USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 793 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 9 GLN : amide:sc= 0.522 K(o=0.62,f=-4.5!) USER MOD Set 1.2: A 45 ASN : amide:sc= 0.102 K(o=0.62,f=-1.3) USER MOD Set 2.1: A 7 LYS NZ :NH3+ 175:sc= 1.03 (180deg=0.859) USER MOD Set 2.2: A 47 GLN : amide:sc= 0 K(o=1,f=0.42) USER MOD Set 3.1: A 1 LYS NZ :NH3+ -132:sc= 1.65 (180deg=-2.28!) USER MOD Set 3.2: A 22 SER OG : rot -43:sc= 0.8 USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -105:sc= 0.941 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -1 HIS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -122:sc= 1.17 (180deg=-1.13!) USER MOD Single : A 32 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 36 LYS NZ :NH3+ -175:sc= 1.22 (180deg=1.07) USER MOD Single : A 49 THR OG1 : rot 86:sc= 1.21 USER MOD Single : A 51 SER OG : rot -104:sc= 1.24 USER MOD Single : A 54 ASN : amide:sc= 0.028 X(o=0.028,f=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 153:sc= 2.41 (180deg=2.01) USER MOD Single : A 70 GLN : amide:sc= 0.349 K(o=0.35,f=-3.9!) USER MOD Single : A 71 LYS NZ :NH3+ -130:sc= 1.19 (180deg=-0.908!) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -106:sc= 1.23 (180deg=-0.105) USER MOD Single : A 78 ASN : amide:sc= 0.941 K(o=0.94,f=0) USER MOD Single : A 82 ASN : amide:sc= 0.336 K(o=0.34,f=-0.62) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -1 8.860 14.704 3.430 1.00 0.00 N ATOM 2 CA HIS A -1 7.403 14.608 3.163 1.00 0.00 C ATOM 3 C HIS A -1 6.630 14.196 4.455 1.00 0.00 C ATOM 4 O HIS A -1 6.430 13.011 4.745 1.00 0.00 O ATOM 5 CB HIS A -1 7.134 13.663 1.959 1.00 0.00 C ATOM 6 CG HIS A -1 7.404 14.279 0.586 1.00 0.00 C ATOM 7 ND1 HIS A -1 6.463 15.029 -0.108 1.00 0.00 N ATOM 8 CD2 HIS A -1 8.608 14.194 -0.135 1.00 0.00 C ATOM 9 CE1 HIS A -1 7.208 15.337 -1.219 1.00 0.00 C ATOM 10 NE2 HIS A -1 8.496 14.884 -1.329 1.00 0.00 N ATOM 0 H1 HIS A -1 9.355 14.979 2.558 1.00 0.00 H new ATOM 0 H2 HIS A -1 9.032 15.419 4.166 1.00 0.00 H new ATOM 0 H3 HIS A -1 9.215 13.782 3.754 1.00 0.00 H new ATOM 0 HA HIS A -1 7.022 15.589 2.880 1.00 0.00 H new ATOM 0 HB2 HIS A -1 7.752 12.772 2.070 1.00 0.00 H new ATOM 0 HB3 HIS A -1 6.095 13.337 1.997 1.00 0.00 H new ATOM 0 HD2 HIS A -1 9.491 13.667 0.195 1.00 0.00 H new ATOM 0 HE1 HIS A -1 6.778 15.937 -2.007 1.00 0.00 H new ATOM 0 HE2 HIS A -1 9.177 15.017 -2.077 1.00 0.00 H new ATOM 18 N MET A 0 6.136 15.198 5.204 1.00 0.00 N ATOM 19 CA MET A 0 5.242 14.987 6.377 1.00 0.00 C ATOM 20 C MET A 0 3.782 14.673 5.906 1.00 0.00 C ATOM 21 O MET A 0 3.114 15.530 5.308 1.00 0.00 O ATOM 22 CB MET A 0 5.364 16.279 7.231 1.00 0.00 C ATOM 23 CG MET A 0 4.600 16.269 8.567 1.00 0.00 C ATOM 24 SD MET A 0 4.751 17.870 9.388 1.00 0.00 S ATOM 25 CE MET A 0 6.239 17.623 10.373 1.00 0.00 C ATOM 0 H MET A 0 6.340 16.180 5.020 1.00 0.00 H new ATOM 0 HA MET A 0 5.526 14.123 6.979 1.00 0.00 H new ATOM 0 HB2 MET A 0 6.419 16.458 7.438 1.00 0.00 H new ATOM 0 HB3 MET A 0 5.009 17.121 6.636 1.00 0.00 H new ATOM 0 HG2 MET A 0 3.549 16.041 8.391 1.00 0.00 H new ATOM 0 HG3 MET A 0 4.993 15.483 9.212 1.00 0.00 H new ATOM 0 HE1 MET A 0 6.457 18.530 10.936 1.00 0.00 H new ATOM 0 HE2 MET A 0 6.084 16.795 11.065 1.00 0.00 H new ATOM 0 HE3 MET A 0 7.077 17.394 9.715 1.00 0.00 H new ATOM 35 N LYS A 1 3.301 13.425 6.116 1.00 0.00 N ATOM 36 CA LYS A 1 2.030 12.963 5.482 1.00 0.00 C ATOM 37 C LYS A 1 1.179 11.937 6.302 1.00 0.00 C ATOM 38 O LYS A 1 1.717 10.961 6.840 1.00 0.00 O ATOM 39 CB LYS A 1 2.363 12.443 4.053 1.00 0.00 C ATOM 40 CG LYS A 1 1.243 12.630 3.003 1.00 0.00 C ATOM 41 CD LYS A 1 1.063 14.086 2.494 1.00 0.00 C ATOM 42 CE LYS A 1 -0.102 14.876 3.133 1.00 0.00 C ATOM 43 NZ LYS A 1 0.371 15.862 4.144 1.00 0.00 N ATOM 0 H LYS A 1 3.757 12.729 6.705 1.00 0.00 H new ATOM 0 HA LYS A 1 1.368 13.828 5.443 1.00 0.00 H new ATOM 0 HB2 LYS A 1 3.259 12.953 3.699 1.00 0.00 H new ATOM 0 HB3 LYS A 1 2.604 11.382 4.118 1.00 0.00 H new ATOM 0 HG2 LYS A 1 1.453 11.985 2.150 1.00 0.00 H new ATOM 0 HG3 LYS A 1 0.301 12.292 3.434 1.00 0.00 H new ATOM 0 HD2 LYS A 1 1.990 14.632 2.672 1.00 0.00 H new ATOM 0 HD3 LYS A 1 0.912 14.059 1.415 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -0.656 15.397 2.352 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -0.795 14.179 3.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -0.196 15.770 5.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 1.371 15.681 4.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 0.269 16.825 3.764 1.00 0.00 H new ATOM 57 N VAL A 2 -0.170 12.120 6.293 1.00 0.00 N ATOM 58 CA VAL A 2 -1.151 11.073 6.724 1.00 0.00 C ATOM 59 C VAL A 2 -1.277 10.022 5.564 1.00 0.00 C ATOM 60 O VAL A 2 -2.077 10.180 4.631 1.00 0.00 O ATOM 61 CB VAL A 2 -2.550 11.655 7.146 1.00 0.00 C ATOM 62 CG1 VAL A 2 -3.486 10.569 7.730 1.00 0.00 C ATOM 63 CG2 VAL A 2 -2.522 12.804 8.180 1.00 0.00 C ATOM 0 H VAL A 2 -0.610 12.989 5.990 1.00 0.00 H new ATOM 0 HA VAL A 2 -0.775 10.596 7.629 1.00 0.00 H new ATOM 0 HB VAL A 2 -2.918 12.054 6.201 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -4.439 11.020 8.006 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -3.655 9.794 6.983 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.024 10.127 8.613 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -3.541 13.125 8.395 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -2.050 12.455 9.099 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.955 13.643 7.776 1.00 0.00 H new ATOM 73 N ASP A 3 -0.436 8.979 5.628 1.00 0.00 N ATOM 74 CA ASP A 3 -0.200 8.052 4.491 1.00 0.00 C ATOM 75 C ASP A 3 -0.378 6.590 5.005 1.00 0.00 C ATOM 76 O ASP A 3 0.338 6.127 5.903 1.00 0.00 O ATOM 77 CB ASP A 3 1.209 8.359 3.905 1.00 0.00 C ATOM 78 CG ASP A 3 1.303 8.149 2.406 1.00 0.00 C ATOM 79 OD1 ASP A 3 1.209 6.990 1.951 1.00 0.00 O ATOM 80 OD2 ASP A 3 1.425 9.145 1.663 1.00 0.00 O ATOM 0 H ASP A 3 0.102 8.748 6.463 1.00 0.00 H new ATOM 0 HA ASP A 3 -0.915 8.183 3.679 1.00 0.00 H new ATOM 0 HB2 ASP A 3 1.472 9.391 4.136 1.00 0.00 H new ATOM 0 HB3 ASP A 3 1.945 7.724 4.399 1.00 0.00 H new ATOM 85 N ILE A 4 -1.409 5.898 4.502 1.00 0.00 N ATOM 86 CA ILE A 4 -1.953 4.665 5.137 1.00 0.00 C ATOM 87 C ILE A 4 -1.720 3.448 4.178 1.00 0.00 C ATOM 88 O ILE A 4 -2.435 3.256 3.191 1.00 0.00 O ATOM 89 CB ILE A 4 -3.414 4.878 5.694 1.00 0.00 C ATOM 90 CG1 ILE A 4 -4.515 5.218 4.650 1.00 0.00 C ATOM 91 CG2 ILE A 4 -3.427 5.948 6.816 1.00 0.00 C ATOM 92 CD1 ILE A 4 -5.974 5.147 5.141 1.00 0.00 C ATOM 0 H ILE A 4 -1.896 6.166 3.647 1.00 0.00 H new ATOM 0 HA ILE A 4 -1.406 4.418 6.047 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.681 3.893 6.077 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.330 6.224 4.275 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -4.406 4.538 3.805 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.445 6.077 7.184 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -2.784 5.625 7.634 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.062 6.895 6.420 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.646 5.405 4.323 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -6.193 4.136 5.486 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.116 5.849 5.962 1.00 0.00 H new ATOM 104 N THR A 5 -0.680 2.641 4.462 1.00 0.00 N ATOM 105 CA THR A 5 -0.279 1.484 3.605 1.00 0.00 C ATOM 106 C THR A 5 -0.737 0.163 4.313 1.00 0.00 C ATOM 107 O THR A 5 -0.050 -0.389 5.185 1.00 0.00 O ATOM 108 CB THR A 5 1.240 1.568 3.255 1.00 0.00 C ATOM 109 OG1 THR A 5 1.577 2.834 2.681 1.00 0.00 O ATOM 110 CG2 THR A 5 1.712 0.505 2.257 1.00 0.00 C ATOM 0 H THR A 5 -0.090 2.763 5.285 1.00 0.00 H new ATOM 0 HA THR A 5 -0.778 1.502 2.636 1.00 0.00 H new ATOM 0 HB THR A 5 1.736 1.409 4.212 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.720 2.729 1.717 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.778 0.632 2.067 1.00 0.00 H new ATOM 0 HG22 THR A 5 1.533 -0.487 2.671 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.161 0.613 1.323 1.00 0.00 H new ATOM 118 N ILE A 6 -1.938 -0.317 3.948 1.00 0.00 N ATOM 119 CA ILE A 6 -2.629 -1.447 4.637 1.00 0.00 C ATOM 120 C ILE A 6 -2.307 -2.743 3.836 1.00 0.00 C ATOM 121 O ILE A 6 -2.914 -3.003 2.793 1.00 0.00 O ATOM 122 CB ILE A 6 -4.180 -1.211 4.788 1.00 0.00 C ATOM 123 CG1 ILE A 6 -4.611 0.191 5.327 1.00 0.00 C ATOM 124 CG2 ILE A 6 -4.815 -2.307 5.682 1.00 0.00 C ATOM 125 CD1 ILE A 6 -4.890 1.219 4.216 1.00 0.00 C ATOM 0 H ILE A 6 -2.469 0.062 3.164 1.00 0.00 H new ATOM 0 HA ILE A 6 -2.263 -1.533 5.660 1.00 0.00 H new ATOM 0 HB ILE A 6 -4.550 -1.261 3.764 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -5.506 0.077 5.938 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -3.827 0.577 5.979 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -5.886 -2.126 5.774 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -4.650 -3.285 5.231 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -4.357 -2.281 6.671 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.184 2.168 4.664 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -3.989 1.363 3.619 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -5.695 0.855 3.577 1.00 0.00 H new ATOM 137 N LYS A 7 -1.341 -3.547 4.298 1.00 0.00 N ATOM 138 CA LYS A 7 -0.838 -4.710 3.518 1.00 0.00 C ATOM 139 C LYS A 7 -1.358 -6.061 4.106 1.00 0.00 C ATOM 140 O LYS A 7 -1.103 -6.433 5.257 1.00 0.00 O ATOM 141 CB LYS A 7 0.673 -4.537 3.230 1.00 0.00 C ATOM 142 CG LYS A 7 1.634 -4.581 4.429 1.00 0.00 C ATOM 143 CD LYS A 7 3.049 -4.022 4.163 1.00 0.00 C ATOM 144 CE LYS A 7 3.865 -4.684 3.035 1.00 0.00 C ATOM 145 NZ LYS A 7 4.125 -6.111 3.335 1.00 0.00 N ATOM 0 H LYS A 7 -0.887 -3.423 5.203 1.00 0.00 H new ATOM 0 HA LYS A 7 -1.266 -4.750 2.516 1.00 0.00 H new ATOM 0 HB2 LYS A 7 0.973 -5.316 2.530 1.00 0.00 H new ATOM 0 HB3 LYS A 7 0.812 -3.582 2.723 1.00 0.00 H new ATOM 0 HG2 LYS A 7 1.189 -4.021 5.251 1.00 0.00 H new ATOM 0 HG3 LYS A 7 1.727 -5.615 4.761 1.00 0.00 H new ATOM 0 HD2 LYS A 7 2.956 -2.960 3.935 1.00 0.00 H new ATOM 0 HD3 LYS A 7 3.623 -4.100 5.086 1.00 0.00 H new ATOM 0 HE2 LYS A 7 3.324 -4.600 2.092 1.00 0.00 H new ATOM 0 HE3 LYS A 7 4.811 -4.157 2.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 4.601 -6.555 2.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 4.733 -6.184 4.