USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 1035 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 140:sc= -0.584 (180deg=-2.86!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.0111) USER MOD Single : A 5 GLN : amide:sc= -0.35 K(o=-0.35,f=-6.4!) USER MOD Single : A 13 ASN :FLIP amide:sc= -9.06! C(o=-11!,f=-9.1!) USER MOD Single : A 15 ASN : amide:sc= -0.367 K(o=-0.37,f=-2.6!) USER MOD Single : A 16 ASN : amide:sc= -1.7! C(o=-1.7!,f=-6.6!) USER MOD Single : A 21 THR OG1 : rot 138:sc= -2.29! USER MOD Single : A 28 HIS : no HD1:sc= -0.261 K(o=-0.26,f=-1.3) USER MOD Single : A 29 MET CE :methyl 156:sc= -0.19 (180deg=-0.467) USER MOD Single : A 31 ASN : amide:sc= -1.65 X(o=-1.6,f=-1.3!) USER MOD Single : A 32 LYS NZ :NH3+ -150:sc= -1.78! (180deg=-2.07!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= -2.26! USER MOD Single : A 48 GLN : amide:sc= -2.34! C(o=-2.3!,f=-6.5!) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 THR OG1 : rot -58:sc= 0.377 USER MOD Single : A 63 GLN : amide:sc= -0.52 X(o=-0.52,f=-0.088) USER MOD Single : A 64 HIS : no HD1:sc= -0.299 X(o=-0.3,f=-0.14) USER MOD Single : A 66 SER OG : rot 37:sc= 0.791 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS :FLIP no HE2:sc= -3.73! F(o=-4.5,f=-3.7!) USER MOD Single : A 81 THR OG1 : rot -9:sc= 1 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -7.77! C(o=-7.8!,f=-16!) USER MOD Single : A 105 MET CE :methyl -143:sc= -3.45! (180deg=-9.51!) USER MOD Single : A 106 SER OG : rot 180:sc= -1.06 USER MOD Single : A 111 ASN : amide:sc= -0.127 K(o=-0.13,f=-4.1!) USER MOD Single : A 119 ASN : amide:sc= -6.03! C(o=-6!,f=-13!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.451 13.947 11.175 1.00 0.00 N ATOM 2 CA MET A 1 14.539 15.083 10.215 1.00 0.00 C ATOM 3 C MET A 1 15.156 14.592 8.903 1.00 0.00 C ATOM 4 O MET A 1 16.302 14.189 8.857 1.00 0.00 O ATOM 5 CB MET A 1 15.412 16.189 10.811 1.00 0.00 C ATOM 6 CG MET A 1 15.597 17.303 9.782 1.00 0.00 C ATOM 7 SD MET A 1 14.878 18.836 10.417 1.00 0.00 S ATOM 8 CE MET A 1 14.204 19.441 8.849 1.00 0.00 C ATOM 0 H1 MET A 1 14.032 14.278 12.067 1.00 0.00 H new ATOM 0 H2 MET A 1 13.856 13.196 10.771 1.00 0.00 H new ATOM 0 H3 MET A 1 15.404 13.573 11.358 1.00 0.00 H new ATOM 0 HA MET A 1 13.541 15.476 10.022 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.948 16.587 11.714 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.381 15.784 11.103 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.657 17.446 9.572 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.120 17.027 8.842 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.224 19.885 9.022 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.874 20.192 8.430 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.108 18.610 8.150 1.00 0.00 H new ATOM 20 N LYS A 2 14.403 14.622 7.837 1.00 0.00 N ATOM 21 CA LYS A 2 14.934 14.157 6.524 1.00 0.00 C ATOM 22 C LYS A 2 15.247 12.661 6.599 1.00 0.00 C ATOM 23 O LYS A 2 16.391 12.254 6.618 1.00 0.00 O ATOM 24 CB LYS A 2 16.207 14.931 6.176 1.00 0.00 C ATOM 25 CG LYS A 2 16.776 14.409 4.857 1.00 0.00 C ATOM 26 CD LYS A 2 18.080 13.659 5.125 1.00 0.00 C ATOM 27 CE LYS A 2 19.249 14.435 4.518 1.00 0.00 C ATOM 28 NZ LYS A 2 20.530 13.899 5.056 1.00 0.00 N ATOM 0 H LYS A 2 13.438 14.951 7.819 1.00 0.00 H new ATOM 0 HA LYS A 2 14.186 14.333 5.751 1.00 0.00 H new ATOM 0 HB2 LYS A 2 15.987 15.995 6.094 1.00 0.00 H new ATOM 0 HB3 LYS A 2 16.943 14.818 6.972 1.00 0.00 H new ATOM 0 HG2 LYS A 2 16.056 13.748 4.375 1.00 0.00 H new ATOM 0 HG3 LYS A 2 16.955 15.238 4.173 1.00 0.00 H new ATOM 0 HD2 LYS A 2 18.228 13.538 6.198 1.00 0.00 H new ATOM 0 HD3 LYS A 2 18.031 12.659 4.695 1.00 0.00 H new ATOM 0 HE2 LYS A 2 19.233 14.348 3.432 1.00 0.00 H new ATOM 0 HE3 LYS A 2 19.158 15.495 4.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 21.327 14.426 4.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 20.543 14.004 6.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 20.616 12.892 4.809 1.00 0.00 H new ATOM 42 N LYS A 3 14.233 11.838 6.634 1.00 0.00 N ATOM 43 CA LYS A 3 14.468 10.367 6.700 1.00 0.00 C ATOM 44 C LYS A 3 13.158 9.650 7.033 1.00 0.00 C ATOM 45 O LYS A 3 12.807 9.471 8.182 1.00 0.00 O ATOM 46 CB LYS A 3 15.507 10.058 7.779 1.00 0.00 C ATOM 47 CG LYS A 3 16.677 9.294 7.155 1.00 0.00 C ATOM 48 CD LYS A 3 17.971 9.652 7.888 1.00 0.00 C ATOM 49 CE LYS A 3 17.904 9.133 9.326 1.00 0.00 C ATOM 50 NZ LYS A 3 18.223 7.677 9.341 1.00 0.00 N ATOM 0 H LYS A 3 13.253 12.121 6.620 1.00 0.00 H new ATOM 0 HA LYS A 3 14.836 10.020 5.734 1.00 0.00 H new ATOM 0 HB2 LYS A 3 15.863 10.983 8.232 1.00 0.00 H new ATOM 0 HB3 LYS A 3 15.055 9.466 8.575 1.00 0.00 H new ATOM 0 HG2 LYS A 3 16.498 8.221 7.216 1.00 0.00 H new ATOM 0 HG3 LYS A 3 16.765 9.543 6.098 1.00 0.00 H new ATOM 0 HD2 LYS A 3 18.826 9.215 7.372 1.00 0.00 H new ATOM 0 HD3 LYS A 3 18.115 10.732 7.886 1.00 0.00 H new ATOM 0 HE2 LYS A 3 18.609 9.678 9.954 1.00 0.00 H new ATOM 0 HE3 LYS A 3 16.910 9.303 9.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 17.630 7.199 10.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 18.036 7.271 8.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 19.226 7.544 9.582 1.00 0.00 H new ATOM 64 N LEU A 4 12.436 9.235 6.031 1.00 0.00 N ATOM 65 CA LEU A 4 11.150 8.522 6.274 1.00 0.00 C ATOM 66 C LEU A 4 10.805 7.690 5.040 1.00 0.00 C ATOM 67 O LEU A 4 10.271 8.192 4.071 1.00 0.00 O ATOM 68 CB LEU A 4 10.037 9.539 6.531 1.00 0.00 C ATOM 69 CG LEU A 4 9.031 8.954 7.525 1.00 0.00 C ATOM 70 CD1 LEU A 4 8.464 7.645 6.972 1.00 0.00 C ATOM 71 CD2 LEU A 4 9.733 8.682 8.857 1.00 0.00 C ATOM 0 H LEU A 4 12.682 9.359 5.049 1.00 0.00 H new ATOM 0 HA LEU A 4 11.248 7.873 7.144 1.00 0.00 H new ATOM 0 HB2 LEU A 4 10.459 10.464 6.925 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.536 9.790 5.596 1.00 0.00 H new ATOM 0 HG LEU A 4 8.218 9.664 7.678 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.748 7.230 7.681 1.00 0.00 H new ATOM 0 HD12 LEU A 4 7.964 7.837 6.023 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.275 6.934 6.818 1.00 0.00 H new ATOM 0 HD21 LEU A 4 9.018 8.265 9.567 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.546 7.973 8.702 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.136 9.614 9.253 1.00 0.00 H new ATOM 83 N GLN A 5 11.117 6.423 5.059 1.00 0.00 N ATOM 84 CA GLN A 5 10.818 5.567 3.878 1.00 0.00 C ATOM 85 C GLN A 5 10.166 4.260 4.331 1.00 0.00 C ATOM 86 O GLN A 5 10.525 3.694 5.345 1.00 0.00 O ATOM 87 CB GLN A 5 12.124 5.253 3.144 1.00 0.00 C ATOM 88 CG GLN A 5 12.835 6.561 2.787 1.00 0.00 C ATOM 89 CD GLN A 5 14.083 6.256 1.958 1.00 0.00 C ATOM 90 OE1 GLN A 5 14.483 5.115 1.835 1.00 0.00 O ATOM 91 NE2 GLN A 5 14.720 7.237 1.376 1.00 0.00 N ATOM 0 H GLN A 5 11.565 5.945 5.840 1.00 0.00 H new ATOM 0 HA GLN A 5 10.134 6.095 3.214 1.00 0.00 H new ATOM 0 HB2 GLN A 5 12.767 4.636 3.772 1.00 0.00 H new ATOM 0 HB3 GLN A 5 11.917 4.680 2.240 1.00 0.00 H new ATOM 0 HG2 GLN A 5 12.163 7.211 2.226 1.00 0.00 H new ATOM 0 HG3 GLN A 5 13.111 7.096 3.695 1.00 0.00 H new ATOM 0 HE21 GLN A 5 14.385 8.195 1.479 1.00 0.00 H new ATOM 0 HE22 GLN A 5 15.552 7.045 0.819 1.00 0.00 H new ATOM 100 N ILE A 6 9.220 3.769 3.579 1.00 0.00 N ATOM 101 CA ILE A 6 8.554 2.495 3.945 1.00 0.00 C ATOM 102 C ILE A 6 8.121 1.785 2.655 1.00 0.00 C ATOM 103 O ILE A 6 7.961 2.402 1.621 1.00 0.00 O ATOM 104 CB ILE A 6 7.343 2.798 4.833 1.00 0.00 C ATOM 105 CG1 ILE A 6 7.806 2.911 6.288 1.00 0.00 C ATOM 106 CG2 ILE A 6 6.314 1.676 4.717 1.00 0.00 C ATOM 107 CD1 ILE A 6 6.592 3.076 7.204 1.00 0.00 C ATOM 0 H ILE A 6 8.880 4.202 2.720 1.00 0.00 H new ATOM 0 HA ILE A 6 9.234 1.847 4.498 1.00 0.00 H new ATOM 0 HB ILE A 6 6.886 3.734 4.512 1.00 0.00 H new ATOM 0 HG12 ILE A 6 8.369 2.021 6.571 1.00 0.00 H new ATOM 0 HG13 ILE A 6 8.477 3.762 6.401 1.00 0.00 H new ATOM 0 HG21 ILE A 6 5.457 1.901 5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 6 5.985 1.589 3.681 1.00 0.00 H new ATOM 0 HG23 ILE A 6 6.764 0.735 5.035 1.00 0.00 H new ATOM 0 HD11 ILE A 6 