 1.00 0.00 N ATOM 1572 CA GLN A 94 -2.945 10.806 16.113 1.00 0.00 C ATOM 1573 C GLN A 94 -1.889 11.676 15.457 1.00 0.00 C ATOM 1574 O GLN A 94 -2.212 12.655 14.782 1.00 0.00 O ATOM 1575 CB GLN A 94 -2.663 10.675 17.612 1.00 0.00 C ATOM 1576 CG GLN A 94 -3.795 11.184 18.489 1.00 0.00 C ATOM 1577 CD GLN A 94 -4.109 12.647 18.247 1.00 0.00 C ATOM 1578 OE1 GLN A 94 -3.251 13.414 17.806 1.00 0.00 O ATOM 1579 NE2 GLN A 94 -5.343 13.045 18.532 1.00 0.00 N ATOM 0 H GLN A 94 -2.963 8.710 16.150 1.00 0.00 H new ATOM 0 HA GLN A 94 -3.914 11.285 15.974 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -2.474 9.628 17.848 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -1.753 11.225 17.852 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -4.689 10.589 18.303 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -3.530 11.042 19.537 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -6.023 12.377 18.895 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -5.611 14.018 18.388 1.00 0.00 H new ATOM 1588 N LYS A 95 -0.629 11.324 15.662 1.00 0.00 N ATOM 1589 CA LYS A 95 0.466 12.090 15.095 1.00 0.00 C ATOM 1590 C LYS A 95 1.808 11.453 15.444 1.00 0.00 C ATOM 1591 O LYS A 95 2.524 11.927 16.325 1.00 0.00 O ATOM 1592 CB LYS A 95 0.393 13.526 15.618 1.00 0.00 C ATOM 1593 CG LYS A 95 1.166 14.532 14.779 1.00 0.00 C ATOM 1594 CD LYS A 95 2.652 14.217 14.750 1.00 0.00 C ATOM 1595 CE LYS A 95 3.461 15.378 14.197 1.00 0.00 C ATOM 1596 NZ LYS A 95 2.817 15.994 13.006 1.00 0.00 N ATOM 0 H LYS A 95 -0.342 10.516 16.215 1.00 0.00 H new ATOM 0 HA LYS A 95 0.378 12.097 14.009 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -0.652 13.833 15.662 1.00 0.00 H new ATOM 0 HB3 LYS A 95 0.776 13.550 16.638 1.00 0.00 H new ATOM 0 HG2 LYS A 95 0.775 14.534 13.762 1.00 0.00 H new ATOM 0 HG3 LYS A 95 1.014 15.534 15.181 1.00 0.00 H new ATOM 0 HD2 LYS A 95 2.994 13.982 15.758 1.00 0.00 H new ATOM 0 HD3 LYS A 95 2.824 13.330 14.140 1.00 0.00 H new ATOM 0 HE2 LYS A 95 3.586 16.134 14.972 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.458 15.029 13.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 3.509 16.586 12.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 2.476 15.245 12.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.015 16.582 13.310 1.00 0.00 H new ATOM 1610 N GLU A 96 2.136 10.366 14.745 1.00 0.00 N ATOM 1611 CA GLU A 96 3.387 9.644 14.968 1.00 0.00 C ATOM 1612 C GLU A 96 3.643 9.412 16.457 1.00 0.00 C ATOM 1613 O GLU A 96 4.790 9.308 16.891 1.00 0.00 O ATOM 1614 CB GLU A 96 4.563 10.401 14.334 1.00 0.00 C ATOM 1615 CG GLU A 96 5.009 11.629 15.113 1.00 0.00 C ATOM 1616 CD GLU A 96 6.306 12.212 14.586 1.00 0.00 C ATOM 1617 OE1 GLU A 96 6.315 12.695 13.435 1.00 0.00 O ATOM 1618 OE2 GLU A 96 7.312 12.185 15.327 1.00 0.00 O ATOM 0 H GLU A 96 1.547 9.965 14.015 1.00 0.00 H new ATOM 0 HA GLU A 96 3.297 8.668 14.491 1.00 0.00 H new ATOM 0 HB2 GLU A 96 5.408 9.720 14.237 1.00 0.00 H new ATOM 0 HB3 GLU A 96 4.282 10.707 13.326 1.00 0.00 H new ATOM 0 HG2 GLU A 96 4.228 12.388 15.067 1.00 0.00 H new ATOM 0 HG3 GLU A 96 5.134 11.364 16.163 1.00 0.00 H new ATOM 1625 N ALA A 97 2.566 9.328 17.234 1.00 0.00 N ATOM 1626 CA ALA A 97 2.676 9.107 18.671 1.00 0.00 C ATOM 1627 C ALA A 97 3.528 10.185 19.331 1.00 0.00 C ATOM 1628 O ALA A 97 4.202 10.962 18.653 1.00 0.00 O ATOM 1629 CB ALA A 97 3.257 7.729 18.947 1.00 0.00 C ATOM 0 H ALA A 97 1.609 9.410 16.892 1.00 0.00 H new ATOM 0 HA ALA A 97 1.675 9.162 19.100 1.00 0.00 H new ATOM 0 HB1 ALA A 97 3.334 7.576 20.023 1.00 0.00 H new ATOM 0 HB2 ALA A 97 2.606 6.967 18.518 1.00 0.00 H new ATOM 0 HB3 ALA A 97 4.247 7.655 18.498 1.00 0.00 H new ATOM 1635 N LYS A 98 3.495 10.227 20.658 1.00 0.00 N ATOM 1636 CA LYS A 98 4.265 11.212 21.412 1.00 0.00 C ATOM 1637 C LYS A 98 3.884 12.630 21.003 1.00 0.00 C ATOM 1638 O LYS A 98 4.585 13.273 20.223 1.00 0.00 O ATOM 1639 CB LYS A 98 5.763 10.992 21.194 1.00 0.00 C ATOM 1640 CG LYS A 98 6.204 9.552 21.405 1.00 0.00 C ATOM 1641 CD LYS A 98 6.887 9.369 22.751 1.00 0.00 C ATOM 1642 CE LYS A 98 6.446 8.081 23.431 1.00 0.00 C ATOM 1643 NZ LYS A 98 6.792 6.880 22.623 1.00 0.00 N ATOM 0 H LYS A 98 2.944 9.591 21.235 1.00 0.00 H new ATOM 0 HA LYS A 98 4.035 11.084 22.470 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.023 11.298 20.181 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.319 11.637 21.874 1.00 0.00 H new ATOM 0 HG2 LYS A 98 5.338 8.893 21.343 1.00 0.00 H new ATOM 0 HG3 LYS A 98 6.886 9.259 20.607 1.00 0.00 H new ATOM 0 HD2 LYS A 98 7.968 9.357 22.613 1.00 0.00 H new ATOM 0 HD3 LYS A 98 6.658 10.218 23.395 1.00 0.00 H new ATOM 0 HE2 LYS A 98 6.918 8.008 24.411 1.00 0.00 H new ATOM 0 HE3 LYS A 98 5.369 8.109 23.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.583 6.021 23.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 6.231 6.877 21.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 7.804 6.902 22.385 1.00 0.00 H new TER 1657 LYS A 98