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 3.224 -6.598 3.516 1.00 0.00 H new ATOM 159 N ILE A 8 -2.193 -6.741 3.307 1.00 0.00 N ATOM 160 CA ILE A 8 -3.147 -7.775 3.791 1.00 0.00 C ATOM 161 C ILE A 8 -2.576 -9.153 3.342 1.00 0.00 C ATOM 162 O ILE A 8 -2.684 -9.511 2.163 1.00 0.00 O ATOM 163 CB ILE A 8 -4.592 -7.477 3.230 1.00 0.00 C ATOM 164 CG1 ILE A 8 -5.149 -6.066 3.601 1.00 0.00 C ATOM 165 CG2 ILE A 8 -5.612 -8.554 3.679 1.00 0.00 C ATOM 166 CD1 ILE A 8 -6.422 -5.625 2.854 1.00 0.00 C ATOM 0 H ILE A 8 -2.233 -6.595 2.298 1.00 0.00 H new ATOM 0 HA ILE A 8 -3.250 -7.774 4.876 1.00 0.00 H new ATOM 0 HB ILE A 8 -4.470 -7.501 2.147 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.355 -6.048 4.671 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -4.368 -5.329 3.415 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.595 -8.315 3.274 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -5.295 -9.530 3.312 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -5.664 -8.575 4.768 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.716 -4.631 3.192 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.225 -5.600 1.782 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.227 -6.331 3.058 1.00 0.00 H new ATOM 178 N GLN A 9 -1.989 -9.931 4.269 1.00 0.00 N ATOM 179 CA GLN A 9 -1.448 -11.273 3.941 1.00 0.00 C ATOM 180 C GLN A 9 -2.404 -12.414 4.409 1.00 0.00 C ATOM 181 O GLN A 9 -2.892 -12.450 5.546 1.00 0.00 O ATOM 182 CB GLN A 9 -0.019 -11.425 4.511 1.00 0.00 C ATOM 183 CG GLN A 9 0.797 -12.566 3.834 1.00 0.00 C ATOM 184 CD GLN A 9 2.089 -12.986 4.532 1.00 0.00 C ATOM 185 OE1 GLN A 9 2.192 -14.090 5.058 1.00 0.00 O ATOM 186 NE2 GLN A 9 3.104 -12.160 4.561 1.00 0.00 N ATOM 0 H GLN A 9 -1.875 -9.661 5.246 1.00 0.00 H new ATOM 0 HA GLN A 9 -1.383 -11.364 2.857 1.00 0.00 H new ATOM 0 HB2 GLN A 9 0.516 -10.483 4.388 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -0.081 -11.619 5.582 1.00 0.00 H new ATOM 0 HG2 GLN A 9 0.154 -13.442 3.750 1.00 0.00 H new ATOM 0 HG3 GLN A 9 1.043 -12.254 2.819 1.00 0.00 H new ATOM 0 HE21 GLN A 9 3.026 -11.241 4.126 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.973 -12.436 5.019 1.00 0.00 H new ATOM 195 N ARG A 10 -2.627 -13.383 3.514 1.00 0.00 N ATOM 196 CA ARG A 10 -3.433 -14.604 3.820 1.00 0.00 C ATOM 197 C ARG A 10 -2.518 -15.866 4.032 1.00 0.00 C ATOM 198 O ARG A 10 -2.755 -16.920 3.438 1.00 0.00 O ATOM 199 CB ARG A 10 -4.492 -14.705 2.677 1.00 0.00 C ATOM 200 CG ARG A 10 -5.542 -13.553 2.656 1.00 0.00 C ATOM 201 CD ARG A 10 -6.321 -13.381 1.335 1.00 0.00 C ATOM 202 NE ARG A 10 -7.508 -14.284 1.235 1.00 0.00 N ATOM 203 CZ ARG A 10 -8.710 -14.032 1.767 1.00 0.00 C ATOM 204 NH1 ARG A 10 -8.960 -12.984 2.502 1.00 0.00 N ATOM 205 NH2 ARG A 10 -9.687 -14.865 1.560 1.00 0.00 N ATOM 0 H ARG A 10 -2.264 -13.358 2.561 1.00 0.00 H new ATOM 0 HA ARG A 10 -3.959 -14.545 4.773 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.972 -14.721 1.719 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -5.018 -15.655 2.771 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.259 -13.725 3.459 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.031 -12.616 2.880 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -6.650 -12.346 1.246 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.652 -13.576 0.497 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.393 -15.158 0.723 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -8.221 -12.309 2.695 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -9.895 -12.840 2.883 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -9.533 -15.701 0.997 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -10.607 -14.682 1.961 1.00 0.00 H new ATOM 219 N ASP A 11 -1.471 -15.740 4.887 1.00 0.00 N ATOM 220 CA ASP A 11 -0.301 -16.673 4.961 1.00 0.00 C ATOM 221 C ASP A 11 0.288 -17.144 3.581 1.00 0.00 C ATOM 222 O ASP A 11 -0.055 -18.211 3.066 1.00 0.00 O ATOM 223 CB ASP A 11 -0.535 -17.800 6.006 1.00 0.00 C ATOM 224 CG ASP A 11 -0.265 -17.394 7.457 1.00 0.00 C ATOM 225 OD1 ASP A 11 0.843 -16.914 7.762 1.00 0.00 O ATOM 226 OD2 ASP A 11 -1.142 -17.574 8.326 1.00 0.00 O ATOM 0 H ASP A 11 -1.409 -14.975 5.559 1.00 0.00 H new ATOM 0 HA ASP A 11 0.528 -16.075 5.340 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -1.566 -18.143 5.925 1.00 0.00 H new ATOM 0 HB3 ASP A 11 0.103 -18.647 5.755 1.00 0.00 H new ATOM 231 N GLY A 12 1.150 -16.305 2.975 1.00 0.00 N ATOM 232 CA GLY A 12 1.645 -16.515 1.588 1.00 0.00 C ATOM 233 C GLY A 12 1.314 -15.349 0.637 1.00 0.00 C ATOM 234 O GLY A 12 2.206 -14.582 0.270 1.00 0.00 O ATOM 0 H GLY A 12 1.524 -15.468 3.423 1.00 0.00 H new ATOM 0 HA2 GLY A 12 2.725 -16.658 1.613 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.211 -17.433 1.190 1.00 0.00 H new ATOM 238 N GLN A 13 0.042 -15.230 0.223 1.00 0.00 N ATOM 239 CA GLN A 13 -0.398 -14.189 -0.755 1.00 0.00 C ATOM 240 C GLN A 13 -0.572 -12.787 -0.075 1.00 0.00 C ATOM 241 O GLN A 13 -1.318 -12.664 0.902 1.00 0.00 O ATOM 242 CB GLN A 13 -1.694 -14.680 -1.478 1.00 0.00 C ATOM 243 CG GLN A 13 -1.731 -14.456 -3.014 1.00 0.00 C ATOM 244 CD GLN A 13 -1.677 -13.005 -3.509 1.00 0.00 C ATOM 245 OE1 GLN A 13 -0.624 -12.379 -3.556 1.00 0.00 O ATOM 246 NE2 GLN A 13 -2.781 -12.433 -3.922 1.00 0.00 N ATOM 0 H GLN A 13 -0.711 -15.838 0.544 1.00 0.00 H new ATOM 0 HA GLN A 13 0.378 -14.049 -1.507 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -1.817 -15.745 -1.281 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -2.551 -14.173 -1.034 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -0.893 -14.996 -3.455 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -2.642 -14.912 -3.401 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -3.663 -12.943 -3.888 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -2.758 -11.477 -4.278 1.00 0.00 H new ATOM 255 N GLU A 14 0.147 -11.764 -0.572 1.00 0.00 N ATOM 256 CA GLU A 14 0.452 -10.514 0.189 1.00 0.00 C ATOM 257 C GLU A 14 -0.010 -9.257 -0.621 1.00 0.00 C ATOM 258 O GLU A 14 0.573 -8.928 -1.659 1.00 0.00 O ATOM 259 CB GLU A 14 1.987 -10.547 0.491 1.00 0.00 C ATOM 260 CG GLU A 14 2.451 -9.896 1.817 1.00 0.00 C ATOM 261 CD GLU A 14 2.708 -8.408 1.856 1.00 0.00 C ATOM 262 OE1 GLU A 14 3.654 -7.939 1.192 1.00 0.00 O ATOM 263 OE2 GLU A 14 2.083 -7.704 2.678 1.00 0.00 O ATOM 0 H GLU A 14 0.539 -11.770 -1.514 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.093 -10.453 1.131 1.00 0.00 H new ATOM 0 HB2 GLU A 14 2.311 -11.588 0.492 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.506 -10.052 -0.330 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.698 -10.119 2.573 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.370 -10.396 2.124 1.00 0.00 H new ATOM 270 N ILE A 15 -1.094 -8.583 -0.184 1.00 0.00 N ATOM 271 CA ILE A 15 -1.799 -7.556 -1.016 1.00 0.00 C ATOM 272 C ILE A 15 -1.597 -6.143 -0.366 1.00 0.00 C ATOM 273 O ILE A 15 -2.272 -5.808 0.613 1.00 0.00 O ATOM 274 CB ILE A 15 -3.316 -7.932 -1.241 1.00 0.00 C ATOM 275 CG1 ILE A 15 -3.588 -9.344 -1.858 1.00 0.00 C ATOM 276 CG2 ILE A 15 -4.018 -6.892 -2.156 1.00 0.00 C ATOM 277 CD1 ILE A 15 -3.730 -10.488 -0.835 1.00 0.00 C ATOM 0 H ILE A 15 -1.508 -8.723 0.737 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.363 -7.528 -2.015 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.719 -7.939 -0.228 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.500 -9.294 -2.453 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.775 -9.588 -2.542 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -5.061 -7.175 -2.295 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.968 -5.907 -1.692 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.518 -6.863 -3.124 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.916 -11.425 -1.360 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.811 -10.574 -0.255 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.563 -10.276 -0.165 1.00 0.00 H new ATOM 289 N GLU A 16 -0.708 -5.303 -0.934 1.00 0.00 N ATOM 290 CA GLU A 16 -0.416 -3.940 -0.400 1.00 0.00 C ATOM 291 C GLU A 16 -1.427 -2.850 -0.897 1.00 0.00 C ATOM 292 O GLU A 16 -1.487 -2.528 -2.088 1.00 0.00 O ATOM 293 CB GLU A 16 1.082 -3.633 -0.676 1.00 0.00 C ATOM 294 CG GLU A 16 1.616 -2.322 -0.034 1.00 0.00 C ATOM 295 CD GLU A 16 3.102 -2.311 0.311 1.00 0.00 C ATOM 296 OE1 GLU A 16 3.943 -2.483 -0.593 1.00 0.00 O ATOM 297 OE2 GLU A 16 3.433 -2.136 1.504 1.00 0.00 O ATOM 0 H GLU A 16 -0.172 -5.539 -1.769 1.00 0.00 H new ATOM 0 HA GLU A 16 -0.572 -3.914 0.678 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.681 -4.468 -0.312 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.233 -3.579 -1.754 1.00 0.00 H new ATOM 0 HG2 GLU A 16 1.414 -1.497 -0.717 1.00 0.00 H new ATOM 0 HG3 GLU A 16 1.049 -2.128 0.877 1.00 0.00 H new ATOM 304 N ILE A 17 -2.222 -2.283 0.033 1.00 0.00 N ATOM 305 CA ILE A 17 -3.296 -1.287 -0.294 1.00 0.00 C ATOM 306 C ILE A 17 -2.814 0.132 0.169 1.00 0.00 C ATOM 307 O ILE A 17 -2.863 0.464 1.359 1.00 0.00 O ATOM 308 CB ILE A 17 -4.677 -1.745 0.310 1.00 0.00 C ATOM 309 CG1 ILE A 17 -5.174 -3.152 -0.148 1.00 0.00 C ATOM 310 CG2 ILE A 17 -5.818 -0.712 0.127 1.00 0.00 C ATOM 311 CD1 ILE A 17 -5.420 -3.343 -1.658 1.00 0.00 C ATOM 0 H ILE A 17 -2.149 -2.492 1.029 1.00 0.00 H new ATOM 0 HA ILE A 17 -3.471 -1.227 -1.368 1.00 0.00 H new ATOM 0 HB ILE A 17 -4.439 -1.819 1.371 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.442 -3.893 0.174 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -6.103 -3.373 0.378 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -6.735 -1.101 0.569 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -5.546 0.222 0.619 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -5.977 -0.529 -0.936 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.762 -4.361 -1.845 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.180 -2.638 -1.995 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.493 -3.166 -2.203 1.00 0.00 H new ATOM 323 N ASP A 18 -2.341 0.961 -0.779 1.00 0.00 N ATOM 324 CA ASP A 18 -1.551 2.188 -0.467 1.00 0.00 C ATOM 325 C ASP A 18 -2.387 3.503 -0.676 1.00 0.00 C ATOM 326 O ASP A 18 -2.521 4.014 -1.794 1.00 0.00 O ATOM 327 CB ASP A 18 -0.258 2.041 -1.321 1.00 0.00 C ATOM 328 CG ASP A 18 0.915 2.912 -0.894 1.00 0.00 C ATOM 329 OD1 ASP A 18 1.174 3.041 0.321 1.00 0.00 O ATOM 330 OD2 ASP A 18 1.578 3.508 -1.772 1.00 0.00 O ATOM 0 H ASP A 18 -2.488 0.810 -1.777 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.279 2.283 0.584 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.058 0.998 -1.293 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -0.501 2.273 -2.358 1.00 0.00 H new ATOM 335 N ILE A 19 -2.989 4.026 0.412 1.00 0.00 N ATOM 336 CA ILE A 19 -4.052 5.091 0.366 1.00 0.00 C ATOM 337 C ILE A 19 -3.582 6.351 1.189 1.00 0.00 C ATOM 338 O ILE A 19 -2.823 6.228 2.151 1.00 0.00 O ATOM 339 CB ILE A 19 -5.424 4.485 0.864 1.00 0.00 C ATOM 340 CG1 ILE A 19 -5.902 3.185 0.147 1.00 0.00 C ATOM 341 CG2 ILE A 19 -6.599 5.497 0.917 1.00 0.00 C ATOM 342 CD1 ILE A 19 -6.161 3.283 -1.369 1.00 0.00 C ATOM 0 H ILE A 19 -2.760 3.730 1.361 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.212 5.435 -0.656 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.155 4.207 1.883 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -5.154 2.410 0.314 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.821 2.850 0.628 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -7.498 4.992 1.270 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -6.348 6.310 1.598 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -6.777 5.901 -0.080 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.488 2.314 -1.746 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.936 4.026 -1.558 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.243 3.579 -1.877 1.00 0.00 H new ATOM 354 N ARG A 20 -3.982 7.586 0.810 1.00 0.00 N ATOM 355 CA ARG A 20 -3.548 8.841 1.521 1.00 0.00 C ATOM 356 C ARG A 20 -4.770 9.770 1.816 1.00 0.00 C ATOM 357 O ARG A 20 -5.677 9.923 0.993 1.00 0.00 O ATOM 358 CB ARG A 20 -2.348 9.631 0.883 1.00 0.00 C ATOM 359 CG ARG A 20 -1.742 9.262 -0.499 1.00 0.00 C ATOM 360 CD ARG A 20 -1.016 7.908 -0.474 1.00 0.00 C ATOM 361 NE ARG A 20 -0.097 7.636 -1.603 1.00 0.00 N ATOM 362 CZ ARG A 20 0.689 6.557 -1.604 1.00 0.00 C ATOM 363 NH1 ARG A 20 1.222 6.033 -0.526 1.00 0.00 N ATOM 364 NH2 ARG A 20 0.928 5.950 -2.726 1.00 0.00 N ATOM 0 H ARG A 20 -4.603 7.755 0.019 1.00 0.00 H new ATOM 0 HA ARG A 20 -3.130 8.481 2.461 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -2.661 10.673 0.817 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -1.530 9.589 1.602 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -2.536 9.232 -1.245 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -1.044 10.041 -0.807 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -0.448 7.842 0.454 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -1.766 7.118 -0.445 1.00 0.00 H new ATOM 0 HE ARG A 20 -0.064 8.282 -2.391 1.00 0.00 H new ATOM 0 HH11 ARG A 20 1.044 6.453 0.386 1.00 0.00 H new ATOM 0 HH12 ARG A 20 1.814 5.206 -0.600 1.00 0.00 H new ATOM 0 HH21 ARG A 20 0.517 6.299 -3.592 1.00 0.00 