6.925 3.156 8.239 1.00 0.00 H new ATOM 0 HD12 ILE A 6 6.047 3.979 6.927 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.937 2.211 7.100 1.00 0.00 H new ATOM 119 N ALA A 7 7.931 0.496 2.707 1.00 0.00 N ATOM 120 CA ALA A 7 7.513 -0.247 1.484 1.00 0.00 C ATOM 121 C ALA A 7 6.086 -0.750 1.673 1.00 0.00 C ATOM 122 O ALA A 7 5.771 -1.398 2.649 1.00 0.00 O ATOM 123 CB ALA A 7 8.450 -1.435 1.260 1.00 0.00 C ATOM 0 H ALA A 7 8.047 -0.076 3.544 1.00 0.00 H new ATOM 0 HA ALA A 7 7.560 0.413 0.618 1.00 0.00 H new ATOM 0 HB1 ALA A 7 8.143 -1.977 0.366 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.471 -1.074 1.133 1.00 0.00 H new ATOM 0 HB3 ALA A 7 8.405 -2.101 2.121 1.00 0.00 H new ATOM 129 N VAL A 8 5.215 -0.447 0.754 1.00 0.00 N ATOM 130 CA VAL A 8 3.802 -0.897 0.897 1.00 0.00 C ATOM 131 C VAL A 8 3.369 -1.676 -0.342 1.00 0.00 C ATOM 132 O VAL A 8 2.735 -1.147 -1.230 1.00 0.00 O ATOM 133 CB VAL A 8 2.908 0.328 1.049 1.00 0.00 C ATOM 134 CG1 VAL A 8 3.363 1.395 0.059 1.00 0.00 C ATOM 135 CG2 VAL A 8 1.458 -0.056 0.750 1.00 0.00 C ATOM 0 H VAL A 8 5.418 0.091 -0.088 1.00 0.00 H new ATOM 0 HA VAL A 8 3.717 -1.542 1.772 1.00 0.00 H new ATOM 0 HB VAL A 8 2.976 0.711 2.067 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.730 2.277 0.158 1.00 0.00 H new ATOM 0 HG12 VAL A 8 4.398 1.666 0.266 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.286 1.006 -0.956 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.820 0.821 0.859 1.00 0.00 H new ATOM 0 HG22 VAL A 8 1.385 -0.434 -0.270 1.00 0.00 H new ATOM 0 HG23 VAL A 8 1.135 -0.829 1.447 1.00 0.00 H new ATOM 145 N GLY A 9 3.667 -2.931 -0.392 1.00 0.00 N ATOM 146 CA GLY A 9 3.228 -3.735 -1.558 1.00 0.00 C ATOM 147 C GLY A 9 1.727 -3.976 -1.418 1.00 0.00 C ATOM 148 O GLY A 9 1.280 -4.589 -0.469 1.00 0.00 O ATOM 0 H GLY A 9 4.194 -3.439 0.319 1.00 0.00 H new ATOM 0 HA2 GLY A 9 3.446 -3.210 -2.488 1.00 0.00 H new ATOM 0 HA3 GLY A 9 3.766 -4.682 -1.593 1.00 0.00 H new ATOM 152 N ILE A 10 0.937 -3.490 -2.336 1.00 0.00 N ATOM 153 CA ILE A 10 -0.526 -3.689 -2.211 1.00 0.00 C ATOM 154 C ILE A 10 -0.957 -4.883 -3.053 1.00 0.00 C ATOM 155 O ILE A 10 -0.183 -5.441 -3.804 1.00 0.00 O ATOM 156 CB ILE A 10 -1.277 -2.443 -2.684 1.00 0.00 C ATOM 157 CG1 ILE A 10 -0.423 -1.173 -2.507 1.00 0.00 C ATOM 158 CG2 ILE A 10 -2.550 -2.302 -1.865 1.00 0.00 C ATOM 159 CD1 ILE A 10 -0.905 -0.110 -3.495 1.00 0.00 C ATOM 0 H ILE A 10 1.242 -2.969 -3.158 1.00 0.00 H new ATOM 0 HA ILE A 10 -0.762 -3.872 -1.163 1.00 0.00 H new ATOM 0 HB ILE A 10 -1.506 -2.556 -3.744 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -0.505 -0.803 -1.485 1.00 0.00 H new ATOM 0 HG13 ILE A 10 0.629 -1.399 -2.680 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -3.096 -1.417 -2.191 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -3.173 -3.185 -2.006 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -2.295 -2.202 -0.810 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -0.307 0.794 -3.378 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -0.800 -0.485 -4.513 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -1.952 0.120 -3.299 1.00 0.00 H new ATOM 171 N ILE A 11 -2.189 -5.284 -2.927 1.00 0.00 N ATOM 172 CA ILE A 11 -2.670 -6.445 -3.711 1.00 0.00 C ATOM 173 C ILE A 11 -4.096 -6.170 -4.195 1.00 0.00 C ATOM 174 O ILE A 11 -4.817 -5.402 -3.603 1.00 0.00 O ATOM 175 CB ILE A 11 -2.670 -7.712 -2.846 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.199 -7.416 -1.399 1.00 0.00 C ATOM 177 CG2 ILE A 11 -1.777 -8.772 -3.494 1.00 0.00 C ATOM 178 CD1 ILE A 11 -0.679 -7.622 -1.217 1.00 0.00 C ATOM 0 H ILE A 11 -2.882 -4.855 -2.314 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.006 -6.596 -4.562 1.00 0.00 H new ATOM 0 HB ILE A 11 -3.692 -8.085 -2.784 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.457 -6.389 -1.140 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -2.736 -8.064 -0.706 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -1.777 -9.672 -2.880 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.157 -9.010 -4.487 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.760 -8.389 -3.577 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.403 -7.401 -0.186 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -0.422 -8.656 -1.448 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.138 -6.955 -1.888 1.00 0.00 H new ATOM 190 N ARG A 12 -4.502 -6.792 -5.269 1.00 0.00 N ATOM 191 CA ARG A 12 -5.888 -6.565 -5.795 1.00 0.00 C ATOM 192 C ARG A 12 -6.301 -7.718 -6.723 1.00 0.00 C ATOM 193 O ARG A 12 -6.459 -7.535 -7.914 1.00 0.00 O ATOM 194 CB ARG A 12 -5.918 -5.253 -6.580 1.00 0.00 C ATOM 195 CG ARG A 12 -7.366 -4.895 -6.924 1.00 0.00 C ATOM 196 CD ARG A 12 -7.416 -3.492 -7.536 1.00 0.00 C ATOM 197 NE ARG A 12 -7.571 -3.598 -9.017 1.00 0.00 N ATOM 198 CZ ARG A 12 -6.963 -4.550 -9.673 1.00 0.00 C ATOM 199 NH1 ARG A 12 -5.689 -4.447 -9.938 1.00 0.00 N ATOM 200 NH2 ARG A 12 -7.627 -5.602 -10.063 1.00 0.00 N ATOM 0 H ARG A 12 -3.937 -7.448 -5.808 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.583 -6.517 -4.957 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.465 -4.455 -5.992 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.330 -5.350 -7.493 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -7.775 -5.623 -7.624 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -7.984 -4.934 -6.027 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -8.248 -2.929 -7.112 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.505 -2.946 -7.294 1.00 0.00 H new ATOM 0 HE ARG A 12 -8.153 -2.926 -9.517 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.170 -3.624 -9.633 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -5.213 -5.190 -10.450 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.623 -5.682 -9.856 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -7.151 -6.345 -10.575 1.00 0.00 H new ATOM 214 N ASN A 13 -6.491 -8.898 -6.187 1.00 0.00 N ATOM 215 CA ASN A 13 -6.906 -10.060 -7.033 1.00 0.00 C ATOM 216 C ASN A 13 -7.441 -11.182 -6.139 1.00 0.00 C ATOM 217 O ASN A 13 -7.613 -11.009 -4.948 1.00 0.00 O ATOM 218 CB ASN A 13 -5.710 -10.592 -7.821 1.00 0.00 C ATOM 219 CG ASN A 13 -5.311 -9.585 -8.898 1.00 0.00 C ATOM 220 OD1 ASN A 13 -4.389 -8.700 -8.636 1.00 0.00 O flip ATOM 221 ND2 ASN A 13 -5.840 -9.604 -9.991 1.00 0.00 N flip ATOM 0 H ASN A 13 -6.376 -9.108 -5.195 1.00 0.00 H new ATOM 0 HA ASN A 13 -7.681 -9.728 -7.724 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -4.871 -10.771 -7.149 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -5.961 -11.548 -8.280 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -6.561 -10.296 -10.197 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -5.563 -8.928 -10.703 1.00 0.00 H new ATOM 228 N GLU A 14 -7.688 -12.336 -6.715 1.00 0.00 N ATOM 229 CA GLU A 14 -8.203 -13.500 -5.926 1.00 0.00 C ATOM 230 C GLU A 14 -9.716 -13.395 -5.792 1.00 0.00 C ATOM 231 O GLU A 14 -10.445 -14.346 -5.992 1.00 0.00 O ATOM 232 CB GLU A 14 -7.561 -13.515 -4.537 1.00 0.00 C ATOM 233 CG GLU A 14 -7.258 -14.958 -4.128 1.00 0.00 C ATOM 234 CD GLU A 14 -6.259 -14.964 -2.970 1.00 0.00 C ATOM 235 OE1 GLU A 14 -6.664 -14.650 -1.863 1.00 0.00 O ATOM 236 OE2 GLU A 14 -5.107 -15.283 -3.211 1.00 0.00 O ATOM 0 H GLU A 14 -7.553 -12.522 -7.709 1.00 0.00 H new ATOM 0 HA GLU A 14 -7.948 -14.425 -6.444 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.643 -12.928 -4.543 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -8.230 -13.053 -3.811 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.177 -15.463 -3.831 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.851 -15.509 -4.976 1.00 0.00 H new ATOM 243 N ASN A 15 -10.180 -12.238 -5.460 1.00 0.00 N ATOM 244 CA ASN A 15 -11.636 -12.015 -5.306 1.00 0.00 C ATOM 245 C ASN A 15 -11.957 -10.628 -5.844 1.00 0.00 C ATOM 246 O ASN A 15 -12.915 -9.997 -5.443 1.00 0.00 O ATOM 247 CB ASN A 15 -11.998 -12.079 -3.824 1.00 0.00 C ATOM 248 CG ASN A 15 -13.518 -12.125 -3.668 1.00 0.00 C ATOM 249 OD1 ASN A 15 -14.232 -12.325 -4.630 