H new ATOM 0 HH22 ARG A 20 1.527 5.124 -2.742 1.00 0.00 H new ATOM 378 N VAL A 21 -4.784 10.390 3.011 1.00 0.00 N ATOM 379 CA VAL A 21 -6.002 11.072 3.564 1.00 0.00 C ATOM 380 C VAL A 21 -5.586 12.317 4.419 1.00 0.00 C ATOM 381 O VAL A 21 -5.623 12.298 5.653 1.00 0.00 O ATOM 382 CB VAL A 21 -6.965 10.082 4.327 1.00 0.00 C ATOM 383 CG1 VAL A 21 -7.812 9.197 3.387 1.00 0.00 C ATOM 384 CG2 VAL A 21 -6.294 9.174 5.385 1.00 0.00 C ATOM 0 H VAL A 21 -3.971 10.441 3.624 1.00 0.00 H new ATOM 0 HA VAL A 21 -6.594 11.436 2.725 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.612 10.778 4.861 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -8.450 8.542 3.981 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -8.432 9.830 2.752 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -7.153 8.593 2.763 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.047 8.535 5.847 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -5.537 8.554 4.905 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -5.824 9.792 6.150 1.00 0.00 H new ATOM 394 N SER A 22 -5.199 13.429 3.763 1.00 0.00 N ATOM 395 CA SER A 22 -4.543 14.588 4.450 1.00 0.00 C ATOM 396 C SER A 22 -5.451 15.641 5.173 1.00 0.00 C ATOM 397 O SER A 22 -5.214 16.852 5.074 1.00 0.00 O ATOM 398 CB SER A 22 -3.650 15.234 3.361 1.00 0.00 C ATOM 399 OG SER A 22 -2.862 16.285 3.922 1.00 0.00 O ATOM 0 H SER A 22 -5.324 13.561 2.759 1.00 0.00 H new ATOM 0 HA SER A 22 -4.000 14.200 5.312 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.999 14.479 2.920 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.273 15.627 2.557 1.00 0.00 H new ATOM 0 HG SER A 22 -3.417 16.825 4.523 1.00 0.00 H new ATOM 405 N THR A 23 -6.497 15.200 5.887 1.00 0.00 N ATOM 406 CA THR A 23 -7.727 16.025 6.097 1.00 0.00 C ATOM 407 C THR A 23 -8.747 15.294 7.033 1.00 0.00 C ATOM 408 O THR A 23 -8.855 14.061 7.054 1.00 0.00 O ATOM 409 CB THR A 23 -8.380 16.442 4.730 1.00 0.00 C ATOM 410 OG1 THR A 23 -9.576 17.189 4.930 1.00 0.00 O ATOM 411 CG2 THR A 23 -8.706 15.270 3.794 1.00 0.00 C ATOM 0 H THR A 23 -6.530 14.283 6.333 1.00 0.00 H new ATOM 0 HA THR A 23 -7.428 16.944 6.601 1.00 0.00 H new ATOM 0 HB THR A 23 -7.614 17.049 4.248 1.00 0.00 H new ATOM 0 HG1 THR A 23 -9.957 17.435 4.061 1.00 0.00 H new ATOM 0 HG21 THR A 23 -9.153 15.651 2.876 1.00 0.00 H new ATOM 0 HG22 THR A 23 -7.790 14.730 3.555 1.00 0.00 H new ATOM 0 HG23 THR A 23 -9.407 14.596 4.286 1.00 0.00 H new ATOM 419 N GLY A 24 -9.566 16.086 7.752 1.00 0.00 N ATOM 420 CA GLY A 24 -10.681 15.550 8.578 1.00 0.00 C ATOM 421 C GLY A 24 -11.847 14.885 7.801 1.00 0.00 C ATOM 422 O GLY A 24 -12.288 15.373 6.756 1.00 0.00 O ATOM 0 H GLY A 24 -9.481 17.102 7.782 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -10.271 14.818 9.274 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.088 16.366 9.176 1.00 0.00 H new ATOM 426 N LYS A 25 -12.329 13.755 8.333 1.00 0.00 N ATOM 427 CA LYS A 25 -13.454 12.958 7.749 1.00 0.00 C ATOM 428 C LYS A 25 -13.224 12.120 6.445 1.00 0.00 C ATOM 429 O LYS A 25 -13.937 11.129 6.258 1.00 0.00 O ATOM 430 CB LYS A 25 -14.840 13.666 7.838 1.00 0.00 C ATOM 431 CG LYS A 25 -15.389 13.771 9.283 1.00 0.00 C ATOM 432 CD LYS A 25 -16.851 14.261 9.358 1.00 0.00 C ATOM 433 CE LYS A 25 -17.430 14.258 10.792 1.00 0.00 C ATOM 434 NZ LYS A 25 -17.823 12.889 11.230 1.00 0.00 N ATOM 0 H LYS A 25 -11.955 13.350 9.191 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.471 12.129 8.456 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -14.755 14.668 7.416 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -15.557 13.121 7.224 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.318 12.794 9.761 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -14.757 14.452 9.854 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -16.908 15.272 8.954 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -17.471 13.628 8.723 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -16.690 14.662 11.483 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -18.298 14.916 10.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -18.832 12.881 11.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -17.654 12.215 10.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -17.257 12.614 12.058 1.00 0.00 H new ATOM 448 N GLU A 26 -12.201 12.395 5.612 1.00 0.00 N ATOM 449 CA GLU A 26 -11.610 11.351 4.708 1.00 0.00 C ATOM 450 C GLU A 26 -10.943 10.163 5.479 1.00 0.00 C ATOM 451 O GLU A 26 -11.245 9.003 5.194 1.00 0.00 O ATOM 452 CB GLU A 26 -10.613 11.936 3.667 1.00 0.00 C ATOM 453 CG GLU A 26 -11.146 13.052 2.733 1.00 0.00 C ATOM 454 CD GLU A 26 -12.314 12.706 1.829 1.00 0.00 C ATOM 455 OE1 GLU A 26 -12.471 11.543 1.402 1.00 0.00 O ATOM 456 OE2 GLU A 26 -13.175 13.585 1.631 1.00 0.00 O ATOM 0 H GLU A 26 -11.762 13.313 5.536 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.468 10.953 4.166 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.751 12.329 4.207 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.253 11.117 3.045 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.439 13.899 3.353 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.321 13.388 2.104 1.00 0.00 H new ATOM 463 N LEU A 27 -10.093 10.453 6.487 1.00 0.00 N ATOM 464 CA LEU A 27 -9.587 9.443 7.462 1.00 0.00 C ATOM 465 C LEU A 27 -10.679 8.590 8.204 1.00 0.00 C ATOM 466 O LEU A 27 -10.548 7.366 8.254 1.00 0.00 O ATOM 467 CB LEU A 27 -8.627 10.218 8.414 1.00 0.00 C ATOM 468 CG LEU A 27 -7.911 9.426 9.542 1.00 0.00 C ATOM 469 CD1 LEU A 27 -6.922 8.368 9.021 1.00 0.00 C ATOM 470 CD2 LEU A 27 -7.157 10.396 10.469 1.00 0.00 C ATOM 0 H LEU A 27 -9.733 11.393 6.654 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.064 8.652 6.924 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.860 10.690 7.800 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.198 11.020 8.882 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.696 8.897 10.083 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -6.460 7.855 9.865 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -7.455 7.644 8.404 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -6.150 8.854 8.425 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.658 9.832 11.257 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.415 10.948 9.892 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.863 11.096 10.915 1.00 0.00 H new ATOM 482 N GLU A 28 -11.754 9.219 8.725 1.00 0.00 N ATOM 483 CA GLU A 28 -12.964 8.509 9.241 1.00 0.00 C ATOM 484 C GLU A 28 -13.667 7.566 8.201 1.00 0.00 C ATOM 485 O GLU A 28 -13.821 6.375 8.481 1.00 0.00 O ATOM 486 CB GLU A 28 -13.908 9.604 9.817 1.00 0.00 C ATOM 487 CG GLU A 28 -15.128 9.132 10.645 1.00 0.00 C ATOM 488 CD GLU A 28 -16.065 10.274 10.999 1.00 0.00 C ATOM 489 OE1 GLU A 28 -16.775 10.766 10.097 1.00 0.00 O ATOM 490 OE2 GLU A 28 -16.099 10.723 12.163 1.00 0.00 O ATOM 0 H GLU A 28 -11.816 10.234 8.804 1.00 0.00 H new ATOM 0 HA GLU A 28 -12.666 7.805 10.018 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -13.312 10.266 10.444 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -14.278 10.202 8.984 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.676 8.377 10.081 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.779 8.655 11.561 1.00 0.00 H new ATOM 497 N ARG A 29 -14.048 8.067 7.007 1.00 0.00 N ATOM 498 CA ARG A 29 -14.645 7.232 5.921 1.00 0.00 C ATOM 499 C ARG A 29 -13.739 6.089 5.350 1.00 0.00 C ATOM 500 O ARG A 29 -14.220 4.960 5.200 1.00 0.00 O ATOM 501 CB ARG A 29 -15.169 8.171 4.800 1.00 0.00 C ATOM 502 CG ARG A 29 -16.430 8.984 5.188 1.00 0.00 C ATOM 503 CD ARG A 29 -17.115 9.724 4.020 1.00 0.00 C ATOM 504 NE ARG A 29 -16.575 11.092 3.800 1.00 0.00 N ATOM 505 CZ ARG A 29 -15.531 11.433 3.050 1.00 0.00 C ATOM 506 NH1 ARG A 29 -14.802 10.603 2.343 1.00 0.00 N ATOM 507 NH2 ARG A 29 -15.226 12.691 3.032 1.00 0.00 N ATOM 0 H ARG A 29 -13.955 9.053 6.761 1.00 0.00 H new ATOM 0 HA ARG A 29 -15.464 6.678 6.380 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -14.375 8.864 4.522 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -15.394 7.573 3.917 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -17.153 8.308 5.644 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -16.153 9.714 5.948 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -16.994 9.141 3.107 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -18.185 9.789 4.217 1.00 0.00 H new ATOM 0 HE ARG A 29 -17.059 11.853 4.277 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -15.021 9.607 2.341 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -14.017 10.954 1.795 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -15.776 13.357 3.574 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -14.435 13.016 2.476 1.00 0.00 H new ATOM 521 N ALA A 30 -12.445 6.351 5.076 1.00 0.00 N ATOM 522 CA ALA A 30 -11.442 5.285 4.808 1.00 0.00 C ATOM 523 C ALA A 30 -11.265 4.233 5.952 1.00 0.00 C ATOM 524 O ALA A 30 -11.396 3.041 5.673 1.00 0.00 O ATOM 525 CB ALA A 30 -10.122 5.976 4.414 1.00 0.00 C ATOM 0 H ALA A 30 -12.063 7.296 5.033 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.812 4.669 3.988 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.363 5.221 4.210 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.281 6.581 3.522 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -9.788 6.615 5.231 1.00 0.00 H new ATOM 531 N LEU A 31 -11.056 4.634 7.224 1.00 0.00 N ATOM 532 CA LEU A 31 -11.108 3.701 8.391 1.00 0.00 C ATOM 533 C LEU A 31 -12.421 2.849 8.530 1.00 0.00 C ATOM 534 O LEU A 31 -12.322 1.633 8.707 1.00 0.00 O ATOM 535 CB LEU A 31 -10.740 4.516 9.661 1.00 0.00 C ATOM 536 CG LEU A 31 -10.474 3.673 10.942 1.00 0.00 C ATOM 537 CD1 LEU A 31 -9.219 4.158 11.684 1.00 0.00 C ATOM 538 CD2 LEU A 31 -11.689 3.676 11.887 1.00 0.00 C ATOM 0 H LEU A 31 -10.848 5.600 7.479 1.00 0.00 H new ATOM 0 HA LEU A 31 -10.374 2.912 8.228 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -9.851 5.109 9.446 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -11.549 5.217 9.869 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.303 2.647 10.615 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -9.063 3.547 12.573 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -8.353 4.072 11.028 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -9.350 5.200 11.978 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -11.465 3.077 12.770 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -11.912 4.699 12.190 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -12.552 3.254 11.372 1.00 0.00 H new ATOM 550 N GLN A 32 -13.621 3.452 8.403 1.00 0.00 N ATOM 551 CA GLN A 32 -14.919 2.722 8.366 1.00 0.00 C ATOM 552 C GLN A 32 -15.070 1.655 7.227 1.00 0.00 C ATOM 553 O GLN A 32 -15.420 0.507 7.525 1.00 0.00 O ATOM 554 CB GLN A 32 -16.048 3.786 8.310 1.00 0.00 C ATOM 555 CG GLN A 32 -16.286 4.618 9.600 1.00 0.00 C ATOM 556 CD GLN A 32 -17.195 5.846 9.425 1.00 0.00 C ATOM 557 OE1 GLN A 32 -17.429 6.376 8.343 1.00 0.00 O ATOM 558 NE2 GLN A 32 -17.710 6.373 10.509 1.00 0.00 N ATOM 0 H GLN A 32 -13.724 4.464 8.322 1.00 0.00 H new ATOM 0 HA GLN A 32 -14.978 2.116 9.270 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -15.825 4.476 7.496 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -16.979 3.281 8.054 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -16.722 3.967 10.358 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -15.321 4.951 9.982 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -17.528 5.948 11.418 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -18.293 7.208 10.443 1.00 0.00 H new ATOM 567 N GLU A 33 -14.795 1.993 5.949 1.00 0.00 N ATOM 568 CA GLU A 33 -14.777 0.983 4.849 1.00 0.00 C ATOM 569 C GLU A 33 -13.584 -0.033 4.882 1.00 0.00 C ATOM 570 O GLU A 33 -13.804 -1.206 4.574 1.00 0.00 O ATOM 571 CB GLU A 33 -14.968 1.677 3.474 1.00 0.00 C ATOM 572 CG GLU A 33 -15.253 0.728 2.270 1.00 0.00 C ATOM 573 CD GLU A 33 -16.481 -0.189 2.340 1.00 0.00 C ATOM 574 OE1 GLU A 33 -17.467 0.118 3.043 1.00 0.00 O ATOM 575 OE2 GLU A 33 -16.486 -1.240 1.662 1.00 0.00 O ATOM 0 H GLU A 33 -14.584 2.944 5.647 1.00 0.00 H new ATOM 0 HA GLU A 33 -15.634 0.333 5.025 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -15.792 2.386 3.557 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -14.071 2.256 3.252 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -15.349 1.345 1.376 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -14.375 0.097 2.129 1.00 0.00 H new ATOM 582 N LEU A 34 -12.356 0.345 5.285 1.00 0.00 N ATOM 583 CA LEU A 34 -11.256 -0.629 5.577 1.00 0.00 C ATOM 584 C LEU A 34 -11.564 -1.662 6.720 1.00 0.00 C ATOM 585 O LEU A 34 -11.319 -2.857 6.529 1.00 0.00 O ATOM 586 CB LEU A 34 -9.929 0.145 5.816 1.00 0.00 C ATOM 587 CG LEU A 34 -9.333 0.899 4.591 1.00 0.00 C ATOM 588 CD1 LEU A 34 -8.265 1.904 5.048 1.00 0.00 C ATOM 589 CD2 LEU A 34 -8.744 -0.047 3.529 1.00 0.00 C ATOM 0 H LEU A 34 -12.088 1.320 5.420 1.00 0.00 H new ATOM 0 HA LEU A 34 -11.157 -1.260 4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.095 0.869 6.614 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -9.182 -0.562 6.178 1.00 0.00 H new ATOM 0 HG LEU A 34 -10.162 1.429 4.121 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.858 2.423 4.180 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -8.714 2.629 5.726 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.463 1.374 5.563 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.345 0.539 2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.944 -0.640 3.973 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -9.525 -0.711 3.160 1.00 0.00 H new ATOM 601 N GLU A 35 -12.164 -1.235 7.852 1.00 0.00 N ATOM 602 CA GLU A 35 -12.833 -2.143 8.835 1.00 0.00 C ATOM 603 C GLU A 35 -13.869 -3.159 8.223 1.00 0.00 C ATOM 604 O GLU A 35 -13.742 -4.374 8.409 1.00 0.00 O ATOM 605 CB GLU A 35 -13.470 -1.216 9.914 1.00 0.00 C ATOM 606 CG GLU A 35 -13.873 -1.918 11.228 1.00 0.00 C ATOM 607 CD GLU A 35 -14.491 -1.001 12.267 1.00 0.00 C ATOM 608 OE1 GLU A 35 -15.672 -0.627 12.122 1.00 0.00 O ATOM 609 OE2 GLU A 35 -13.841 -0.695 13.286 1.00 0.00 O ATOM 0 H GLU A 35 -12.203 -0.251 8.119 1.00 0.00 H new ATOM 0 HA GLU A 35 -12.087 -2.814 9.261 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.764 -0.419 10.148 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -14.354 -0.743 9.487 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -14.581 -2.714 10.998 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -12.990 -2.391 11.658 1.00 0.00 H new ATOM 616 N LYS A 36 -14.850 -2.653 7.447 1.00 0.00 N ATOM 617 CA LYS A 36 -15.782 -3.478 6.624 1.00 0.00 C ATOM 618 C LYS A 36 -15.093 -4.429 5.582 1.00 0.00 C ATOM 619 O LYS A 36 -15.421 -5.616 5.543 1.00 0.00 O ATOM 620 CB LYS A 36 -16.789 -2.463 6.000 1.00 0.00 C ATOM 621 CG LYS A 36 -18.066 -2.996 5.308 1.00 0.00 C ATOM 622 CD LYS A 36 -17.830 -3.691 3.942 1.00 0.00 C ATOM 623 CE LYS A 36 -18.973 -3.527 2.921 1.00 0.00 C ATOM 624 NZ LYS A 36 -18.900 -2.174 2.303 1.00 0.00 N ATOM 0 H LYS A 36 -15.026 -1.651 7.368 1.00 0.00 H new ATOM 0 HA LYS A 36 -16.293 -4.209 7.250 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -17.104 -1.784 6.792 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.243 -1.867 5.268 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -18.556 -3.702 5.978 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -18.755 -2.165 5.161 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -16.913 -3.297 3.504 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -17.668 -4.755 4.116 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -18.899 -4.294 2.150 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -19.936 -3.662 3.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -19.719 -2.033 1.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -18.906 -1.450 3.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -18.024 -2.092 1.749 1.00 0.00 H new ATOM 638 N ALA A 37 -14.155 -3.934 4.751 1.00 0.00 N ATOM 639 CA ALA A 37 -13.381 -4.758 3.786 1.00 0.00 C ATOM 640 C ALA A 37 -12.486 -5.889 4.385 1.00 0.00 C ATOM 641 O ALA A 37 -12.521 -7.007 3.863 1.00 0.00 O ATOM 642 CB ALA A 37 -12.578 -3.777 2.909 1.00 0.00 C ATOM 0 H ALA A 37 -13.907 -2.945 4.726 1.00 0.00 H new ATOM 0 HA ALA A 37 -14.097 -5.341 3.207 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -11.991 -4.337 2.181 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -13.264 -3.111 2.386 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -11.910 -3.189 3.539 1.00 0.00 H new ATOM 648 N LEU A 38 -11.740 -5.650 5.485 1.00 0.00 N ATOM 649 CA LEU A 38 -11.065 -6.739 6.255 1.00 0.00 C ATOM 650 C LEU A 38 -12.032 -7.802 6.887 1.00 0.00 C ATOM 651 O LEU A 38 -11.797 -9.002 6.710 1.00 0.00 O ATOM 652 CB LEU A 38 -10.082 -6.130 7.306 1.00 0.00 C ATOM 653 CG LEU A 38 -8.624 -5.816 6.869 1.00 0.00 C ATOM 654 CD1 LEU A 38 -7.874 -7.070 6.384 1.00 0.00 C ATOM 655 CD2 LEU A 38 -8.505 -4.690 5.829 1.00 0.00 C ATOM 0 H LEU A 38 -11.585 -4.717 5.866 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.494 -7.313 5.526 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.524 -5.204 7.674 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -10.033 -6.817 8.150 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.146 -5.452 7.778 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.860 -6.797 6.090 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.833 -7.804 7.189 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.397 -7.498 5.529 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -7.455 -4.535 5.579 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -9.055 -4.966 4.929 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.920 -3.770 6.240 1.00 0.00 H new ATOM 667 N ALA A 39 -13.124 -7.383 7.563 1.00 0.00 N ATOM 668 CA ALA A 39 -14.237 -8.295 7.959 1.00 0.00 C ATOM 669 C ALA A 39 -14.932 -9.108 6.807 1.00 0.00 C ATOM 670 O ALA A 39 -15.154 -10.311 6.958 1.00 0.00 O ATOM 671 CB ALA A 39 -15.241 -7.426 8.741 1.00 0.00 C ATOM 0 H ALA A 39 -13.265 -6.415 7.850 1.00 0.00 H new ATOM 0 HA ALA A 39 -13.812 -9.099 8.559 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -16.083 -8.040 9.060 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -14.750 -7.001 9.617 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -15.601 -6.621 8.101 1.00 0.00 H new ATOM 677 N ARG A 40 -15.228 -8.474 5.655 1.00 0.00 N ATOM 678 CA ARG A 40 -15.665 -9.170 4.409 1.00 0.00 C ATOM 679 C ARG A 40 -14.645 -10.197 3.804 1.00 0.00 C ATOM 680 O ARG A 40 -15.038 -11.304 3.428 1.00 0.00 O ATOM 681 CB ARG A 40 -16.043 -8.051 3.393 1.00 0.00 C ATOM 682 CG ARG A 40 -16.768 -8.525 2.108 1.00 0.00 C ATOM 683 CD ARG A 40 -16.897 -7.406 1.058 1.00 0.00 C ATOM 684 NE ARG A 40 -17.684 -7.903 -0.105 1.00 0.00 N ATOM 685 CZ ARG A 40 -17.952 -7.207 -1.212 1.00 0.00 C ATOM 686 NH1 ARG A 40 -17.509 -5.993 -1.432 1.00 0.00 N ATOM 687 NH2 ARG A 40 -18.691 -7.763 -2.128 1.00 0.00 N ATOM 0 H ARG A 40 -15.173 -7.461 5.553 1.00 0.00 H new ATOM 0 HA ARG A 40 -16.512 -9.811 4.654 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -16.679 -7.326 3.900 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -15.132 -7.528 3.102 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -16.223 -9.364 1.675 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -17.761 -8.891 2.369 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -17.386 -6.536 1.496 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -15.908 -7.084 0.731 1.00 0.00 H new ATOM 0 HE ARG A 40 -18.048 -8.854 -0.051 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -16.925 -5.529 -0.736 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -17.748 -5.512 -2.299 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -19.050 -8.708 -1.990 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.911 -7.254 -2.984 1.00 0.00 H new ATOM 701 N ALA A 41 -13.363 -9.817 3.675 1.00 0.00 N ATOM 702 CA ALA A 41 -12.306 -10.692 3.113 1.00 0.00 C ATOM 703 C ALA A 41 -11.817 -11.872 4.013 1.00 0.00 C ATOM 704 O ALA A 41 -11.582 -12.961 3.476 1.00 0.00 O ATOM 705 CB ALA A 41 -11.152 -9.761 2.692 1.00 0.00 C ATOM 0 H ALA A 41 -13.025 -8.897 3.955 1.00 0.00 H new ATOM 0 HA ALA A 41 -12.737 -11.234 2.271 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.342 -10.355 2.269 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.510 -9.052 1.946 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -10.787 -9.217 3.563 1.00 0.00 H new ATOM 711 N GLY A 42 -11.587 -11.671 5.327 1.00 0.00 N ATOM 712 CA GLY A 42 -11.088 -12.746 6.230 1.00 0.00 C ATOM 713 C GLY A 42 -9.594 -13.105 6.068 1.00 0.00 C ATOM 714 O GLY A 42 -9.267 -14.160 5.520 1.00 0.00 O ATOM 0 H GLY A 42 -11.737 -10.776 5.793 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.261 -12.440 7.262 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -11.681 -13.645 6.060 1.00 0.00 H new ATOM 718 N ALA A 43 -8.698 -12.215 6.517 1.00 0.00 N ATOM 719 CA ALA A 43 -7.229 -12.385 6.357 1.00 0.00 C ATOM 720 C ALA A 43 -6.491 -12.792 7.671 1.00 0.00 C ATOM 721 O ALA A 43 -6.847 -12.354 8.770 1.00 0.00 O ATOM 722 CB ALA A 43 -6.716 -11.054 5.792 1.00 0.00 C ATOM 0 H ALA A 43 -8.960 -11.356 7.001 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.020 -13.218 5.686 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.637 -11.111 5.650 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -7.198 -10.855 4.835 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.948 -10.249 6.489 1.00 0.00 H new ATOM 728 N ARG A 44 -5.457 -13.647 7.549 1.00 0.00 N ATOM 729 CA ARG A 44 -4.806 -14.299 8.726 1.00 0.00 C ATOM 730 C ARG A 44 -3.509 -13.632 9.301 1.00 0.00 C ATOM 731 O ARG A 44 -3.202 -13.913 10.461 1.00 0.00 O ATOM 732 CB ARG A 44 -4.647 -15.814 8.408 1.00 0.00 C ATOM 733 CG ARG A 44 -4.590 -16.724 9.665 1.00 0.00 C ATOM 734 CD ARG A 44 -4.725 -18.234 9.392 1.00 0.00 C ATOM 735 NE ARG A 44 -3.458 -18.775 8.841 1.00 0.00 N ATOM 736 CZ ARG A 44 -3.221 -20.041 8.527 1.00 0.00 C ATOM 737 NH1 ARG A 44 -4.106 -21.000 8.628 1.00 0.00 N ATOM 738 NH2 ARG A 44 -2.032 -20.325 8.092 1.00 0.00 N ATOM 0 H ARG A 44 -5.047 -13.909 6.652 1.00 0.00 H new ATOM 0 HA ARG A 44 -5.475 -14.147 9.573 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.480 -16.132 7.780 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.736 -15.958 7.827 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -3.645 -16.548 10.178 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.385 -16.423 10.348 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.980 -18.756 10.315 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.540 -18.412 8.690 1.00 0.00 H new ATOM 0 HE ARG A 44 -2.699 -18.111 8.690 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.046 -20.793 8.966 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.856 -21.954 8.369 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -1.331 -19.589 8.005 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.798 -21.284 7.837 1.00 0.00 H new ATOM 752 N ASN A 45 -2.770 -12.767 8.573 1.00 0.00 N ATOM 753 CA ASN A 45 -1.791 -11.818 9.189 1.00 0.00 C ATOM 754 C ASN A 45 -1.921 -10.406 8.523 1.00 0.00 C ATOM 755 O ASN A 45 -1.605 -10.215 7.343 1.00 0.00 O ATOM 756 CB ASN A 45 -0.356 -12.405 9.277 1.00 0.00 C ATOM 757 CG ASN A 45 0.470 -12.633 8.017 1.00 0.00 C ATOM 758 OD1 ASN A 45 1.314 -11.825 7.643 1.00 0.00 O ATOM 759 ND2 ASN A 45 0.308 -13.759 7.365 1.00 0.00 N ATOM 0 H ASN A 45 -2.826 -12.699 7.557 