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.047 -11.948 -2.489 1.00 0.00 N ATOM 0 H ASN A 15 -9.602 -11.416 -5.284 1.00 0.00 H new ATOM 0 HA ASN A 15 -12.201 -12.774 -5.848 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -11.549 -12.961 -3.368 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -11.595 -11.210 -3.303 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -15.060 -11.978 -2.375 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -13.448 -11.780 -1.681 1.00 0.00 H new ATOM 257 N ASN A 16 -11.145 -10.139 -6.736 1.00 0.00 N ATOM 258 CA ASN A 16 -11.385 -8.785 -7.284 1.00 0.00 C ATOM 259 C ASN A 16 -11.452 -7.811 -6.109 1.00 0.00 C ATOM 260 O ASN A 16 -12.330 -6.977 -6.018 1.00 0.00 O ATOM 261 CB ASN A 16 -12.706 -8.791 -8.052 1.00 0.00 C ATOM 262 CG ASN A 16 -13.129 -7.360 -8.388 1.00 0.00 C ATOM 263 OD1 ASN A 16 -12.326 -6.566 -8.835 1.00 0.00 O ATOM 264 ND2 ASN A 16 -14.365 -6.995 -8.190 1.00 0.00 N ATOM 0 H ASN A 16 -10.326 -10.621 -7.107 1.00 0.00 H new ATOM 0 HA ASN A 16 -10.588 -8.485 -7.964 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -12.599 -9.371 -8.969 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -13.479 -9.276 -7.456 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -14.657 -6.043 -8.411 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -15.040 -7.662 -7.815 1.00 0.00 H new ATOM 271 N GLU A 17 -10.527 -7.921 -5.191 1.00 0.00 N ATOM 272 CA GLU A 17 -10.544 -7.011 -4.016 1.00 0.00 C ATOM 273 C GLU A 17 -9.117 -6.597 -3.676 1.00 0.00 C ATOM 274 O GLU A 17 -8.178 -7.336 -3.897 1.00 0.00 O ATOM 275 CB GLU A 17 -11.163 -7.733 -2.820 1.00 0.00 C ATOM 276 CG GLU A 17 -12.472 -8.398 -3.245 1.00 0.00 C ATOM 277 CD GLU A 17 -13.518 -8.213 -2.144 1.00 0.00 C ATOM 278 OE1 GLU A 17 -13.360 -7.297 -1.354 1.00 0.00 O ATOM 279 OE2 GLU A 17 -14.456 -8.991 -2.109 1.00 0.00 O ATOM 0 H GLU A 17 -9.765 -8.599 -5.207 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.135 -6.125 -4.250 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -10.470 -8.482 -2.436 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.348 -7.026 -2.011 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.829 -7.961 -4.178 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.309 -9.459 -3.432 1.00 0.00 H new ATOM 286 N ILE A 18 -8.943 -5.425 -3.138 1.00 0.00 N ATOM 287 CA ILE A 18 -7.573 -4.972 -2.785 1.00 0.00 C ATOM 288 C ILE A 18 -7.329 -5.221 -1.302 1.00 0.00 C ATOM 289 O ILE A 18 -8.238 -5.194 -0.498 1.00 0.00 O ATOM 290 CB ILE A 18 -7.425 -3.473 -3.053 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.335 -3.049 -4.208 1.00 0.00 C ATOM 292 CG2 ILE A 18 -5.974 -3.149 -3.410 1.00 0.00 C ATOM 293 CD1 ILE A 18 -9.446 -2.143 -3.675 1.00 0.00 C ATOM 0 H ILE A 18 -9.689 -4.762 -2.928 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.854 -5.524 -3.391 1.00 0.00 H new ATOM 0 HB ILE A 18 -7.710 -2.929 -2.152 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -7.756 -2.524 -4.968 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.766 -3.928 -4.687 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -5.876 -2.080 -3.600 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.324 -3.432 -2.582 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -5.686 -3.704 -4.303 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -10.095 -1.841 -4.497 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -10.031 -2.684 -2.931 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -9.005 -1.258 -3.216 1.00 0.00 H new ATOM 305 N PHE A 19 -6.102 -5.431 -0.929 1.00 0.00 N ATOM 306 CA PHE A 19 -5.795 -5.646 0.511 1.00 0.00 C ATOM 307 C PHE A 19 -5.543 -4.280 1.141 1.00 0.00 C ATOM 308 O PHE A 19 -4.416 -3.844 1.274 1.00 0.00 O ATOM 309 CB PHE A 19 -4.547 -6.517 0.662 1.00 0.00 C ATOM 310 CG PHE A 19 -4.166 -6.596 2.122 1.00 0.00 C ATOM 311 CD1 PHE A 19 -5.039 -7.191 3.042 1.00 0.00 C ATOM 312 CD2 PHE A 19 -2.944 -6.069 2.558 1.00 0.00 C ATOM 313 CE1 PHE A 19 -4.689 -7.259 4.396 1.00 0.00 C ATOM 314 CE2 PHE A 19 -2.594 -6.138 3.912 1.00 0.00 C ATOM 315 CZ PHE A 19 -3.467 -6.732 4.831 1.00 0.00 C ATOM 0 H PHE A 19 -5.298 -5.463 -1.556 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.627 -6.151 1.001 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.737 -7.516 0.270 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.725 -6.098 0.082 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -5.982 -7.597 2.707 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.271 -5.609 1.849 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -5.362 -7.718 5.105 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.651 -5.733 4.247 1.00 0.00 H new ATOM 0 HZ PHE A 19 -3.198 -6.784 5.876 1.00 0.00 H new ATOM 325 N ILE A 20 -6.583 -3.588 1.506 1.00 0.00 N ATOM 326 CA ILE A 20 -6.405 -2.242 2.098 1.00 0.00 C ATOM 327 C ILE A 20 -5.988 -2.362 3.549 1.00 0.00 C ATOM 328 O ILE A 20 -6.069 -3.409 4.155 1.00 0.00 O ATOM 329 CB ILE A 20 -7.729 -1.487 2.042 1.00 0.00 C ATOM 330 CG1 ILE A 20 -8.266 -1.509 0.618 1.00 0.00 C ATOM 331 CG2 ILE A 20 -7.506 -0.041 2.474 1.00 0.00 C ATOM 332 CD1 ILE A 20 -7.211 -0.911 -0.303 1.00 0.00 C ATOM 0 H ILE A 20 -7.550 -3.900 1.418 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.637 -1.711 1.536 1.00 0.00 H new ATOM 0 HB ILE A 20 -8.447 -1.963 2.710 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.498 -2.530 0.316 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -9.193 -0.939 0.553 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -8.451 0.500 2.435 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -7.119 -0.021 3.493 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -6.789 0.432 1.804 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -7.578 -0.918 -1.329 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -7.002 0.115 0.001 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -6.297 -1.501 -0.240 1.00 0.00 H new ATOM 344 N THR A 21 -5.555 -1.281 4.111 1.00 0.00 N ATOM 345 CA THR A 21 -5.150 -1.301 5.530 1.00 0.00 C ATOM 346 C THR A 21 -5.988 -0.282 6.298 1.00 0.00 C ATOM 347 O THR A 21 -6.094 0.868 5.921 1.00 0.00 O ATOM 348 CB THR A 21 -3.682 -0.929 5.651 1.00 0.00 C ATOM 349 OG1 THR A 21 -3.226 -0.393 4.418 1.00 0.00 O ATOM 350 CG2 THR A 21 -2.862 -2.169 6.007 1.00 0.00 C ATOM 0 H THR A 21 -5.464 -0.378 3.645 1.00 0.00 H new ATOM 0 HA THR A 21 -5.304 -2.300 5.939 1.00 0.00 H new ATOM 0 HB THR A 21 -3.563 -0.183 6.437 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.651 0.382 4.591 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.810 -1.897 6.093 1.00 0.00 H new ATOM 0 HG22 THR A 21 -3.210 -2.575 6.957 1.00 0.00 H new ATOM 0 HG23 THR A 21 -2.980 -2.920 5.226 1.00 0.00 H new ATOM 358 N ARG A 22 -6.589 -0.703 7.368 1.00 0.00 N ATOM 359 CA ARG A 22 -7.428 0.212 8.170 1.00 0.00 C ATOM 360 C ARG A 22 -7.605 -0.369 9.575 1.00 0.00 C ATOM 361 O ARG A 22 -8.322 -1.331 9.771 1.00 0.00 O ATOM 362 CB ARG A 22 -8.789 0.348 7.493 1.00 0.00 C ATOM 363 CG ARG A 22 -9.202 1.809 7.532 1.00 0.00 C ATOM 364 CD ARG A 22 -10.558 1.985 6.840 1.00 0.00 C ATOM 365 NE ARG A 22 -11.439 2.870 7.659 1.00 0.00 N ATOM 366 CZ ARG A 22 -11.437 2.781 8.961 1.00 0.00 C ATOM 367 NH1 ARG A 22 -11.737 1.651 9.538 1.00 0.00 N ATOM 368 NH2 ARG A 22 -11.138 3.826 9.684 1.00 0.00 N ATOM 0 H ARG A 22 -6.532 -1.657 7.725 1.00 0.00 H new ATOM 0 HA ARG A 22 -6.955 1.191 8.244 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -8.736 -0.004 6.463 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -9.529 -0.269 8.003 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -9.264 2.151 8.565 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -8.449 2.422 7.037 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -10.416 2.416 5.849 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.033 1.014 6.700 1.00 0.00 H new ATOM 0 HE ARG A 22 -12.046 3.548 7.198 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -11.973 0.836 8.972 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.735 1.582 10.556 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.906 4.710 9.231 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -11.136 3.758 10.702 1.00 0.00 H new ATOM 382 N ARG A 23 -6.959 0.202 10.556 1.00 0.00 N ATOM 383 CA ARG A 23 -7.091 -0.318 11.935 1.00 0.00 C ATOM 384 C ARG A 23 -8.574 -0.491 12.282 1.00 0.00 C ATOM 385 O ARG A 23 -9.289 0.464 12.513 1.00 0.00 O ATOM 386 CB ARG A 23 -6.429 0.673 12.892 1.00 0.00 C ATOM 387 CG ARG A 23 -7.284 1.934 13.019 1.00 0.00 C ATOM 388 CD ARG A 23 -6.374 3.143 13.254 1.00 0.00 C ATOM 389 NE ARG A 23 -6.758 3.827 14.523 1.00 0.00 N ATOM 390 CZ ARG A 23 -8.015 3.916 14.866 1.00 0.00 C ATOM 391 NH1 ARG A 23 -8.886 4.400 14.026 1.00 0.00 N ATOM 392 NH2 ARG A 23 -8.398 3.520 16.049 1.00 0.00 N ATOM 0 H ARG A 23 -6.344 1.010 10.455 1.00 0.00 H new ATOM 0 HA ARG A 23 -6.604 -1.289 12.022 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -6.299 0.213 13.871 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -5.435 0.933 12.528 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -7.874 2.079 12.114 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -7.987 1.828 13.845 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -5.334 2.822 13.304 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -6.454 3.837 12.418 1.00 0.00 H new ATOM 0 HE ARG A 23 -6.037 4.226 15.124 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -8.586 4.709 13.101 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.868 4.470 14.293 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -7.716 3.141 16.706 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.380 3.589 16.317 1.00 0.00 H new ATOM 406 N ALA A 24 -9.042 -1.708 12.315 1.00 0.00 N ATOM 407 CA ALA A 24 -10.476 -1.947 12.642 1.00 0.00 C ATOM 408 C ALA A 24 -11.346 -1.537 11.451 1.00 0.00 C ATOM 409 O ALA A 24 -10.855 -1.267 10.373 1.00 0.00 O ATOM 410 CB ALA A 24 -10.866 -1.116 13.866 1.00 0.00 C ATOM 0 H ALA A 24 -8.493 -2.548 12.130 1.00 0.00 H new ATOM 0 HA ALA A 24 -10.628 -3.005 12.857 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -11.915 -1.291 14.105 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -10.247 -1.406 14.715 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -10.714 -0.058 13.651 1.00 0.00 H new ATOM 416 N ALA A 25 -12.636 -1.487 11.640 1.00 0.00 N ATOM 417 CA ALA A 25 -13.540 -1.091 10.524 1.00 0.00 C ATOM 418 C ALA A 25 -14.556 -0.069 11.037 1.00 0.00 C ATOM 419 O ALA A 25 -14.245 0.760 11.869 1.00 0.00 O ATOM 420 CB ALA A 25 -14.270 -2.329 9.997 1.00 0.00 C ATOM 0 H ALA A 25 -13.103 -1.704 12.520 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.957 -0.648 9.717 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.932 -2.041 9.180 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -13.541 -3.054 9.635 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.857 -2.774 10.800 1.00 0.00 H new ATOM 426 N ASP A 26 -15.766 -0.117 10.550 1.00 0.00 N ATOM 427 CA ASP A 26 -16.795 0.855 11.014 1.00 0.00 C ATOM 428 C ASP A 26 -16.376 2.276 10.602 1.00 0.00 C ATOM 429 O ASP A 26 -16.248 2.570 9.430 1.00 0.00 O ATOM 430 CB ASP A 26 -16.937 0.760 12.538 1.00 0.00 C ATOM 431 CG ASP A 26 -17.444 -0.631 12.921 1.00 0.00 C ATOM 432 OD1 ASP A 26 -17.185 -1.560 12.173 1.00 0.00 O ATOM 433 OD2 ASP A 26 -18.079 -0.745 13.956 1.00 0.00 O ATOM 0 H ASP A 26 -16.086 -0.787 9.851 1.00 0.00 H new ATOM 0 HA ASP A 26 -17.757 0.623 10.556 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -15.976 0.952 13.015 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -17.629 1.522 12.897 1.00 0.00 H new ATOM 438 N ALA A 27 -16.162 3.163 11.542 1.00 0.00 N ATOM 439 CA ALA A 27 -15.757 4.550 11.172 1.00 0.00 C ATOM 440 C ALA A 27 -16.928 5.255 10.482 1.00 0.00 C ATOM 441 O ALA A 27 -17.190 5.046 9.314 1.00 0.00 O ATOM 442 CB ALA A 27 -14.559 4.496 10.220 1.00 0.00 C ATOM 0 H ALA A 27 -16.250 2.986 12.543 1.00 0.00 H new ATOM 0 HA ALA A 27 -15.480 5.101 12.071 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -14.263 5.510 9.950 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -13.726 3.994 10.712 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -14.834 3.946 9.320 1.00 0.00 H new ATOM 448 N HIS A 28 -17.635 6.089 11.195 1.00 0.00 N ATOM 449 CA HIS A 28 -18.787 6.807 10.579 1.00 0.00 C ATOM 450 C HIS A 28 -18.450 8.295 10.451 1.00 0.00 C ATOM 451 O HIS A 28 -18.695 8.911 9.432 1.00 0.00 O ATOM 452 CB HIS A 28 -20.024 6.637 11.464 1.00 0.00 C ATOM 453 CG HIS A 28 -20.696 5.328 11.146 1.00 0.00 C ATOM 454 ND1 HIS A 28 -20.200 4.453 10.192 1.00 0.00 N ATOM 455 CD2 HIS A 28 -21.827 4.732 11.649 1.00 0.00 C ATOM 456 CE1 HIS A 28 -21.023 3.390 10.150 1.00 0.00 C ATOM 457 NE2 HIS A 28 -22.031 3.508 11.018 1.00 0.00 N ATOM 0 H HIS A 28 -17.465 6.304 12.177 1.00 0.00 H new ATOM 0 HA HIS A 28 -18.988 6.394 9.590 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -19.738 6.665 12.515 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -20.717 7.462 11.300 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -22.461 5.149 12.417 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -20.885 2.543 9.494 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -22.788 2.844 11.183 1.00 0.00 H new ATOM 465 N MET A 29 -17.886 8.876 11.474 1.00 0.00 N ATOM 466 CA MET A 29 -17.532 10.322 11.406 1.00 0.00 C ATOM 467 C MET A 29 -16.841 10.607 10.071 1.00 0.00 C ATOM 468 O MET A 29 -17.314 11.387 9.268 1.00 0.00 O ATOM 469 CB MET A 29 -16.583 10.669 12.556 1.00 0.00 C ATOM 470 CG MET A 29 -17.311 11.548 13.576 1.00 0.00 C ATOM 471 SD MET A 29 -17.572 13.198 12.877 1.00 0.00 S ATOM 472 CE MET A 29 -19.381 13.180 12.915 1.00 0.00 C ATOM 0 H MET A 29 -17.655 8.413 12.353 1.00 0.00 H new ATOM 0 HA MET A 29 -18.436 10.926 11.488 1.00 0.00 H new ATOM 0 HB2 MET A 29 -16.228 9.757 13.035 1.00 0.00 H new ATOM 0 HB3 MET A 29 -15.706 11.190 12.172 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.268 11.099 13.841 1.00 0.00 H new ATOM 0 HG3 MET A 29 -16.727 11.619 14.493 1.00 0.00 H new ATOM 0 HE1 MET A 29 -19.755 14.204 12.939 1.00 0.00 H new ATOM 0 HE2 MET A 29 -19.759 12.677 12.025 1.00 0.00 H new ATOM 0 HE3 MET A 29 -19.721 12.649 13.804 1.00 0.00 H new ATOM 482 N ALA A 30 -15.725 9.976 9.828 1.00 0.00 N ATOM 483 CA ALA A 30 -14.998 10.202 8.547 1.00 0.00 C ATOM 484 C ALA A 30 -14.328 8.896 8.114 1.00 0.00 C ATOM 485 O ALA A 30 -13.416 8.414 8.756 1.00 0.00 O ATOM 486 CB ALA A 30 -13.933 11.281 8.747 1.00 0.00 C ATOM 0 H ALA A 30 -15.284 9.311 10.464 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.700 10.527 7.779 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -13.402 11.446 7.810 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -14.410 12.209 9.062 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.227 10.958 9.512 1.00 0.00 H new ATOM 492 N ASN A 31 -14.774 8.317 7.034 1.00 0.00 N ATOM 493 CA ASN A 31 -14.163 7.039 6.567 1.00 0.00 C ATOM 494 C ASN A 31 -12.864 7.332 5.817 1.00 0.00 C ATOM 495 O ASN A 31 -12.828 8.134 4.907 1.00 0.00 O ATOM 496 CB ASN A 31 -15.133 6.318 5.629 1.00 0.00 C ATOM 497 CG ASN A 31 -16.184 5.572 6.452 1.00 0.00 C ATOM 498 OD1 ASN A 31 -16.904 6.170 7.227 1.00 0.00 O ATOM 499 ND2 ASN A 31 -16.303 4.279 6.316 1.00 0.00 N ATOM 0 H ASN A 31 -15.534 8.672 6.454 1.00 0.00 H new ATOM 0 HA ASN A 31 -13.951 6.409 7.431 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -15.617 7.037 4.968 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -14.589 5.618 4.995 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -17.000 3.771 6.860 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -15.699 3.777 5.666 1.00 0.00 H new ATOM 506 N LYS A 32 -11.797 6.680 6.188 1.00 0.00 N ATOM 507 CA LYS A 32 -10.504 6.913 5.489 1.00 0.00 C ATOM 508 C LYS A 32 -9.840 5.565 5.192 1.00 0.00 C ATOM 509 O LYS A 32 -9.830 4.670 6.013 1.00 0.00 O ATOM 510 CB LYS A 32 -9.584 7.766 6.372 1.00 0.00 C ATOM 511 CG LYS A 32 -8.998 6.911 7.498 1.00 0.00 C ATOM 512 CD LYS A 32 -7.548 6.550 7.163 1.00 0.00 C ATOM 513 CE LYS A 32 -6.986 5.628 8.246 1.00 0.00 C ATOM 514 NZ LYS A 32 -7.383 4.220 7.958 1.00 0.00 N ATOM 0 H LYS A 32 -11.765 5.997 6.945 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.685 7.441 4.553 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.780 8.190 5.770 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -10.143 8.602 6.792 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -9.040 7.455 8.442 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -9.589 6.004 7.626 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -7.500 6.058 6.192 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -6.944 7.455 7.092 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -5.900 5.711 8.281 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.360 5.929 9.