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.042 -11.669 10.239 1.00 0.00 H new ATOM 0 HB2 ASN A 45 0.222 -11.745 9.924 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -0.433 -13.365 9.788 1.00 0.00 H new ATOM 0 HD21 ASN A 45 0.883 -13.962 6.548 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -0.393 -14.432 7.675 1.00 0.00 H new ATOM 766 N VAL A 46 -2.459 -9.427 9.271 1.00 0.00 N ATOM 767 CA VAL A 46 -2.944 -8.128 8.706 1.00 0.00 C ATOM 768 C VAL A 46 -2.010 -6.980 9.201 1.00 0.00 C ATOM 769 O VAL A 46 -2.028 -6.625 10.381 1.00 0.00 O ATOM 770 CB VAL A 46 -4.451 -7.914 9.089 1.00 0.00 C ATOM 771 CG1 VAL A 46 -5.015 -6.528 8.692 1.00 0.00 C ATOM 772 CG2 VAL A 46 -5.398 -8.971 8.481 1.00 0.00 C ATOM 0 H VAL A 46 -2.575 -9.500 10.282 1.00 0.00 H new ATOM 0 HA VAL A 46 -2.900 -8.133 7.617 1.00 0.00 H new ATOM 0 HB VAL A 46 -4.430 -8.004 10.175 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.061 -6.461 8.992 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -4.444 -5.746 9.192 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -4.938 -6.400 7.612 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.423 -8.761 8.788 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.330 -8.938 7.394 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.110 -9.962 8.832 1.00 0.00 H new ATOM 782 N GLN A 47 -1.232 -6.379 8.285 1.00 0.00 N ATOM 783 CA GLN A 47 -0.220 -5.339 8.626 1.00 0.00 C ATOM 784 C GLN A 47 -0.770 -3.910 8.305 1.00 0.00 C ATOM 785 O GLN A 47 -0.724 -3.444 7.160 1.00 0.00 O ATOM 786 CB GLN A 47 1.069 -5.659 7.819 1.00 0.00 C ATOM 787 CG GLN A 47 1.839 -6.958 8.176 1.00 0.00 C ATOM 788 CD GLN A 47 2.863 -7.405 7.116 1.00 0.00 C ATOM 789 OE1 GLN A 47 3.584 -6.620 6.501 1.00 0.00 O ATOM 790 NE2 GLN A 47 2.972 -8.690 6.867 1.00 0.00 N ATOM 0 H GLN A 47 -1.279 -6.592 7.289 1.00 0.00 H new ATOM 0 HA GLN A 47 0.005 -5.350 9.692 1.00 0.00 H new ATOM 0 HB2 GLN A 47 0.801 -5.707 6.764 1.00 0.00 H new ATOM 0 HB3 GLN A 47 1.755 -4.820 7.935 1.00 0.00 H new ATOM 0 HG2 GLN A 47 2.357 -6.810 9.123 1.00 0.00 H new ATOM 0 HG3 GLN A 47 1.119 -7.762 8.329 1.00 0.00 H new ATOM 0 HE21 GLN A 47 2.384 -9.358 7.366 1.00 0.00 H new ATOM 0 HE22 GLN A 47 3.645 -9.020 6.175 1.00 0.00 H new ATOM 799 N ILE A 48 -1.283 -3.201 9.326 1.00 0.00 N ATOM 800 CA ILE A 48 -1.856 -1.828 9.157 1.00 0.00 C ATOM 801 C ILE A 48 -0.707 -0.790 9.362 1.00 0.00 C ATOM 802 O ILE A 48 -0.260 -0.596 10.495 1.00 0.00 O ATOM 803 CB ILE A 48 -3.070 -1.595 10.133 1.00 0.00 C ATOM 804 CG1 ILE A 48 -4.266 -2.562 9.872 1.00 0.00 C ATOM 805 CG2 ILE A 48 -3.579 -0.127 10.094 1.00 0.00 C ATOM 806 CD1 ILE A 48 -5.268 -2.699 11.031 1.00 0.00 C ATOM 0 H ILE A 48 -1.318 -3.546 10.285 1.00 0.00 H new ATOM 0 HA ILE A 48 -2.260 -1.706 8.152 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.675 -1.811 11.126 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.803 -2.218 8.988 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.869 -3.550 9.639 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.416 -0.014 10.783 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.773 0.545 10.389 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.905 0.118 9.083 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.059 -3.393 10.748 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -4.753 -3.077 11.914 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.702 -1.724 11.253 1.00 0.00 H new ATOM 818 N THR A 49 -0.274 -0.097 8.290 1.00 0.00 N ATOM 819 CA THR A 49 0.734 1.001 8.394 1.00 0.00 C ATOM 820 C THR A 49 0.010 2.375 8.418 1.00 0.00 C ATOM 821 O THR A 49 -0.751 2.682 7.496 1.00 0.00 O ATOM 822 CB THR A 49 1.773 0.990 7.222 1.00 0.00 C ATOM 823 OG1 THR A 49 2.079 -0.325 6.767 1.00 0.00 O ATOM 824 CG2 THR A 49 3.095 1.699 7.562 1.00 0.00 C ATOM 0 H THR A 49 -0.600 -0.271 7.339 1.00 0.00 H new ATOM 0 HA THR A 49 1.285 0.836 9.320 1.00 0.00 H new ATOM 0 HB THR A 49 1.272 1.545 6.429 1.00 0.00 H new ATOM 0 HG1 THR A 49 1.416 -0.603 6.101 1.00 0.00 H new ATOM 0 HG21 THR A 49 3.765 1.651 6.703 1.00 0.00 H new ATOM 0 HG22 THR A 49 2.896 2.742 7.809 1.00 0.00 H new ATOM 0 HG23 THR A 49 3.563 1.207 8.415 1.00 0.00 H new ATOM 832 N ILE A 50 0.290 3.221 9.419 1.00 0.00 N ATOM 833 CA ILE A 50 -0.189 4.634 9.435 1.00 0.00 C ATOM 834 C ILE A 50 1.071 5.550 9.598 1.00 0.00 C ATOM 835 O ILE A 50 1.668 5.606 10.679 1.00 0.00 O ATOM 836 CB ILE A 50 -1.270 4.873 10.554 1.00 0.00 C ATOM 837 CG1 ILE A 50 -2.459 3.866 10.635 1.00 0.00 C ATOM 838 CG2 ILE A 50 -1.820 6.317 10.545 1.00 0.00 C ATOM 839 CD1 ILE A 50 -3.449 3.786 9.465 1.00 0.00 C ATOM 0 H ILE A 50 0.845 2.963 10.235 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.698 4.878 8.502 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.685 4.687 11.455 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.038 2.871 10.778 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.030 4.103 11.533 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.562 6.429 11.336 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.003 7.019 10.712 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.284 6.524 9.581 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.211 3.038 9.684 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.924 4.757 9.323 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.916 3.506 8.556 1.00 0.00 H new ATOM 851 N SER A 51 1.444 6.323 8.560 1.00 0.00 N ATOM 852 CA SER A 51 2.372 7.479 8.717 1.00 0.00 C ATOM 853 C SER A 51 1.658 8.676 9.416 1.00 0.00 C ATOM 854 O SER A 51 0.626 9.161 8.944 1.00 0.00 O ATOM 855 CB SER A 51 2.913 7.873 7.321 1.00 0.00 C ATOM 856 OG SER A 51 3.619 9.118 7.340 1.00 0.00 O ATOM 0 H SER A 51 1.123 6.175 7.603 1.00 0.00 H new ATOM 0 HA SER A 51 3.208 7.197 9.356 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.576 7.088 6.957 1.00 0.00 H new ATOM 0 HB3 SER A 51 2.082 7.940 6.618 1.00 0.00 H new ATOM 0 HG SER A 51 3.056 9.819 6.950 1.00 0.00 H new ATOM 862 N ALA A 52 2.219 9.150 10.534 1.00 0.00 N ATOM 863 CA ALA A 52 1.691 10.327 11.260 1.00 0.00 C ATOM 864 C ALA A 52 2.400 11.662 10.876 1.00 0.00 C ATOM 865 O ALA A 52 3.616 11.713 10.663 1.00 0.00 O ATOM 866 CB ALA A 52 1.867 10.003 12.752 1.00 0.00 C ATOM 0 H ALA A 52 3.046 8.737 10.965 1.00 0.00 H new ATOM 0 HA ALA A 52 0.647 10.496 10.996 1.00 0.00 H new ATOM 0 HB1 ALA A 52 1.496 10.834 13.351 1.00 0.00 H new ATOM 0 HB2 ALA A 52 1.307 9.101 12.997 1.00 0.00 H new ATOM 0 HB3 ALA A 52 2.924 9.844 12.968 1.00 0.00 H new ATOM 872 N GLU A 53 1.640 12.771 10.859 1.00 0.00 N ATOM 873 CA GLU A 53 2.224 14.137 10.672 1.00 0.00 C ATOM 874 C GLU A 53 2.935 14.766 11.929 1.00 0.00 C ATOM 875 O GLU A 53 3.771 15.656 11.764 1.00 0.00 O ATOM 876 CB GLU A 53 1.158 15.053 9.991 1.00 0.00 C ATOM 877 CG GLU A 53 0.864 14.641 8.518 1.00 0.00 C ATOM 878 CD GLU A 53 0.109 15.574 7.573 1.00 0.00 C ATOM 879 OE1 GLU A 53 0.067 16.797 7.794 1.00 0.00 O ATOM 880 OE2 GLU A 53 -0.389 15.077 6.534 1.00 0.00 O ATOM 0 H GLU A 53 0.626 12.763 10.970 1.00 0.00 H new ATOM 0 HA GLU A 53 3.078 14.036 10.003 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.233 15.016 10.566 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.505 16.086 10.013 1.00 0.00 H new ATOM 0 HG2 GLU A 53 1.824 14.423 8.050 1.00 0.00 H new ATOM 0 HG3 GLU A 53 0.307 13.705 8.554 1.00 0.00 H new ATOM 887 N ASN A 54 2.659 14.300 13.161 1.00 0.00 N ATOM 888 CA ASN A 54 3.476 14.585 14.382 1.00 0.00 C ATOM 889 C ASN A 54 3.587 13.300 15.286 1.00 0.00 C ATOM 890 O ASN A 54 2.855 12.317 15.122 1.00 0.00 O ATOM 891 CB ASN A 54 2.847 15.801 15.143 1.00 0.00 C ATOM 892 CG ASN A 54 3.457 17.180 14.861 1.00 0.00 C ATOM 893 OD1 ASN A 54 4.093 17.791 15.710 1.00 0.00 O ATOM 894 ND2 ASN A 54 3.287 17.737 13.688 1.00 0.00 N ATOM 0 H ASN A 54 1.853 13.705 13.352 1.00 0.00 H new ATOM 0 HA ASN A 54 4.494 14.852 14.099 1.00 0.00 H new ATOM 0 HB2 ASN A 54 1.785 15.842 14.900 1.00 0.00 H new ATOM 0 HB3 ASN A 54 2.922 15.608 16.213 1.00 0.00 H new ATOM 0 HD21 ASN A 54 3.681 18.659 13.499 1.00 0.00 H new ATOM 0 HD22 ASN A 54 2.761 17.249 12.963 1.00 0.00 H new ATOM 901 N ASP A 55 4.488 13.316 16.288 1.00 0.00 N ATOM 902 CA ASP A 55 4.529 12.281 17.371 1.00 0.00 C ATOM 903 C ASP A 55 3.263 12.201 18.310 1.00 0.00 C ATOM 904 O ASP A 55 2.776 11.104 18.598 1.00 0.00 O ATOM 905 CB ASP A 55 5.874 12.419 18.140 1.00 0.00 C ATOM 906 CG ASP A 55 6.092 13.662 19.015 1.00 0.00 C ATOM 907 OD1 ASP A 55 5.577 14.749 18.670 1.00 0.00 O ATOM 908 OD2 ASP A 55 6.786 13.547 20.046 1.00 0.00 O ATOM 0 H ASP A 55 5.206 14.034 16.381 1.00 0.00 H new ATOM 0 HA ASP A 55 4.482 11.308 16.881 1.00 0.00 H new ATOM 0 HB2 ASP A 55 5.983 11.541 18.777 1.00 0.00 H new ATOM 0 HB3 ASP A 55 6.680 12.383 17.407 1.00 0.00 H new ATOM 913 N GLU A 56 2.680 13.349 18.713 1.00 0.00 N ATOM 914 CA GLU A 56 1.312 13.411 19.321 1.00 0.00 C ATOM 915 C GLU A 56 0.148 12.836 18.432 1.00 0.00 C ATOM 916 O GLU A 56 -0.706 12.101 18.939 1.00 0.00 O ATOM 917 CB GLU A 56 0.994 14.865 19.765 1.00 0.00 C ATOM 918 CG GLU A 56 1.885 15.442 20.895 1.00 0.00 C ATOM 919 CD GLU A 56 1.432 16.804 21.398 1.00 0.00 C ATOM 920 OE1 GLU A 56 1.797 17.827 20.783 1.00 0.00 O ATOM 921 OE2 GLU A 56 0.714 16.852 22.419 1.00 0.00 O ATOM 0 H GLU A 56 3.132 14.260 18.632 1.00 0.00 H new ATOM 0 HA GLU A 56 1.352 12.745 20.183 1.00 0.00 H new ATOM 0 HB2 GLU A 56 1.079 15.516 18.895 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.045 14.904 20.093 1.00 0.00 H new ATOM 0 HG2 GLU A 56 1.896 14.742 21.730 1.00 0.00 H new ATOM 0 HG3 GLU A 56 2.910 15.521 20.532 1.00 0.00 H new ATOM 928 N GLN A 57 0.149 13.103 17.106 1.00 0.00 N ATOM 929 CA GLN A 57 -0.663 12.325 16.121 1.00 0.00 C ATOM 930 C GLN A 57 -0.383 10.785 16.117 1.00 0.00 C ATOM 931 O GLN A 57 -1.344 10.022 16.174 1.00 0.00 O ATOM 932 CB GLN A 57 -0.500 12.911 14.689 1.00 0.00 C ATOM 933 CG GLN A 57 -1.035 14.342 14.432 1.00 0.00 C ATOM 934 CD GLN A 57 -2.557 14.434 14.324 1.00 0.00 C ATOM 935 OE1 GLN A 57 -3.164 14.019 13.343 1.00 0.00 O ATOM 936 NE2 GLN A 57 -3.227 14.976 15.308 1.00 0.00 N ATOM 0 H GLN A 57 0.701 13.851 16.686 1.00 0.00 H new ATOM 0 HA GLN A 57 -1.696 12.433 16.451 1.00 0.00 H new ATOM 0 HB2 GLN A 57 0.561 12.900 14.441 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -0.997 12.237 13.992 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.700 14.993 15.239 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -0.593 14.723 13.511 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -2.734 15.325 16.130 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -4.243 15.050 15.254 1.00 0.00 H new ATOM 945 N ALA A 58 0.885 10.317 16.098 1.00 0.00 N ATOM 946 CA ALA A 58 1.228 8.880 16.304 1.00 0.00 C ATOM 947 C ALA A 58 0.673 8.192 17.598 1.00 0.00 C ATOM 948 O ALA A 58 0.208 7.055 17.510 1.00 0.00 O ATOM 949 CB ALA A 58 2.758 8.739 16.193 1.00 0.00 C ATOM 0 H ALA A 58 1.697 10.914 15.941 1.00 0.00 H new ATOM 0 HA ALA A 58 0.707 8.329 15.521 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.039 7.696 16.340 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.083 9.067 15.206 1.00 0.00 H new ATOM 0 HB3 ALA A 58 3.236 9.354 16.955 1.00 0.00 H new ATOM 955 N LYS A 59 0.650 8.875 18.761 1.00 0.00 N ATOM 956 CA LYS A 59 -0.121 8.427 19.962 1.00 0.00 C ATOM 957 C LYS A 59 -1.664 8.236 19.732 1.00 0.00 C ATOM 958 O LYS A 59 -2.188 7.152 20.009 1.00 0.00 O ATOM 959 CB LYS A 59 0.239 9.401 21.124 1.00 0.00 C ATOM 960 CG LYS A 59 -0.218 9.005 22.554 1.00 0.00 C ATOM 961 CD LYS A 59 -1.685 9.363 22.922 1.00 0.00 C ATOM 962 CE LYS A 59 -2.546 8.138 23.280 1.00 0.00 C ATOM 963 NZ LYS A 59 -3.941 8.563 23.563 1.00 0.00 N ATOM 0 H LYS A 59 1.158 9.748 18.904 1.00 0.00 H new ATOM 0 HA LYS A 59 0.177 7.411 20.220 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.322 9.523 21.138 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.189 10.376 20.891 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -0.087 7.929 22.672 1.00 0.00 H new ATOM 0 HG3 LYS A 59 0.444 9.487 23.273 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -1.681 10.053 23.766 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -2.144 9.887 22.083 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -2.535 7.422 22.458 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -2.128 7.631 24.