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.473 3.695 8.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.295 4.212 7.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -6.658 3.770 7.363 1.00 0.00 H new ATOM 528 N LEU A 33 -9.288 5.415 4.022 1.00 0.00 N ATOM 529 CA LEU A 33 -8.626 4.141 3.659 1.00 0.00 C ATOM 530 C LEU A 33 -7.120 4.299 3.852 1.00 0.00 C ATOM 531 O LEU A 33 -6.659 5.269 4.418 1.00 0.00 O ATOM 532 CB LEU A 33 -8.926 3.839 2.193 1.00 0.00 C ATOM 533 CG LEU A 33 -10.347 3.272 2.016 1.00 0.00 C ATOM 534 CD1 LEU A 33 -10.371 2.367 0.786 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.774 2.454 3.240 1.00 0.00 C ATOM 0 H LEU A 33 -9.269 6.131 3.296 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.991 3.327 4.285 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.820 4.749 1.603 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.197 3.124 1.810 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.038 4.106 1.897 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.374 1.961 0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.093 2.944 -0.096 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.663 1.549 0.922 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.781 2.067 3.086 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.083 1.623 3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.762 3.090 4.125 1.00 0.00 H new ATOM 547 N GLU A 34 -6.347 3.358 3.392 1.00 0.00 N ATOM 548 CA GLU A 34 -4.882 3.477 3.558 1.00 0.00 C ATOM 549 C GLU A 34 -4.175 2.568 2.566 1.00 0.00 C ATOM 550 O GLU A 34 -4.705 2.198 1.539 1.00 0.00 O ATOM 551 CB GLU A 34 -4.489 3.062 4.974 1.00 0.00 C ATOM 552 CG GLU A 34 -3.438 4.029 5.522 1.00 0.00 C ATOM 553 CD GLU A 34 -2.245 3.239 6.066 1.00 0.00 C ATOM 554 OE1 GLU A 34 -2.391 2.632 7.114 1.00 0.00 O ATOM 555 OE2 GLU A 34 -1.206 3.257 5.427 1.00 0.00 O ATOM 0 H GLU A 34 -6.668 2.517 2.911 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.590 4.512 3.381 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.367 3.060 5.620 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.095 2.046 4.969 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.109 4.708 4.735 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.871 4.643 6.312 1.00 0.00 H new ATOM 562 N PHE A 35 -2.976 2.206 2.883 1.00 0.00 N ATOM 563 CA PHE A 35 -2.198 1.312 1.990 1.00 0.00 C ATOM 564 C PHE A 35 -1.340 0.379 2.847 1.00 0.00 C ATOM 565 O PHE A 35 -1.058 0.679 3.990 1.00 0.00 O ATOM 566 CB PHE A 35 -1.298 2.153 1.082 1.00 0.00 C ATOM 567 CG PHE A 35 -2.006 3.436 0.720 1.00 0.00 C ATOM 568 CD1 PHE A 35 -2.010 4.511 1.615 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.659 3.551 -0.514 1.00 0.00 C ATOM 570 CE1 PHE A 35 -2.666 5.702 1.279 1.00 0.00 C ATOM 571 CE2 PHE A 35 -3.316 4.742 -0.851 1.00 0.00 C ATOM 572 CZ PHE A 35 -3.319 5.816 0.046 1.00 0.00 C ATOM 0 H PHE A 35 -2.491 2.493 3.733 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.876 0.723 1.373 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.358 2.374 1.588 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.051 1.595 0.179 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.507 4.423 2.566 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.656 2.722 -1.206 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.668 6.532 1.970 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.820 4.831 -1.802 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.826 6.734 -0.213 1.00 0.00 H new ATOM 582 N PRO A 36 -0.951 -0.725 2.267 1.00 0.00 N ATOM 583 CA PRO A 36 -0.119 -1.722 2.958 1.00 0.00 C ATOM 584 C PRO A 36 1.159 -1.060 3.479 1.00 0.00 C ATOM 585 O PRO A 36 1.188 0.126 3.741 1.00 0.00 O ATOM 586 CB PRO A 36 0.201 -2.771 1.883 1.00 0.00 C ATOM 587 CG PRO A 36 -0.591 -2.391 0.607 1.00 0.00 C ATOM 588 CD PRO A 36 -1.304 -1.060 0.878 1.00 0.00 C ATOM 0 HA PRO A 36 -0.616 -2.166 3.821 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.271 -2.794 1.677 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -0.079 -3.767 2.225 1.00 0.00 H new ATOM 0 HG2 PRO A 36 0.081 -2.298 -0.246 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.314 -3.169 0.360 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -0.973 -0.285 0.187 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.383 -1.156 0.755 1.00 0.00 H new ATOM 596 N GLY A 37 2.214 -1.806 3.634 1.00 0.00 N ATOM 597 CA GLY A 37 3.476 -1.198 4.139 1.00 0.00 C ATOM 598 C GLY A 37 4.424 -2.292 4.629 1.00 0.00 C ATOM 599 O GLY A 37 4.231 -3.462 4.368 1.00 0.00 O ATOM 0 H GLY A 37 2.259 -2.805 3.435 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.953 -0.620 3.348 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.256 -0.505 4.951 1.00 0.00 H new ATOM 603 N GLY A 38 5.453 -1.914 5.335 1.00 0.00 N ATOM 604 CA GLY A 38 6.424 -2.920 5.846 1.00 0.00 C ATOM 605 C GLY A 38 7.598 -2.196 6.503 1.00 0.00 C ATOM 606 O GLY A 38 7.662 -2.065 7.709 1.00 0.00 O ATOM 0 H GLY A 38 5.664 -0.947 5.581 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.938 -3.579 6.566 1.00 0.00 H new ATOM 0 HA3 GLY A 38 6.780 -3.548 5.029 1.00 0.00 H new ATOM 610 N LYS A 39 8.522 -1.717 5.715 1.00 0.00 N ATOM 611 CA LYS A 39 9.695 -0.991 6.281 1.00 0.00 C ATOM 612 C LYS A 39 10.762 -0.836 5.196 1.00 0.00 C ATOM 613 O LYS A 39 11.041 -1.753 4.448 1.00 0.00 O ATOM 614 CB LYS A 39 10.277 -1.776 7.461 1.00 0.00 C ATOM 615 CG LYS A 39 11.640 -1.194 7.841 1.00 0.00 C ATOM 616 CD LYS A 39 12.181 -1.925 9.072 1.00 0.00 C ATOM 617 CE LYS A 39 13.685 -2.158 8.907 1.00 0.00 C ATOM 618 NZ LYS A 39 14.018 -3.554 9.309 1.00 0.00 N ATOM 0 H LYS A 39 8.515 -1.798 4.698 1.00 0.00 H new ATOM 0 HA LYS A 39 9.377 -0.009 6.630 1.00 0.00 H new ATOM 0 HB2 LYS A 39 9.599 -1.727 8.313 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.381 -2.828 7.196 1.00 0.00 H new ATOM 0 HG2 LYS A 39 12.336 -1.297 7.009 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.547 -0.128 8.049 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.989 -1.338 9.970 1.00 0.00 H new ATOM 0 HD3 LYS A 39 11.666 -2.877 9.198 1.00 0.00 H new ATOM 0 HE2 LYS A 39 13.979 -1.986 7.872 1.00 0.00 H new ATOM 0 HE3 LYS A 39 14.243 -1.449 9.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 15.040 -3.713 9.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.751 -3.702 10.