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.592 7.779 23.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.027 8.828 24.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.182 9.380 22.967 1.00 0.00 H new ATOM 977 N GLU A 60 -2.381 9.253 19.221 1.00 0.00 N ATOM 978 CA GLU A 60 -3.833 9.135 18.873 1.00 0.00 C ATOM 979 C GLU A 60 -4.165 8.155 17.694 1.00 0.00 C ATOM 980 O GLU A 60 -5.116 7.374 17.790 1.00 0.00 O ATOM 981 CB GLU A 60 -4.419 10.555 18.625 1.00 0.00 C ATOM 982 CG GLU A 60 -4.459 11.509 19.850 1.00 0.00 C ATOM 983 CD GLU A 60 -5.347 11.048 20.998 1.00 0.00 C ATOM 984 OE1 GLU A 60 -4.868 10.275 21.853 1.00 0.00 O ATOM 985 OE2 GLU A 60 -6.524 11.457 21.050 1.00 0.00 O ATOM 0 H GLU A 60 -1.988 10.175 19.034 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.316 8.671 19.733 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -3.835 11.033 17.839 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.435 10.444 18.245 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.444 11.637 20.225 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -4.801 12.489 19.517 1.00 0.00 H new ATOM 992 N LEU A 61 -3.368 8.155 16.610 1.00 0.00 N ATOM 993 CA LEU A 61 -3.429 7.128 15.530 1.00 0.00 C ATOM 994 C LEU A 61 -3.124 5.657 15.983 1.00 0.00 C ATOM 995 O LEU A 61 -3.857 4.753 15.576 1.00 0.00 O ATOM 996 CB LEU A 61 -2.544 7.598 14.338 1.00 0.00 C ATOM 997 CG LEU A 61 -3.000 8.895 13.602 1.00 0.00 C ATOM 998 CD1 LEU A 61 -1.860 9.493 12.761 1.00 0.00 C ATOM 999 CD2 LEU A 61 -4.245 8.686 12.720 1.00 0.00 C ATOM 0 H LEU A 61 -2.656 8.868 16.449 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.469 7.060 15.210 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.530 7.753 14.706 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.498 6.790 13.608 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.274 9.598 14.389 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.211 10.396 12.261 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -1.020 9.741 13.410 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.539 8.767 12.014 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.510 9.626 12.236 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.031 7.935 11.960 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.077 8.349 13.339 1.00 0.00 H new ATOM 1011 N LEU A 62 -2.134 5.405 16.869 1.00 0.00 N ATOM 1012 CA LEU A 62 -2.012 4.124 17.632 1.00 0.00 C ATOM 1013 C LEU A 62 -3.302 3.649 18.381 1.00 0.00 C ATOM 1014 O LEU A 62 -3.704 2.501 18.179 1.00 0.00 O ATOM 1015 CB LEU A 62 -0.759 4.254 18.550 1.00 0.00 C ATOM 1016 CG LEU A 62 -0.402 3.074 19.496 1.00 0.00 C ATOM 1017 CD1 LEU A 62 -0.014 1.796 18.739 1.00 0.00 C ATOM 1018 CD2 LEU A 62 0.751 3.474 20.433 1.00 0.00 C ATOM 0 H LEU A 62 -1.395 6.076 17.081 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.882 3.310 16.919 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.103 4.436 17.909 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.891 5.143 19.166 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.302 2.856 20.071 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.224 1.008 19.453 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.847 1.478 18.112 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.856 1.994 18.113 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.992 2.639 21.091 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.628 3.734 19.840 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.451 4.333 21.033 1.00 0.00 H new ATOM 1030 N GLU A 63 -3.970 4.505 19.183 1.00 0.00 N ATOM 1031 CA GLU A 63 -5.336 4.203 19.708 1.00 0.00 C ATOM 1032 C GLU A 63 -6.457 4.032 18.627 1.00 0.00 C ATOM 1033 O GLU A 63 -7.215 3.069 18.729 1.00 0.00 O ATOM 1034 CB GLU A 63 -5.751 5.178 20.842 1.00 0.00 C ATOM 1035 CG GLU A 63 -5.116 4.857 22.221 1.00 0.00 C ATOM 1036 CD GLU A 63 -5.880 5.428 23.401 1.00 0.00 C ATOM 1037 OE1 GLU A 63 -6.863 4.790 23.843 1.00 0.00 O ATOM 1038 OE2 GLU A 63 -5.489 6.500 23.907 1.00 0.00 O ATOM 0 H GLU A 63 -3.597 5.405 19.484 1.00 0.00 H new ATOM 0 HA GLU A 63 -5.241 3.206 20.138 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -5.473 6.192 20.554 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -6.836 5.161 20.942 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.048 3.775 22.335 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.097 5.244 22.239 1.00 0.00 H new ATOM 1045 N LEU A 64 -6.561 4.866 17.575 1.00 0.00 N ATOM 1046 CA LEU A 64 -7.483 4.598 16.422 1.00 0.00 C ATOM 1047 C LEU A 64 -7.303 3.212 15.700 1.00 0.00 C ATOM 1048 O LEU A 64 -8.310 2.579 15.368 1.00 0.00 O ATOM 1049 CB LEU A 64 -7.446 5.789 15.423 1.00 0.00 C ATOM 1050 CG LEU A 64 -8.053 7.131 15.920 1.00 0.00 C ATOM 1051 CD1 LEU A 64 -7.607 8.306 15.036 1.00 0.00 C ATOM 1052 CD2 LEU A 64 -9.592 7.093 15.976 1.00 0.00 C ATOM 0 H LEU A 64 -6.027 5.730 17.487 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.477 4.514 16.862 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.408 5.967 15.143 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -7.974 5.491 14.517 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.678 7.276 16.933 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -8.048 9.230 15.409 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -6.520 8.387 15.060 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -7.936 8.135 14.011 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -9.967 8.054 16.329 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -9.987 6.893 14.980 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.912 6.306 16.658 1.00 0.00 H new ATOM 1064 N ILE A 65 -6.065 2.698 15.526 1.00 0.00 N ATOM 1065 CA ILE A 65 -5.828 1.267 15.149 1.00 0.00 C ATOM 1066 C ILE A 65 -6.165 0.291 16.337 1.00 0.00 C ATOM 1067 O ILE A 65 -7.015 -0.584 16.164 1.00 0.00 O ATOM 1068 CB ILE A 65 -4.398 0.969 14.562 1.00 0.00 C ATOM 1069 CG1 ILE A 65 -3.791 2.017 13.583 1.00 0.00 C ATOM 1070 CG2 ILE A 65 -4.385 -0.414 13.858 1.00 0.00 C ATOM 1071 CD1 ILE A 65 -2.253 1.959 13.530 1.00 0.00 C ATOM 0 H ILE A 65 -5.210 3.243 15.638 1.00 0.00 H new ATOM 0 HA ILE A 65 -6.522 1.079 14.329 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.762 1.005 15.446 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -4.192 1.849 12.583 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.103 3.016 13.888 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -3.391 -0.608 13.456 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -4.644 -1.191 14.577 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.111 -0.415 13.045 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -1.884 2.711 12.832 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.847 2.155 14.522 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.937 0.970 13.198 1.00 0.00 H new ATOM 1083 N ALA A 66 -5.525 0.404 17.521 1.00 0.00 N ATOM 1084 CA ALA A 66 -5.779 -0.500 18.681 1.00 0.00 C ATOM 1085 C ALA A 66 -7.261 -0.624 19.181 1.00 0.00 C ATOM 1086 O ALA A 66 -7.713 -1.739 19.452 1.00 0.00 O ATOM 1087 CB ALA A 66 -4.819 -0.081 19.811 1.00 0.00 C ATOM 0 H ALA A 66 -4.820 1.118 17.707 1.00 0.00 H new ATOM 0 HA ALA A 66 -5.587 -1.515 18.332 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -4.976 -0.722 20.678 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -3.789 -0.180 19.469 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -5.012 0.956 20.086 1.00 0.00 H new ATOM 1093 N ARG A 67 -8.030 0.480 19.249 1.00 0.00 N ATOM 1094 CA ARG A 67 -9.502 0.445 19.481 1.00 0.00 C ATOM 1095 C ARG A 67 -10.351 -0.165 18.313 1.00 0.00 C ATOM 1096 O ARG A 67 -11.304 -0.878 18.618 1.00 0.00 O ATOM 1097 CB ARG A 67 -10.032 1.844 19.915 1.00 0.00 C ATOM 1098 CG ARG A 67 -9.361 2.543 21.130 1.00 0.00 C ATOM 1099 CD ARG A 67 -9.384 1.735 22.438 1.00 0.00 C ATOM 1100 NE ARG A 67 -8.577 2.457 23.456 1.00 0.00 N ATOM 1101 CZ ARG A 67 -8.314 2.017 24.681 1.00 0.00 C ATOM 1102 NH1 ARG A 67 -8.728 0.867 25.158 1.00 0.00 N ATOM 1103 NH2 ARG A 67 -7.593 2.785 25.440 1.00 0.00 N ATOM 0 H ARG A 67 -7.657 1.424 19.146 1.00 0.00 H new ATOM 0 HA ARG A 67 -9.642 -0.258 20.302 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.946 2.512 19.058 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.095 1.743 20.135 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -8.325 2.765 20.876 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -9.859 3.498 21.301 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -10.409 1.610 22.787 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -8.979 0.737 22.273 1.00 0.00 H new ATOM 0 HE ARG A 67 -8.194 3.365 23.192 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -9.291 0.246 24.576 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -8.487 0.594 26.111 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -7.257 3.681 25.087 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -7.363 2.493 26.390 1.00 0.00 H new ATOM 1117 N LEU A 68 -10.011 0.023 17.017 1.00 0.00 N ATOM 1118 CA LEU A 68 -10.513 -0.851 15.903 1.00 0.00 C ATOM 1119 C LEU A 68 -10.261 -2.388 16.101 1.00 0.00 C ATOM 1120 O LEU A 68 -11.193 -3.193 16.021 1.00 0.00 O ATOM 1121 CB LEU A 68 -9.928 -0.307 14.572 1.00 0.00 C ATOM 1122 CG LEU A 68 -10.449 -1.004 13.283 1.00 0.00 C ATOM 1123 CD1 LEU A 68 -10.682 0.030 12.185 1.00 0.00 C ATOM 1124 CD2 LEU A 68 -9.499 -2.099 12.759 1.00 0.00 C ATOM 0 H LEU A 68 -9.391 0.770 16.705 1.00 0.00 H new ATOM 0 HA LEU A 68 -11.601 -0.793 15.890 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -10.151 0.758 14.505 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -8.843 -0.404 14.605 1.00 0.00 H new ATOM 0 HG LEU A 68 -11.386 -1.491 13.553 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -11.047 -0.469 11.287 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -11.421 0.758 12.521 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.745 0.541 11.961 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -9.920 -2.546 11.859 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -8.530 -1.659 12.526 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -9.374 -2.868 13.521 1.00 0.00 H new ATOM 1136 N LEU A 69 -9.005 -2.773 16.377 1.00 0.00 N ATOM 1137 CA LEU A 69 -8.602 -4.175 16.677 1.00 0.00 C ATOM 1138 C LEU A 69 -9.297 -4.819 17.928 1.00 0.00 C ATOM 1139 O LEU A 69 -9.783 -5.949 17.848 1.00 0.00 O ATOM 1140 CB LEU A 69 -7.053 -4.198 16.786 1.00 0.00 C ATOM 1141 CG LEU A 69 -6.252 -3.743 15.533 1.00 0.00 C ATOM 1142 CD1 LEU A 69 -4.760 -3.645 15.879 1.00 0.00 C ATOM 1143 CD2 LEU A 69 -6.535 -4.621 14.307 1.00 0.00 C ATOM 0 H LEU A 69 -8.223 -2.118 16.401 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.950 -4.808 15.861 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.763 -3.563 17.623 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.746 -5.214 17.035 1.00 0.00 H new ATOM 0 HG LEU A 69 -6.591 -2.748 15.245 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.202 -3.326 14.998 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.619 -2.919 16.680 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.397 -4.620 16.205 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.951 -4.261 13.459 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.259 -5.652 14.526 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.596 -4.574 14.063 1.00 0.00 H new ATOM 1155 N GLN A 70 -9.387 -4.080 19.051 1.00 0.00 N ATOM 1156 CA GLN A 70 -10.265 -4.414 20.208 1.00 0.00 C ATOM 1157 C GLN A 70 -11.811 -4.444 19.907 1.00 0.00 C ATOM 1158 O GLN A 70 -12.481 -5.380 20.344 1.00 0.00 O ATOM 1159 CB GLN A 70 -9.845 -3.419 21.330 1.00 0.00 C ATOM 1160 CG GLN A 70 -10.391 -3.720 22.744 1.00 0.00 C ATOM 1161 CD GLN A 70 -9.884 -2.755 23.833 1.00 0.00 C ATOM 1162 OE1 GLN A 70 -9.897 -1.530 23.714 1.00 0.00 O ATOM 1163 NE2 GLN A 70 -9.430 -3.280 24.946 1.00 0.00 N ATOM 0 H GLN A 70 -8.850 -3.224 19.190 1.00 0.00 H new ATOM 0 HA GLN A 70 -10.115 -5.450 20.511 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -8.756 -3.398 21.380 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -10.171 -2.419 21.042 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -11.480 -3.681 22.717 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -10.115 -4.738 23.019 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -9.412 -4.293 25.062 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.095 -2.675 25.696 1.00 0.00 H new ATOM 1172 N LYS A 71 -12.364 -3.476 19.145 1.00 0.00 N ATOM 1173 CA LYS A 71 -13.765 -3.512 18.615 1.00 0.00 C ATOM 1174 C LYS A 71 -14.124 -4.749 17.722 1.00 0.00 C ATOM 1175 O LYS A 71 -15.150 -5.387 17.966 1.00 0.00 O ATOM 1176 CB LYS A 71 -14.007 -2.126 17.943 1.00 0.00 C ATOM 1177 CG LYS A 71 -15.387 -1.819 17.311 1.00 0.00 C ATOM 1178 CD LYS A 71 -15.504 -2.241 15.826 1.00 0.00 C ATOM 1179 CE LYS A 71 -16.791 -1.759 15.125 1.00 0.00 C ATOM 1180 NZ LYS A 71 -16.595 -0.397 14.564 1.00 0.00 N ATOM 0 H LYS A 71 -11.855 -2.635 18.872 1.00 0.00 H new ATOM 0 HA LYS A 71 -14.464 -3.669 19.436 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -13.813 -1.360 18.694 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -13.256 -2.005 17.163 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.160 -2.329 17.886 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -15.583 -0.750 17.391 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -14.642 -1.854 15.282 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -15.457 -3.328 15.765 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -17.060 -2.452 14.328 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -17.618 -1.752 15.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -17.380 0.217 14.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -15.697 -0.004 14.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.571 -0.449 13.526 1.00 0.00 H new ATOM 1194 N LEU A 72 -13.293 -5.111 16.725 1.00 0.00 N ATOM 1195 CA LEU A 72 -13.379 -6.440 16.039 1.00 0.00 C ATOM 1196 C LEU A 72 -13.141 -7.705 16.937 1.00 0.00 C ATOM 1197 O LEU A 72 -13.779 -8.738 16.719 1.00 0.00 O ATOM 1198 CB LEU A 72 -12.407 -6.430 14.811 1.00 0.00 C ATOM 1199 CG LEU A 72 -13.008 -6.152 13.409 1.00 0.00 C ATOM 1200 CD1 LEU A 72 -13.912 -7.299 12.925 1.00 0.00 C ATOM 1201 CD2 LEU A 72 -13.754 -4.813 13.320 1.00 0.00 C ATOM 0 H LEU A 72 -12.550 -4.510 16.368 1.00 0.00 H new ATOM 0 HA LEU A 72 -14.419 -6.550 15.731 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -11.639 -5.680 15.000 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -11.906 -7.397 14.774 1.00 0.00 H new ATOM 0 HG LEU A 72 -12.148 -6.086 12.742 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -14.309 -7.058 11.939 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.332 -8.220 12.867 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.736 -7.433 13.625 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -14.149 -4.683 12.312 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -14.576 -4.806 14.035 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -13.067 -3.998 13.549 1.00 0.00 H new ATOM 1213 N GLY A 73 -12.210 -7.635 17.901 1.00 0.00 N ATOM 1214 CA GLY A 73 -11.825 -8.785 18.757 1.00 0.00 C ATOM 1215 C GLY A 73 -10.618 -9.623 18.282 1.00 0.00 C ATOM 1216 O GLY A 73 -10.651 -10.852 18.398 1.00 0.00 O ATOM 0 H GLY A 73 -11.697 -6.780 18.115 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -11.607 -8.409 19.756 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.686 -9.447 18.847 1.00 0.00 H new ATOM 1220 N TYR A 74 -9.529 -8.977 17.833 1.00 0.00 N ATOM 1221 CA TYR A 74 -8.278 -9.678 17.427 1.00 0.00 C ATOM 1222 C TYR A 74 -7.451 -10.158 18.663 1.00 0.00 C ATOM 1223 O TYR A 74 -7.400 -9.507 19.711 1.00 0.00 O ATOM 1224 CB TYR A 74 -7.434 -8.758 16.498 1.00 0.00 C ATOM 1225 CG TYR A 74 -7.923 -8.674 15.039 1.00 0.00 C ATOM 1226 CD1 TYR A 74 -7.459 -9.587 14.080 1.00 0.00 C ATOM 1227 CD2 TYR A 74 -8.797 -7.659 14.647 1.00 0.00 C ATOM 1228 CE1 TYR A 74 -7.851 -9.457 12.747 1.00 0.00 C ATOM 1229 CE2 TYR A 74 -9.184 -7.532 13.315 1.00 0.00 C ATOM 1230 CZ TYR A 74 -8.706 -8.434 12.365 1.00 0.00 C ATOM 1231 OH TYR A 74 -9.075 -8.305 11.052 1.00 0.00 O ATOM 0 H TYR A 74 -9.481 -7.963 17.738 1.00 0.00 H new ATOM 0 HA TYR A 74 -8.554 -10.575 16.872 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -7.425 -7.753 16.920 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -6.404 -9.114 16.499 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -6.799 -10.390 14.373 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -9.177 -6.966 15.383 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -7.487 -10.157 12.009 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -9.852 -6.737 13.019 1.00 0.00 H new ATOM 0 HH TYR A 74 -9.678 -7.538 10.955 1.00 0.00 H new ATOM 1241 N LYS A 75 -6.827 -11.337 18.533 1.00 0.00 N ATOM 1242 CA LYS A 75 -6.020 -11.952 19.627 1.00 0.00 C ATOM 1243 C LYS A 75 -4.507 -11.579 19.564 1.00 0.00 C ATOM 1244 O LYS A 75 -3.963 -11.069 20.548 1.00 0.00 O ATOM 1245 CB LYS A 75 -6.253 -13.491 19.651 1.00 0.00 C ATOM 1246 CG LYS A 75 -7.700 -14.018 19.841 1.00 0.00 C ATOM 1247 CD LYS A 75 -8.348 -13.776 21.229 1.00 0.00 C ATOM 1248 CE LYS A 75 -9.129 -12.455 21.423 1.00 0.00 C ATOM 1249 NZ LYS A 75 -10.403 -12.450 20.650 1.00 0.00 N ATOM 0 H LYS A 75 -6.859 -11.896 17.681 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.368 -11.532 20.571 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -5.872 -13.899 18.715 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -5.641 -13.906 20.452 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.333 -13.556 19.084 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.701 -15.091 19.646 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -9.027 -14.603 21.434 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -7.560 -13.817 21.981 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -9.345 -12.312 22.482 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -8.509 -11.616 21.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -10.305 -11.827 19.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -10.620 -13.416 20.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.175 -12.104 21.255 1.00 0.00 H new ATOM 1263 N ASP A 76 -3.828 -11.850 18.438 1.00 0.00 N ATOM 1264 CA ASP A 76 -2.344 -11.885 18.383 1.00 0.00 C ATOM 1265 C ASP A 76 -1.806 -10.535 17.807 1.00 0.00 C ATOM 1266 O ASP A 76 -1.606 -10.387 16.598 1.00 0.00 O ATOM 1267 CB ASP A 76 -1.968 -13.128 17.533 1.00 0.00 C ATOM 1268 CG ASP A 76 -2.343 -14.498 18.104 1.00 0.00 C ATOM 1269 OD1 ASP A 76 -3.483 -14.954 17.868 1.00 0.00 O ATOM 1270 OD2 ASP A 76 -1.501 -15.118 18.786 1.00 0.00 O ATOM 0 H ASP A 76 -4.279 -12.050 17.545 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.883 -11.981 19.366 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -2.441 -13.027 16.556 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.891 -13.113 17.368 1.00 0.00 H new ATOM 1275 N ILE A 77 -1.633 -9.530 18.688 1.00 0.00 N ATOM 1276 CA ILE A 77 -1.445 -8.104 18.272 1.00 0.00 C ATOM 1277 C ILE A 77 0.064 -7.714 18.450 1.00 0.00 C ATOM 1278 O ILE A 77 0.563 -7.592 19.573 1.00 0.00 O ATOM 1279 CB ILE A 77 -2.465 -7.173 19.039 1.00 0.00 C ATOM 1280 CG1 ILE A 77 -3.969 -7.532 18.789 1.00 0.00 C ATOM 1281 CG2 ILE A 77 -2.252 -5.671 18.703 1.00 0.00 C ATOM 1282 CD1 ILE A 77 -4.973 -6.996 19.829 1.00 0.00 C ATOM 0 H ILE A 77 -1.618 -9.669 19.698 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.675 -7.966 17.215 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.248 -7.354 20.092 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.255 -7.152 17.808 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.061 -8.617 18.750 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.975 -5.069 19.253 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.242 -5.374 18.987 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -2.389 -5.515 17.633 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.981 -7.305 19.554 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.726 -7.395 20.813 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.922 -5.908 19.856 1.00 0.00 H new ATOM 1294 N ASN A 78 0.774 -7.496 17.330 1.00 0.00 N ATOM 1295 CA ASN A 78 2.251 -7.298 17.307 1.00 0.00 C ATOM 1296 C ASN A 78 2.601 -5.826 16.895 1.00 0.00 C ATOM 1297 O ASN A 78 2.256 -5.358 15.805 1.00 0.00 O ATOM 1298 CB ASN A 78 2.861 -8.343 16.328 1.00 0.00 C ATOM 1299 CG ASN A 78 2.794 -9.806 16.796 1.00 0.00 C ATOM 1300 OD1 ASN A 78 3.240 -10.154 17.884 1.00 0.00 O ATOM 1301 ND2 ASN A 78 2.258 -10.710 16.011 1.00 0.00 N ATOM 0 H ASN A 78 0.346 -7.450 16.405 1.00 0.00 H new ATOM 0 HA ASN A 78 2.677 -7.450 18.299 1.00 0.00 H new ATOM 0 HB2 ASN A 78 2.346 -8.262 15.371 1.00 0.00 H new ATOM 0 HB3 ASN A 78 3.905 -8.084 16.151 1.00 0.00 H new ATOM 0 HD21 ASN A 78 2.217 -11.685 16.309 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.882 -10.438 15.103 1.00 0.00 H new ATOM 1308 N VAL A 79 3.291 -5.090 17.786 1.00 0.00 N ATOM 1309 CA VAL A 79 3.550 -3.626 17.630 1.00 0.00 C ATOM 1310 C VAL A 79 4.915 -3.290 16.928 1.00 0.00 C ATOM 1311 O VAL A 79 5.980 -3.772 17.326 1.00 0.00 O ATOM 1312 CB VAL A 79 3.383 -2.953 19.042 1.00 0.00 C ATOM 1313 CG1 VAL A 79 4.446 -3.338 20.101 1.00 0.00 C ATOM 1314 CG2 VAL A 79 3.327 -1.414 18.975 1.00 0.00 C ATOM 0 H VAL A 79 3.689 -5.483 18.639 1.00 0.00 H new ATOM 0 HA VAL A 79 2.818 -3.206 16.940 1.00 0.00 H new ATOM 0 HB VAL A 79 2.426 -3.361 19.368 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.234 -2.817 21.035 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.417 -4.414 20.271 1.00 0.00 H new ATOM 0 HG13 VAL A 79 5.436 -3.054 19.743 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.211 -1.010 19.981 1.00 0.00 H new ATOM 0 HG22 VAL A 79 4.250 -1.035 18.536 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.480 -1.107 18.361 1.00 0.00 H new ATOM 1324 N ARG A 80 4.883 -2.384 15.934 1.00 0.00 N ATOM 1325 CA ARG A 80 6.103 -1.745 15.362 1.00 0.00 C ATOM 1326 C ARG A 80 5.854 -0.206 15.212 1.00 0.00 C ATOM 1327 O ARG A 80 5.407 0.265 14.162 1.00 0.00 O ATOM 1328 CB ARG A 80 6.465 -2.457 14.025 1.00 0.00 C ATOM 1329 CG ARG A 80 7.812 -2.023 13.395 1.00 0.00 C ATOM 1330 CD ARG A 80 7.987 -2.493 11.933 1.00 0.00 C ATOM 1331 NE ARG A 80 9.403 -2.337 11.492 1.00 0.00 N ATOM 1332 CZ ARG A 80 9.963 -1.205 11.058 1.00 0.00 C ATOM 1333 NH1 ARG A 80 9.300 -0.152 10.668 1.00 0.00 N ATOM 1334 NH2 ARG A 80 11.260 -1.131 11.021 1.00 0.00 N ATOM 0 H ARG A 80 4.016 -2.068 15.499 1.00 0.00 H new ATOM 0 HA ARG A 80 6.964 -1.857 16.022 1.00 0.00 H new ATOM 0 HB2 ARG A 80 6.493 -3.533 14.200 1.00 0.00 H new ATOM 0 HB3 ARG A 80 5.668 -2.272 13.305 1.00 0.00 H new ATOM 0 HG2 ARG A 80 7.888 -0.936 13.431 1.00 0.00 H new ATOM 0 HG3 ARG A 80 8.630 -2.419 13.996 1.00 0.00 H new ATOM 0 HD2 ARG A 80 7.687 -3.537 11.844 1.00 0.00 H new ATOM 0 HD3 ARG A 80 7.332 -1.916 11.280 1.00 0.00 H new ATOM 0 HE ARG A 80 9.995 -3.167 11.525 1.00 0.00 H new ATOM 0 HH11 ARG A 80 8.280 -0.157 10.682 1.00 0.00 H new ATOM 0 HH12 ARG A 80 9.801 0.677 10.349 1.00 0.00 H new ATOM 0 HH21 ARG A 80 11.825 -1.926 11.319 1.00 0.00 H new ATOM 0 HH22 ARG A 80 11.713 -0.278 10.694 1.00 0.00 H new ATOM 1348 N VAL A 81 6.176 0.592 16.250 1.00 0.00 N ATOM 1349 CA VAL A 81 6.126 2.088 16.166 1.00 0.00 C ATOM 1350 C VAL A 81 7.561 2.592 15.797 1.00 0.00 C ATOM 1351 O VAL A 81 8.443 2.694 16.656 1.00 0.00 O ATOM 1352 CB VAL A 81 5.521 2.723 17.470 1.00 0.00 C ATOM 1353 CG1 VAL A 81 5.549 4.273 17.472 1.00 0.00 C ATOM 1354 CG2 VAL A 81 4.048 2.315 17.712 1.00 0.00 C ATOM 0 H VAL A 81 6.474 0.238 17.159 1.00 0.00 H new ATOM 0 HA VAL A 81 5.444 2.416 15.382 1.00 0.00 H new ATOM 0 HB VAL A 81 6.165 2.333 18.258 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.116 4.644 18.401 1.00 0.00 H new ATOM 0 HG12 VAL A 81 6.579 4.618 17.388 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.971 4.648 16.628 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.686 2.784 18.627 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.437 2.641 16.870 1.00 0.00 H new ATOM 0 HG23 VAL A 81 3.982 1.231 17.810 1.00 0.00 H new ATOM 1364 N ASN A 82 7.786 2.908 14.510 1.00 0.00 N ATOM 1365 CA ASN A 82 9.090 3.434 14.015 1.00 0.00 C ATOM 1366 C ASN A 82 9.021 4.996 13.900 1.00 0.00 C ATOM 1367 O ASN A 82 8.932 5.561 12.803 1.00 0.00 O ATOM 1368 CB ASN A 82 9.374 2.636 12.708 1.00 0.00 C ATOM 1369 CG ASN A 82 10.731 2.781 12.010 1.00 0.00 C ATOM 1370 OD1 ASN A 82 11.464 1.813 11.820 1.00 0.00 O ATOM 1371 ND2 ASN A 82 11.080 3.945 11.522 1.00 0.00 N ATOM 0 H ASN A 82 7.080 2.810 13.780 1.00 0.00 H new ATOM 0 HA ASN A 82 9.938 3.283 14.683 1.00 0.00 H new ATOM 0 HB2 ASN A 82 9.236 1.579 12.935 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.605 2.910 11.986 1.00 0.00 H new ATOM 0 HD21 ASN A 82 11.948 4.037 10.994 1.00 0.00 H new ATOM 0 HD22 ASN A 82 10.484 4.759 11.670 1.00 0.00 H new ATOM 1378 N GLY A 83 9.045 5.689 15.058 1.00 0.00 N ATOM 1379 CA GLY A 83 8.856 7.164 15.129 1.00 0.00 C ATOM 1380 C GLY A 83 7.430 7.654 14.797 1.00 0.00 C ATOM 1381 O GLY A 83 6.529 7.598 15.636 1.00 0.00 O ATOM 0 H GLY A 83 9.194 5.251 15.967 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.116 7.501 16.133 1.00 0.00 H new ATOM 0 HA3 GLY A 83 9.557 7.639 14.442 1.00 0.00 H new ATOM 1385 N THR A 84 7.249 8.117 13.555 1.00 0.00 N ATOM 1386 CA THR A 84 5.903 8.463 12.994 1.00 0.00 C ATOM 1387 C THR A 84 5.186 7.308 12.208 1.00 0.00 C ATOM 1388 O THR A 84 3.963 7.362 12.054 1.00 0.00 O ATOM 1389 CB THR A 84 5.985 9.758 12.130 1.00 0.00 C ATOM 1390 OG1 THR A 84 6.912 9.618 11.060 1.00 0.00 O ATOM 1391 CG2 THR A 84 6.359 11.032 12.908 1.00 0.00 C ATOM 0 H THR A 84 8.016 8.268 12.900 1.00 0.00 H new ATOM 0 HA THR A 84 5.271 8.637 13.865 1.00 0.00 H new ATOM 0 HB THR A 84 4.968 9.880 11.758 1.00 0.00 H new ATOM 0 HG1 THR A 84 6.937 10.447 10.538 1.00 0.00 H new ATOM 0 HG21 THR A 84 6.391 11.880 12.224 1.00 0.00 H new ATOM 0 HG22 THR A 84 5.614 11.218 13.681 1.00 0.00 H new ATOM 0 HG23 THR A 84 7.337 10.902 13.371 1.00 0.00 H new ATOM 1399 N GLU A 85 5.905 6.270 11.726 1.00 0.00 N ATOM 1400 CA GLU A 85 5.305 5.046 11.136 1.00 0.00 C ATOM 1401 C GLU A 85 4.729 4.111 12.252 1.00 0.00 C ATOM 1402 O GLU A 85 5.462 3.417 12.965 1.00 0.00 O ATOM 1403 CB GLU A 85 6.429 4.371 10.306 1.00 0.00 C ATOM 1404 CG GLU A 85 6.050 3.059 9.557 1.00 0.00 C ATOM 1405 CD GLU A 85 7.106 1.959 9.604 1.00 0.00 C ATOM 1406 OE1 GLU A 85 8.256 2.185 9.174 1.00 0.00 O ATOM 1407 OE2 GLU A 85 6.797 0.844 10.084 1.00 0.00 O ATOM 0 H GLU A 85 6.925 6.255 11.734 1.00 0.00 H new ATOM 0 HA GLU A 85 4.456 5.278 10.494 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.789 5.091 9.571 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.262 4.153 10.974 1.00 0.00 H new ATOM 0 HG2 GLU A 85 5.124 2.671 9.982 1.00 0.00 H new ATOM 0 HG3 GLU A 85 5.845 3.301 8.514 1.00 0.00 H new ATOM 1414 N VAL A 86 3.397 4.089 12.378 1.00 0.00 N ATOM 1415 CA VAL A 86 2.683 3.235 13.367 1.00 0.00 C ATOM 1416 C VAL A 86 2.216 1.955 12.599 1.00 0.00 C ATOM 1417 O VAL A 86 1.198 1.980 11.898 1.00 0.00 O ATOM 1418 CB VAL A 86 1.524 4.052 14.036 1.00 0.00 C ATOM 1419 CG1 VAL A 86 0.745 3.232 15.083 1.00 0.00 C ATOM 1420 CG2 VAL A 86 1.968 5.354 14.748 1.00 0.00 C ATOM 0 H VAL A 86 2.774 4.657 11.804 1.00 0.00 H new ATOM 0 HA VAL A 86 3.318 2.921 14.195 1.00 0.00 H new ATOM 0 HB VAL A 86 0.899 4.307 13.180 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -0.045 3.848 15.513 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.304 2.357 14.605 1.00 0.00 H new ATOM 0 HG13 VAL A 86 1.425 2.910 15.872 1.00 0.00 H new ATOM 0 HG21 VAL A 86 1.097 5.848 15.179 1.00 0.00 H new ATOM 0 HG22 VAL A 86 2.677 5.112 15.540 1.00 0.00 H new ATOM 0 HG23 VAL A 86 2.443 6.019 14.027 1.00 0.00 H new ATOM 1430 N LYS A 87 2.984 0.854 12.698 1.00 0.00 N ATOM 1431 CA LYS A 87 2.761 -0.367 11.878 1.00 0.00 C ATOM 1432 C LYS A 87 2.341 -1.557 12.788 1.00 0.00 C ATOM 1433 O LYS A 87 3.156 -2.108 13.531 1.00 0.00 O ATOM 1434 CB LYS A 87 4.027 -0.599 11.014 1.00 0.00 C ATOM 1435 CG LYS A 87 3.842 -1.576 9.826 1.00 0.00 C ATOM 1436 CD LYS A 87 4.986 -1.445 8.797 1.00 0.00 C ATOM 1437 CE LYS A 87 4.749 -2.248 7.505 1.00 0.00 C ATOM 1438 NZ LYS A 87 5.670 -1.750 6.444 1.00 0.00 N ATOM 0 H LYS A 87 3.772 0.778 13.341 1.00 0.00 H new ATOM 0 HA LYS A 87 1.927 -0.255 11.185 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.363 0.362 10.625 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.822 -0.979 11.656 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.803 -2.599 10.199 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.888 -1.378 9.337 1.00 0.00 H new ATOM 0 HD2 LYS A 87 5.115 -0.393 8.542 1.00 0.00 H new ATOM 0 HD3 LYS A 87 5.916 -1.779 9.256 1.00 0.00 H new ATOM 0 HE2 LYS A 87 4.922 -3.309 7.685 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.713 -2.144 7.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 5.514 -2.289 5.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 5.484 -0.742 6.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 6.655 -1.871 6.755 1.00 0.00 H new ATOM 1452 N ILE A 88 1.049 -1.921 12.763 1.00 0.00 N ATOM 1453 CA ILE A 88 0.458 -2.888 13.741 1.00 0.00 C ATOM 1454 C ILE A 88 0.074 -4.180 12.953 1.00 0.00 C ATOM 1455 O ILE A 88 -0.834 -4.164 12.112 1.00 0.00 O ATOM 1456 CB ILE A 88 -0.728 -2.248 14.553 1.00 0.00 C ATOM 1457 CG1 ILE A 88 -0.458 -0.834 15.158 1.00 0.00 C ATOM 1458 CG2 ILE A 88 -1.256 -3.177 15.678 1.00 0.00 C ATOM 1459 CD1 ILE A 88 0.723 -0.719 16.139 1.00 0.00 C ATOM 0 H ILE A 88 0.380 -1.567 12.079 1.00 0.00 H new ATOM 0 HA ILE A 88 1.182 -3.158 14.510 1.00 0.00 H new ATOM 0 HB ILE A 88 -1.487 -2.119 13.781 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.287 -0.139 14.336 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.361 -0.505 15.672 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.073 -2.683 16.204 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -1.616 -4.109 15.242 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.450 -3.393 16.380 1.00 0.00 H new ATOM 0 HD11 ILE A 88 0.807 0.310 16.489 1.00 0.00 H new ATOM 0 HD12 ILE A 88 0.555 -1.379 16.990 1.00 0.00 H new ATOM 0 HD13 ILE A 88 1.645 -1.007 15.634 1.00 0.00 H new ATOM 1471 N GLU A 89 0.784 -5.288 13.226 1.00 0.00 N ATOM 1472 CA GLU A 89 0.485 -6.616 12.626 1.00 0.00 C ATOM 1473 C GLU A 89 -0.487 -7.415 13.548 1.00 0.00 C ATOM 1474 O GLU A 89 -0.198 -7.624 14.730 1.00 0.00 O ATOM 1475 CB GLU A 89 1.844 -7.321 12.349 1.00 0.00 C ATOM 1476 CG GLU A 89 1.792 -8.656 11.554 1.00 0.00 C ATOM 1477 CD GLU A 89 1.288 -9.885 12.299 1.00 0.00 C ATOM 1478 OE1 GLU A 89 1.960 -10.345 13.245 1.00 0.00 O ATOM 1479 OE2 GLU A 89 0.221 -10.406 11.919 1.00 0.00 O ATOM 0 H GLU A 89 1.579 -5.297 13.865 1.00 0.00 H new ATOM 0 HA GLU A 89 -0.041 -6.531 11.675 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.482 -6.626 11.804 1.00 0.00 H new ATOM 0 HB3 GLU A 89 2.328 -7.514 13.306 1.00 0.00 H new ATOM 0 HG2 GLU A 89 1.158 -8.506 10.680 1.00 0.00 H new ATOM 0 HG3 GLU A 89 2.795 -8.871 11.186 1.00 0.00 H new ATOM 1486 N VAL A 90 -1.642 -7.855 13.016 1.00 0.00 N ATOM 1487 CA VAL A 90 -2.602 -8.708 13.782 1.00 0.00 C ATOM 1488 C VAL A 90 -2.804 -10.104 13.123 1.00 0.00 C ATOM 1489 O VAL A 90 -3.231 -10.210 11.967 1.00 0.00 O ATOM 1490 CB VAL A 90 -3.959 -8.012 14.121 1.00 0.00 C ATOM 1491 CG1 VAL A 90 -3.769 -6.782 15.019 1.00 0.00 C ATOM 1492 CG2 VAL A 90 -4.854 -7.613 12.931 1.00 0.00 C ATOM 0 H VAL A 90 -1.942 -7.642 12.065 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.123 -8.868 14.748 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.491 -8.807 14.643 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -4.739 -6.331 15.228 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -3.300 -7.084 15.955 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -3.133 -6.056 14.512 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.763 -7.140 13.302 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -4.317 -6.913 12.290 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.115 -8.503 12.358 1.00 0.00 H new ATOM 1502 N ARG A 91 -2.561 -11.173 13.902 1.00 0.00 N ATOM 1503 CA ARG A 91 -2.841 -12.567 13.472 1.00 0.00 C ATOM 1504 C ARG A 91 -4.234 -13.090 13.956 1.00 0.00 C ATOM 1505 O ARG A 91 -4.728 -12.753 15.039 1.00 0.00 O ATOM 1506 CB ARG A 91 -1.659 -13.492 13.898 1.00 0.00 C ATOM 1507 CG ARG A 91 -0.586 -13.664 12.806 1.00 0.00 C ATOM 1508 CD ARG A 91 0.426 -14.789 13.092 1.00 0.00 C ATOM 1509 NE ARG A 91 1.328 -14.998 11.922 1.00 0.00 N ATOM 1510 CZ ARG A 91 1.022 -15.683 10.816 1.00 0.00 C ATOM 1511 NH1 ARG A 91 -0.120 -16.301 10.633 1.00 0.00 N ATOM 1512 NH2 ARG A 91 1.892 -15.723 9.855 1.00 0.00 N ATOM 0 H ARG A 91 -2.168 -11.103 14.841 1.00 0.00 H new ATOM 0 HA ARG A 91 -2.911 -12.581 12.384 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -1.192 -13.082 14.793 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.054 -14.472 14.165 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -1.079 -13.866 11.855 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.046 -12.724 12.691 1.00 0.00 H new ATOM 0 HD2 ARG A 91 1.017 -14.538 13.973 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -0.105 -15.714 13.318 1.00 0.00 H new ATOM 0 HE ARG A 91 2.258 -14.582 11.970 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -0.836 -16.275 11.359 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -0.292 -16.807 9.765 1.00 0.00 H new ATOM 0 HH21 ARG A 91 2.784 -15.239 9.954 1.00 0.00 H new ATOM 0 HH22 ARG A 91 1.684 -16.239 9.000 1.00 0.00 H new ATOM 1526 N VAL A 92 -4.847 -13.960 13.128 1.00 0.00 N ATOM 1527 CA VAL A 92 -6.123 -14.656 13.468 1.00 0.00 C ATOM 1528 C VAL A 92 -5.758 -16.128 13.782 1.00 0.00 C ATOM 1529 O VAL A 92 -5.558 -16.961 12.892 1.00 0.00 O ATOM 1530 CB VAL A 92 -7.210 -14.483 12.349 1.00 0.00 C ATOM 1531 CG1 VAL A 92 -8.542 -15.204 12.667 1.00 0.00 C ATOM 1532 CG2 VAL A 92 -7.567 -13.011 12.040 1.00 0.00 C ATOM 0 H VAL A 92 -4.481 -14.205 12.208 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.596 -14.212 14.344 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.729 -14.937 11.483 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -9.247 -15.042 11.852 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -8.359 -16.272 12.782 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -8.959 -14.806 13.592 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -8.324 -12.977 11.257 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -7.954 -12.534 12.940 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.674 -12.483 11.705 1.00 0.00 H new TER 1542 VAL A 92