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.496 -4.222 8.707 1.00 0.00 H new ATOM 632 N ILE A 40 11.358 0.320 5.103 1.00 0.00 N ATOM 633 CA ILE A 40 12.404 0.543 4.067 1.00 0.00 C ATOM 634 C ILE A 40 13.751 0.791 4.757 1.00 0.00 C ATOM 635 O ILE A 40 13.992 1.845 5.310 1.00 0.00 O ATOM 636 CB ILE A 40 12.003 1.758 3.216 1.00 0.00 C ATOM 637 CG1 ILE A 40 11.124 1.297 2.053 1.00 0.00 C ATOM 638 CG2 ILE A 40 13.239 2.472 2.657 1.00 0.00 C ATOM 639 CD1 ILE A 40 10.724 2.509 1.210 1.00 0.00 C ATOM 0 H ILE A 40 11.165 1.123 5.702 1.00 0.00 H new ATOM 0 HA ILE A 40 12.497 -0.331 3.422 1.00 0.00 H new ATOM 0 HB ILE A 40 11.456 2.454 3.851 1.00 0.00 H new ATOM 0 HG12 ILE A 40 11.662 0.575 1.439 1.00 0.00 H new ATOM 0 HG13 ILE A 40 10.235 0.794 2.432 1.00 0.00 H new ATOM 0 HG21 ILE A 40 12.925 3.328 2.059 1.00 0.00 H new ATOM 0 HG22 ILE A 40 13.865 2.815 3.481 1.00 0.00 H new ATOM 0 HG23 ILE A 40 13.807 1.782 2.033 1.00 0.00 H new ATOM 0 HD11 ILE A 40 10.097 2.184 0.380 1.00 0.00 H new ATOM 0 HD12 ILE A 40 10.170 3.215 1.828 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.620 2.993 0.820 1.00 0.00 H new ATOM 651 N GLU A 41 14.628 -0.173 4.725 1.00 0.00 N ATOM 652 CA GLU A 41 15.957 0.007 5.373 1.00 0.00 C ATOM 653 C GLU A 41 17.024 0.148 4.292 1.00 0.00 C ATOM 654 O GLU A 41 18.202 -0.012 4.542 1.00 0.00 O ATOM 655 CB GLU A 41 16.267 -1.216 6.233 1.00 0.00 C ATOM 656 CG GLU A 41 15.721 -2.465 5.543 1.00 0.00 C ATOM 657 CD GLU A 41 16.309 -2.571 4.134 1.00 0.00 C ATOM 658 OE1 GLU A 41 17.511 -2.750 4.028 1.00 0.00 O ATOM 659 OE2 GLU A 41 15.548 -2.469 3.186 1.00 0.00 O ATOM 0 H GLU A 41 14.482 -1.078 4.278 1.00 0.00 H new ATOM 0 HA GLU A 41 15.946 0.900 5.998 1.00 0.00 H new ATOM 0 HB2 GLU A 41 17.343 -1.308 6.381 1.00 0.00 H new ATOM 0 HB3 GLU A 41 15.818 -1.105 7.220 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.975 -3.353 6.122 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.633 -2.418 5.492 1.00 0.00 H new ATOM 666 N MET A 42 16.615 0.437 3.087 1.00 0.00 N ATOM 667 CA MET A 42 17.596 0.583 1.976 1.00 0.00 C ATOM 668 C MET A 42 18.011 -0.811 1.491 1.00 0.00 C ATOM 669 O MET A 42 17.188 -1.694 1.353 1.00 0.00 O ATOM 670 CB MET A 42 18.819 1.355 2.475 1.00 0.00 C ATOM 671 CG MET A 42 19.542 1.994 1.289 1.00 0.00 C ATOM 672 SD MET A 42 19.857 3.739 1.644 1.00 0.00 S ATOM 673 CE MET A 42 18.608 4.426 0.529 1.00 0.00 C ATOM 0 H MET A 42 15.640 0.579 2.824 1.00 0.00 H new ATOM 0 HA MET A 42 17.146 1.133 1.149 1.00 0.00 H new ATOM 0 HB2 MET A 42 18.512 2.124 3.184 1.00 0.00 H new ATOM 0 HB3 MET A 42 19.494 0.683 3.006 1.00 0.00 H new ATOM 0 HG2 MET A 42 20.482 1.475 1.100 1.00 0.00 H new ATOM 0 HG3 MET A 42 18.938 1.899 0.387 1.00 0.00 H new ATOM 0 HE1 MET A 42 18.627 5.514 0.588 1.00 0.00 H new ATOM 0 HE2 MET A 42 18.822 4.114 -0.493 1.00 0.00 H new ATOM 0 HE3 MET A 42 17.622 4.064 0.820 1.00 0.00 H new ATOM 683 N GLY A 43 19.274 -1.025 1.229 1.00 0.00 N ATOM 684 CA GLY A 43 19.713 -2.366 0.756 1.00 0.00 C ATOM 685 C GLY A 43 20.478 -2.217 -0.557 1.00 0.00 C ATOM 686 O GLY A 43 21.563 -1.673 -0.598 1.00 0.00 O ATOM 0 H GLY A 43 20.016 -0.331 1.322 1.00 0.00 H new ATOM 0 HA2 GLY A 43 20.346 -2.839 1.507 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.848 -3.014 0.614 1.00 0.00 H new ATOM 690 N GLU A 44 19.922 -2.700 -1.631 1.00 0.00 N ATOM 691 CA GLU A 44 20.614 -2.592 -2.942 1.00 0.00 C ATOM 692 C GLU A 44 19.664 -1.973 -3.971 1.00 0.00 C ATOM 693 O GLU A 44 20.062 -1.173 -4.794 1.00 0.00 O ATOM 694 CB GLU A 44 21.038 -3.985 -3.407 1.00 0.00 C ATOM 695 CG GLU A 44 21.459 -3.928 -4.875 1.00 0.00 C ATOM 696 CD GLU A 44 22.582 -4.934 -5.128 1.00 0.00 C ATOM 697 OE1 GLU A 44 23.098 -5.473 -4.163 1.00 0.00 O ATOM 698 OE2 GLU A 44 22.907 -5.151 -6.285 1.00 0.00 O ATOM 0 H GLU A 44 19.015 -3.166 -1.657 1.00 0.00 H new ATOM 0 HA GLU A 44 21.496 -1.960 -2.839 1.00 0.00 H new ATOM 0 HB2 GLU A 44 21.864 -4.348 -2.795 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.215 -4.688 -3.281 1.00 0.00 H new ATOM 0 HG2 GLU A 44 20.607 -4.151 -5.517 1.00 0.00 H new ATOM 0 HG3 GLU A 44 21.795 -2.922 -5.128 1.00 0.00 H new ATOM 705 N THR A 45 18.409 -2.332 -3.932 1.00 0.00 N ATOM 706 CA THR A 45 17.445 -1.757 -4.909 1.00 0.00 C ATOM 707 C THR A 45 16.018 -1.858 -4.325 1.00 0.00 C ATOM 708 O THR A 45 15.811 -2.503 -3.316 1.00 0.00 O ATOM 709 CB THR A 45 17.599 -2.497 -6.258 1.00 0.00 C ATOM 710 OG1 THR A 45 17.675 -1.548 -7.316 1.00 0.00 O ATOM 711 CG2 THR A 45 16.429 -3.447 -6.515 1.00 0.00 C ATOM 0 H THR A 45 18.012 -2.996 -3.268 1.00 0.00 H new ATOM 0 HA THR A 45 17.645 -0.701 -5.093 1.00 0.00 H new ATOM 0 HB THR A 45 18.514 -3.088 -6.214 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.774 -2.018 -8.170 1.00 0.00 H new ATOM 0 HG21 THR A 45 16.572 -3.949 -7.472 1.00 0.00 H new ATOM 0 HG22 THR A 45 16.382 -4.190 -5.719 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.498 -2.880 -6.538 1.00 0.00 H new ATOM 719 N PRO A 46 15.092 -1.174 -4.952 1.00 0.00 N ATOM 720 CA PRO A 46 13.683 -1.114 -4.490 1.00 0.00 C ATOM 721 C PRO A 46 13.010 -2.495 -4.446 1.00 0.00 C ATOM 722 O PRO A 46 11.996 -2.670 -3.801 1.00 0.00 O ATOM 723 CB PRO A 46 12.978 -0.211 -5.512 1.00 0.00 C ATOM 724 CG PRO A 46 14.033 0.240 -6.554 1.00 0.00 C ATOM 725 CD PRO A 46 15.373 -0.405 -6.175 1.00 0.00 C ATOM 0 HA PRO A 46 13.627 -0.736 -3.469 1.00 0.00 H new ATOM 0 HB2 PRO A 46 12.165 -0.749 -6.000 1.00 0.00 H new ATOM 0 HB3 PRO A 46 12.536 0.654 -5.017 1.00 0.00 H new ATOM 0 HG2 PRO A 46 13.733 -0.064 -7.557 1.00 0.00 H new ATOM 0 HG3 PRO A 46 14.121 1.326 -6.563 1.00 0.00 H new ATOM 0 HD2 PRO A 46 15.740 -1.051 -6.972 1.00 0.00 H new ATOM 0 HD3 PRO A 46 16.139 0.350 -5.999 1.00 0.00 H new ATOM 733 N GLU A 47 13.548 -3.469 -5.117 1.00 0.00 N ATOM 734 CA GLU A 47 12.916 -4.819 -5.099 1.00 0.00 C ATOM 735 C GLU A 47 13.297 -5.536 -3.806 1.00 0.00 C ATOM 736 O GLU A 47 12.464 -5.833 -2.985 1.00 0.00 O ATOM 737 CB GLU A 47 13.416 -5.629 -6.295 1.00 0.00 C ATOM 738 CG GLU A 47 12.260 -5.876 -7.266 1.00 0.00 C ATOM 739 CD GLU A 47 12.754 -5.694 -8.702 1.00 0.00 C ATOM 740 OE1 GLU A 47 13.542 -4.792 -8.927 1.00 0.00 O ATOM 741 OE2 GLU A 47 12.332 -6.460 -9.554 1.00 0.00 O ATOM 0 H GLU A 47 14.397 -3.393 -5.677 1.00 0.00 H new ATOM 0 HA GLU A 47 11.832 -4.717 -5.156 1.00 0.00 H new ATOM 0 HB2 GLU A 47 14.220 -5.093 -6.800 1.00 0.00 H new ATOM 0 HB3 GLU A 47 13.829 -6.579 -5.957 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.866 -6.883 -7.130 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.444 -5.184 -7.060 1.00 0.00 H new ATOM 748 N GLN A 48 14.559 -5.793 -3.623 1.00 0.00 N ATOM 749 CA GLN A 48 15.049 -6.467 -2.410 1.00 0.00 C ATOM 750 C GLN A 48 14.274 -5.983 -1.215 1.00 0.00 C ATOM 751 O GLN A 48 14.050 -6.687 -0.253 1.00 0.00 O ATOM 752 CB GLN A 48 16.506 -6.085 -2.245 1.00 0.00 C ATOM 753 CG GLN A 48 17.256 -7.297 -1.757 1.00 0.00 C ATOM 754 CD GLN A 48 18.736 -7.170 -2.117 1.00 0.00 C ATOM 755 OE1 GLN A 48 19.097 -6.396 -2.980 1.00 0.00 O ATOM 756 NE2 GLN A 48 19.615 -7.905 -1.493 1.00 0.00 N ATOM 0 H GLN A 48 15.290 -5.552 -4.293 1.00 0.00 H new ATOM 0 HA GLN A 48 14.930 -7.547 -2.493 1.00 0.00 H new ATOM 0 HB2 GLN A 48 16.918 -5.739 -3.193 1.00 0.00 H new ATOM 0 HB3 GLN A 48 16.606 -5.264 -1.535 1.00 0.00 H new ATOM 0 HG2 GLN A 48 17.142 -7.396 -0.677 1.00 0.00 H new ATOM 0 HG3 GLN A 48 16.839 -8.199 -2.206 1.00 0.00 H new ATOM 0 HE21 GLN A 48 19.313 -8.556 -0.768 1.00 0.00 H new ATOM 0 HE22 GLN A 48 20.604 -7.829 -1.730 1.00 0.00 H new ATOM 765 N ALA A 49 13.892 -4.768 -1.279 1.00 0.00 N ATOM 766 CA ALA A 49 13.146 -4.162 -0.160 1.00 0.00 C ATOM 767 C ALA A 49 11.813 -4.881 0.083 1.00 0.00 C ATOM 768 O ALA A 49 11.601 -5.468 1.124 1.00 0.00 O ATOM 769 CB ALA A 49 12.882 -2.684 -0.456 1.00 0.00 C ATOM 0 H ALA A 49 14.063 -4.147 -2.070 1.00 0.00 H new ATOM 0 HA ALA A 49 13.753 -4.260 0.740 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.331 -2.240 0.373 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.831 -2.163 -0.581 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.296 -2.595 -1.371 1.00 0.00 H new ATOM 775 N VAL A 50 10.901 -4.816 -0.848 1.00 0.00 N ATOM 776 CA VAL A 50 9.577 -5.471 -0.640 1.00 0.00 C ATOM 777 C VAL A 50 9.661 -6.965 -0.930 1.00 0.00 C ATOM 778 O VAL A 50 9.138 -7.776 -0.197 1.00 0.00 O ATOM 779 CB VAL A 50 8.552 -4.818 -1.558 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.718 -5.335 -2.990 1.00 0.00 C ATOM 781 CG2 VAL A 50 7.145 -5.135 -1.067 1.00 0.00 C ATOM 0 H VAL A 50 11.014 -4.339 -1.742 1.00 0.00 H new ATOM 0 HA VAL A 50 9.276 -5.346 0.400 1.00 0.00 H new ATOM 0 HB VAL A 50 8.709 -3.739 -1.547 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.979 -4.860 -3.636 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.720 -5.098 -3.349 1.00 0.00 H new ATOM 0 HG13 VAL A 50 8.573 -6.415 -3.006 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.415 -4.666 -1.727 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.994 -6.214 -1.068 1.00 0.00 H new ATOM 0 HG23 VAL A 50 7.018 -4.752 -0.055 1.00 0.00 H new ATOM 791 N VAL A 51 10.310 -7.331 -1.992 1.00 0.00 N ATOM 792 CA VAL A 51 10.441 -8.769 -2.335 1.00 0.00 C ATOM 793 C VAL A 51 10.749 -9.556 -1.060 1.00 0.00 C ATOM 794 O VAL A 51 10.332 -10.684 -0.892 1.00 0.00 O ATOM 795 CB VAL A 51 11.591 -8.917 -3.328 1.00 0.00 C ATOM 796 CG1 VAL A 51 12.859 -8.343 -2.714 1.00 0.00 C ATOM 797 CG2 VAL A 51 11.823 -10.384 -3.638 1.00 0.00 C ATOM 0 H VAL A 51 10.761 -6.690 -2.645 1.00 0.00 H new ATOM 0 HA VAL A 51 9.519 -9.149 -2.776 1.00 0.00 H new ATOM 0 HB VAL A 51 11.339 -8.385 -4.246 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.684 -8.446 -3.419 1.00 0.00 H new ATOM 0 HG12 VAL A 51 12.707 -7.288 -2.485 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.096 -8.883 -1.797 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.645 -10.480 -4.347 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.072 -10.915 -2.719 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.919 -10.812 -4.071 1.00 0.00 H new ATOM 807 N ARG A 52 11.475 -8.952 -0.156 1.00 0.00 N ATOM 808 CA ARG A 52 11.824 -9.605 1.107 1.00 0.00 C ATOM 809 C ARG A 52 10.598 -9.599 2.027 1.00 0.00 C ATOM 810 O ARG A 52 10.283 -10.590 2.655 1.00 0.00 O ATOM 811 CB ARG A 52 12.984 -8.798 1.698 1.00 0.00 C ATOM 812 CG ARG A 52 12.725 -8.441 3.159 1.00 0.00 C ATOM 813 CD ARG A 52 13.958 -7.753 3.749 1.00 0.00 C ATOM 814 NE ARG A 52 13.586 -7.038 5.003 1.00 0.00 N ATOM 815 CZ ARG A 52 12.422 -6.456 5.105 1.00 0.00 C ATOM 816 NH1 ARG A 52 11.953 -5.757 4.108 1.00 0.00 N ATOM 817 NH2 ARG A 52 11.727 -6.574 6.205 1.00 0.00 N ATOM 0 H ARG A 52 11.843 -8.006 -0.259 1.00 0.00 H new ATOM 0 HA ARG A 52 12.123 -10.645 0.976 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.907 -9.373 1.620 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.127 -7.886 1.119 1.00 0.00 H new ATOM 0 HG2 ARG A 52 11.859 -7.784 3.235 1.00 0.00 H new ATOM 0 HG3 ARG A 52 12.492 -9.341 3.728 1.00 0.00 H new ATOM 0 HD2 ARG A 52 14.733 -8.491 3.957 1.00 0.00 H new ATOM 0 HD3 ARG A 52 14.373 -7.049 3.028 1.00 0.00 H new ATOM 0 HE ARG A 52 14.242 -7.003 5.783 1.00 0.00 H new ATOM 0 HH11 ARG A 52 12.496 -5.666 3.249 1.00 0.00 H new ATOM 0 HH12 ARG A 52 11.044 -5.302 4.187 1.00 0.00 H new ATOM 0 HH21 ARG A 52 12.094 -7.121 6.984 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.817 -6.119 6.285 1.00 0.00 H new ATOM 831 N GLU A 53 9.891 -8.497 2.110 1.00 0.00 N ATOM 832 CA GLU A 53 8.694 -8.481 2.989 1.00 0.00 C ATOM 833 C GLU A 53 7.610 -9.347 2.348 1.00 0.00 C ATOM 834 O GLU A 53 6.578 -9.608 2.934 1.00 0.00 O ATOM 835 CB GLU A 53 8.197 -7.036 3.184 1.00 0.00 C ATOM 836 CG GLU A 53 7.325 -6.585 2.002 1.00 0.00 C ATOM 837 CD GLU A 53 6.331 -5.524 2.482 1.00 0.00 C ATOM 838 OE1 GLU A 53 5.520 -5.844 3.336 1.00 0.00 O ATOM 839 OE2 GLU A 53 6.399 -4.411 1.988 1.00 0.00 O ATOM 0 H GLU A 53 10.090 -7.627 1.615 1.00 0.00 H new ATOM 0 HA GLU A 53 8.945 -8.881 3.971 1.00 0.00 H new ATOM 0 HB2 GLU A 53 7.625 -6.967 4.109 1.00 0.00 H new ATOM 0 HB3 GLU A 53 9.050 -6.366 3.287 1.00 0.00 H new ATOM 0 HG2 GLU A 53 7.951 -6.180 1.207 1.00 0.00 H new ATOM 0 HG3 GLU A 53 6.790 -7.438 1.583 1.00 0.00 H new ATOM 846 N LEU A 54 7.843 -9.799 1.142 1.00 0.00 N ATOM 847 CA LEU A 54 6.839 -10.650 0.458 1.00 0.00 C ATOM 848 C LEU A 54 6.699 -11.960 1.226 1.00 0.00 C ATOM 849 O LEU A 54 5.651 -12.282 1.748 1.00 0.00 O ATOM 850 CB LEU A 54 7.305 -10.950 -0.971 1.00 0.00 C ATOM 851 CG LEU A 54 6.223 -10.531 -1.969 1.00 0.00 C ATOM 852 CD1 LEU A 54 6.521 -11.144 -3.336 1.00 0.00 C ATOM 853 CD2 LEU A 54 4.856 -11.024 -1.487 1.00 0.00 C ATOM 0 H LEU A 54 8.690 -9.612 0.605 1.00 0.00 H new ATOM 0 HA LEU A 54 5.881 -10.132 0.423 1.00 0.00 H new ATOM 0 HB2 LEU A 54 8.232 -10.416 -1.180 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.519 -12.014 -1.078 1.00 0.00 H new ATOM 0 HG LEU A 54 6.213 -9.444 -2.047 1.00 0.00 H new ATOM 0 HD11 LEU A 54 5.749 -10.844 -4.045 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.492 -10.795 -3.687 1.00 0.00 H new ATOM 0 HD13 LEU A 54 6.535 -12.231 -3.252 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.089 -10.724 -2.200 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.869 -12.111 -1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 54 4.635 -10.589 -0.512 1.00 0.00 H new ATOM 865 N GLN A 55 7.757 -12.715 1.299 1.00 0.00 N ATOM 866 CA GLN A 55 7.702 -14.005 2.035 1.00 0.00 C ATOM 867 C GLN A 55 7.873 -13.745 3.532 1.00 0.00 C ATOM 868 O GLN A 55 7.452 -14.529 4.360 1.00 0.00 O ATOM 869 CB GLN A 55 8.825 -14.919 1.538 1.00 0.00 C ATOM 870 CG GLN A 55 8.935 -14.800 0.015 1.00 0.00 C ATOM 871 CD GLN A 55 9.912 -15.851 -0.516 1.00 0.00 C ATOM 872 OE1 GLN A 55 9.631 -17.032 -0.477 1.00 0.00 O ATOM 873 NE2 GLN A 55 11.053 -15.467 -1.016 1.00 0.00 N ATOM 0 H GLN A 55 8.660 -12.493 0.879 1.00 0.00 H new ATOM 0 HA GLN A 55 6.739 -14.486 1.861 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.770 -14.641 2.006 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.621 -15.952 1.820 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.955 -14.937 -0.442 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.277 -13.801 -0.258 1.00 0.00 H new ATOM 0 HE21 GLN A 55 11.288 -14.475 -1.048 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.711 -16.159 -1.375 1.00 0.00 H new ATOM 882 N GLU A 56 8.494 -12.652 3.887 1.00 0.00 N ATOM 883 CA GLU A 56 8.700 -12.346 5.333 1.00 0.00 C ATOM 884 C GLU A 56 7.438 -11.716 5.943 1.00 0.00 C ATOM 885 O GLU A 56 7.522 -10.917 6.856 1.00 0.00 O ATOM 886 CB GLU A 56 9.873 -11.376 5.480 1.00 0.00 C ATOM 887 CG GLU A 56 11.102 -11.956 4.779 1.00 0.00 C ATOM 888 CD GLU A 56 12.089 -12.479 5.824 1.00 0.00 C ATOM 889 OE1 GLU A 56 12.030 -12.013 6.950 1.00 0.00 O ATOM 890 OE2 GLU A 56 12.889 -13.334 5.480 1.00 0.00 O ATOM 0 H GLU A 56 8.867 -11.958 3.239 1.00 0.00 H new ATOM 0 HA GLU A 56 8.913 -13.276 5.860 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.616 -10.409 5.047 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.089 -11.206 6.535 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.804 -12.763 4.109 1.00 0.00 H new ATOM 0 HG3 GLU A 56 11.578 -11.191 4.165 1.00 0.00 H new ATOM 897 N GLU A 57 6.270 -12.061 5.462 1.00 0.00 N ATOM 898 CA GLU A 57 5.028 -11.466 6.038 1.00 0.00 C ATOM 899 C GLU A 57 3.872 -12.476 5.943 1.00 0.00 C ATOM 900 O GLU A 57 3.364 -12.938 6.945 1.00 0.00 O ATOM 901 CB GLU A 57 4.672 -10.195 5.268 1.00 0.00 C ATOM 902 CG GLU A 57 5.343 -8.989 5.931 1.00 0.00 C ATOM 903 CD GLU A 57 4.275 -8.086 6.554 1.00 0.00 C ATOM 904 OE1 GLU A 57 3.924 -8.318 7.699 1.00 0.00 O ATOM 905 OE2 GLU A 57 3.827 -7.177 5.875 1.00 0.00 O ATOM 0 H GLU A 57 6.124 -12.724 4.701 1.00 0.00 H new ATOM 0 HA GLU A 57 5.196 -11.220 7.086 1.00 0.00 H new ATOM 0 HB2 GLU A 57 4.999 -10.282 4.232 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.591 -10.059 5.251 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.042 -9.325 6.697 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.921 -8.431 5.194 1.00 0.00 H new ATOM 912 N VAL A 58 3.467 -12.838 4.752 1.00 0.00 N ATOM 913 CA VAL A 58 2.362 -13.838 4.615 1.00 0.00 C ATOM 914 C VAL A 58 2.908 -15.056 3.872 1.00 0.00 C ATOM 915 O VAL A 58 2.550 -16.185 4.145 1.00 0.00 O ATOM 916 CB VAL A 58 1.160 -13.255 3.826 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.990 -11.770 4.102 1.00 0.00 C ATOM 918 CG2 VAL A 58 1.365 -13.444 2.326 1.00 0.00 C ATOM 0 H VAL A 58 3.850 -12.488 3.874 1.00 0.00 H new ATOM 0 HA VAL A 58 2.009 -14.110 5.610 1.00 0.00 H new ATOM 0 HB VAL A 58 0.268 -13.789 4.154 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.140 -11.390 3.535 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.815 -11.616 5.167 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.893 -11.238 3.802 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.513 -13.030 1.787 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.275 -12.931 2.016 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.454 -14.507 2.102 1.00 0.00 H new ATOM 928 N GLY A 59 3.768 -14.823 2.919 1.00 0.00 N ATOM 929 CA GLY A 59 4.338 -15.940 2.134 1.00 0.00 C ATOM 930 C GLY A 59 3.447 -16.204 0.921 1.00 0.00 C ATOM 931 O GLY A 59 2.984 -17.307 0.711 1.00 0.00 O ATOM 0 H GLY A 59 4.100 -13.896 2.653 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.350 -15.695 1.811 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.408 -16.836 2.751 1.00 0.00 H new ATOM 935 N ILE A 60 3.198 -15.200 0.118 1.00 0.00 N ATOM 936 CA ILE A 60 2.329 -15.422 -1.075 1.00 0.00 C ATOM 937 C ILE A 60 3.154 -16.024 -2.213 1.00 0.00 C ATOM 938 O ILE A 60 4.339 -16.269 -2.092 1.00 0.00 O ATOM 939 CB ILE A 60 1.673 -14.115 -1.573 1.00 0.00 C ATOM 940 CG1 ILE A 60 2.181 -12.890 -0.801 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.160 -14.218 -1.409 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.655 -11.617 -1.468 1.00 0.00 C ATOM 0 H ILE A 60 3.553 -14.251 0.235 1.00 0.00 H new ATOM 0 HA ILE A 60 1.536 -16.106 -0.771 1.00 0.00 H new ATOM 0 HB ILE A 60 1.939 -13.985 -2.622 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.847 -12.935 0.236 1.00 0.00 H new ATOM 0 HG13 ILE A 60 3.271 -12.882 -0.785 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.307 -13.298 -1.759 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.213 -15.059 -1.993 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.082 -14.371 -0.357 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.014 -10.745 -0.922 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.010 -11.572 -2.497 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.565 -11.626 -1.461 1.00 0.00 H new ATOM 954 N THR A 61 2.513 -16.253 -3.320 1.00 0.00 N ATOM 955 CA THR A 61 3.189 -16.833 -4.516 1.00 0.00 C ATOM 956 C THR A 61 2.723 -16.026 -5.729 1.00 0.00 C ATOM 957 O THR A 61 2.118 -16.559 -6.638 1.00 0.00 O ATOM 958 CB THR A 61 2.701 -18.253 -4.683 1.00 0.00 C ATOM 959 OG1 THR A 61 3.318 -18.846 -5.818 1.00 0.00 O ATOM 960 CG2 THR A 61 1.199 -18.165 -4.882 1.00 0.00 C ATOM 0 H THR A 61 1.521 -16.058 -3.452 1.00 0.00 H new ATOM 0 HA THR A 61 4.274 -16.810 -4.414 1.00 0.00 H new ATOM 0 HB THR A 61 2.947 -18.867 -3.817 1.00 0.00 H new ATOM 0 HG1 THR A 61 3.117 -18.313 -6.615 1.00 0.00 H new ATOM 0 HG21 THR A 61 0.789 -19.167 -5.009 1.00 0.00 H new ATOM 0 HG22 THR A 61 0.743 -17.694 -4.011 1.00 0.00 H new ATOM 0 HG23 THR A 61 0.984 -17.570 -5.770 1.00 0.00 H new ATOM 968 N PRO A 62 2.968 -14.761 -5.673 1.00 0.00 N ATOM 969 CA PRO A 62 2.531 -13.831 -6.717 1.00 0.00 C ATOM 970 C PRO A 62 3.005 -14.285 -8.086 1.00 0.00 C ATOM 971 O PRO A 62 4.162 -14.587 -8.300 1.00 0.00 O ATOM 972 CB PRO A 62 3.129 -12.489 -6.319 1.00 0.00 C ATOM 973 CG PRO A 62 3.892 -12.706 -4.991 1.00 0.00 C ATOM 974 CD PRO A 62 3.727 -14.156 -4.581 1.00 0.00 C ATOM 0 HA PRO A 62 1.445 -13.774 -6.795 1.00 0.00 H new ATOM 0 HB2 PRO A 62 3.802 -12.122 -7.094 1.00 0.00 H new ATOM 0 HB3 PRO A 62 2.347 -11.740 -6.196 1.00 0.00 H new ATOM 0 HG2 PRO A 62 4.947 -12.464 -5.115 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.502 -12.045 -4.216 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.693 -14.644 -4.451 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.196 -14.242 -3.633 1.00 0.00 H new ATOM 982 N GLN A 63 2.096 -14.344 -9.007 1.00 0.00 N ATOM 983 CA GLN A 63 2.438 -14.790 -10.375 1.00 0.00 C ATOM 984 C GLN A 63 3.051 -13.624 -11.153 1.00 0.00 C ATOM 985 O GLN A 63 4.027 -13.792 -11.856 1.00 0.00 O ATOM 986 CB GLN A 63 1.167 -15.284 -11.071 1.00 0.00 C ATOM 987 CG GLN A 63 0.175 -15.809 -10.022 1.00 0.00 C ATOM 988 CD GLN A 63 -0.756 -16.834 -10.671 1.00 0.00 C ATOM 989 OE1 GLN A 63 -1.959 -16.763 -10.518 1.00 0.00 O ATOM 990 NE2 GLN A 63 -0.245 -17.793 -11.394 1.00 0.00 N ATOM 0 H GLN A 63 1.116 -14.098 -8.868 1.00 0.00 H new ATOM 0 HA GLN A 63 3.163 -15.603 -10.333 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.714 -14.473 -11.641 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.413 -16.074 -11.781 1.00 0.00 H new ATOM 0 HG2 GLN A 63 0.714 -16.266 -9.192 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.406 -14.984 -9.610 1.00 0.00 H new ATOM 0 HE21 GLN A 63 0.765 -17.852 -11.522 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.856 -18.483 -11.831 1.00 0.00 H new ATOM 999 N HIS A 64 2.500 -12.440 -11.042 1.00 0.00 N ATOM 1000 CA HIS A 64 3.095 -11.301 -11.796 1.00 0.00 C ATOM 1001 C HIS A 64 2.651 -9.959 -11.205 1.00 0.00 C ATOM 1002 O HIS A 64 1.492 -9.600 -11.257 1.00 0.00 O ATOM 1003 CB HIS A 64 2.645 -11.383 -13.254 1.00 0.00 C ATOM 1004 CG HIS A 64 3.789 -11.005 -14.150 1.00 0.00 C ATOM 1005 ND1 HIS A 64 3.812 -11.336 -15.495 1.00 0.00 N ATOM 1006 CD2 HIS A 64 4.961 -10.333 -13.908 1.00 0.00 C ATOM 1007 CE1 HIS A 64 4.965 -10.867 -16.008 1.00 0.00 C ATOM 1008 NE2 HIS A 64 5.702 -10.247 -15.083 1.00 0.00 N ATOM 0 H HIS A 64 1.682 -12.218 -10.474 1.00 0.00 H new ATOM 0 HA HIS A 64 4.181 -11.365 -11.727 1.00 0.00 H new ATOM 0 HB2 HIS A 64 2.306 -12.393 -13.485 1.00 0.00 H new ATOM 0 HB3 HIS A 64 1.800 -10.716 -13.424 1.00 0.00 H new ATOM 0 HD2 HIS A 64 5.262 -9.932 -12.952 1.00 0.00 H new ATOM 0 HE1 HIS A 64 5.258 -10.979 -17.041 1.00 0.00 H new ATOM 0 HE2 HIS A 64 6.613 -9.805 -15.210 1.00 0.00 H new ATOM 1016 N PHE A 65 3.575 -9.203 -10.666 1.00 0.00 N ATOM 1017 CA PHE A 65 3.217 -7.871 -10.100 1.00 0.00 C ATOM 1018 C PHE A 65 4.038 -6.792 -10.804 1.00 0.00 C ATOM 1019 O PHE A 65 4.864 -7.078 -11.646 1.00 0.00 O ATOM 1020 CB PHE A 65 3.521 -7.825 -8.602 1.00 0.00 C ATOM 1021 CG PHE A 65 4.818 -8.547 -8.315 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.029 -8.019 -8.781 1.00 0.00 C ATOM 1023 CD2 PHE A 65 4.813 -9.736 -7.576 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.233 -8.680 -8.508 1.00 0.00 C ATOM 1025 CE2 PHE A 65 6.017 -10.398 -7.304 1.00 0.00 C ATOM 1026 CZ PHE A 65 7.226 -9.869 -7.770 1.00 0.00 C ATOM 0 H PHE A 65 4.561 -9.453 -10.595 1.00 0.00 H new ATOM 0 HA PHE A 65 2.151 -7.700 -10.252 1.00 0.00 H new ATOM 0 HB2 PHE A 65 3.590 -6.790 -8.268 1.00 0.00 H new ATOM 0 HB3 PHE A 65 2.707 -8.286 -8.043 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.034 -7.102 -9.351 1.00 0.00 H new ATOM 0 HD2 PHE A 65 3.880 -10.143 -7.215 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.167 -8.272 -8.867 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.012 -11.316 -6.735 1.00 0.00 H new ATOM 0 HZ PHE A 65 8.155 -10.379 -7.560 1.00 0.00 H new ATOM 1036 N SER A 66 3.821 -5.555 -10.461 1.00 0.00 N ATOM 1037 CA SER A 66 4.596 -4.459 -11.112 1.00 0.00 C ATOM 1038 C SER A 66 4.516 -3.200 -10.252 1.00 0.00 C ATOM 1039 O SER A 66 3.615 -3.045 -9.451 1.00 0.00 O ATOM 1040 CB SER A 66 4.012 -4.168 -12.494 1.00 0.00 C ATOM 1041 OG SER A 66 4.695 -4.951 -13.466 1.00 0.00 O ATOM 0 H SER A 66 3.143 -5.253 -9.761 1.00 0.00 H new ATOM 0 HA SER A 66 5.637 -4.765 -11.216 1.00 0.00 H new ATOM 0 HB2 SER A 66 2.947 -4.398 -12.507 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.112 -3.108 -12.728 1.00 0.00 H new ATOM 0 HG SER A 66 4.908 -5.830 -13.088 1.00 0.00 H new ATOM 1047 N LEU A 67 5.439 -2.288 -10.408 1.00 0.00 N ATOM 1048 CA LEU A 67 5.373 -1.051 -9.590 1.00 0.00 C ATOM 1049 C LEU A 67 4.450 -0.043 -10.264 1.00 0.00 C ATOM 1050 O LEU A 67 4.854 0.694 -11.141 1.00 0.00 O ATOM 1051 CB LEU A 67 6.756 -0.426 -9.424 1.00 0.00 C ATOM 1052 CG LEU A 67 6.633 0.792 -8.503 1.00 0.00 C ATOM 1053 CD1 LEU A 67 6.058 0.357 -7.152 1.00 0.00 C ATOM 1054 CD2 LEU A 67 8.013 1.421 -8.293 1.00 0.00 C ATOM 0 H LEU A 67 6.223 -2.347 -11.057 1.00 0.00 H new ATOM 0 HA LEU A 67 4.989 -1.316 -8.605 1.00 0.00 H new ATOM 0 HB2 LEU A 67 7.451 -1.152 -9.001 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.156 -0.129 -10.393 1.00 0.00 H new ATOM 0 HG LEU A 67 5.969 1.525 -8.961 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.971 1.224 -6.497 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.073 -0.085 -7.301 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.720 -0.378 -6.694 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.922 2.287 -7.637 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.681 0.690 -7.838 1.00 0.00 H new ATOM 0 HD23 LEU A 67 8.420 1.735 -9.254 1.00 0.00 H new ATOM 1066 N PHE A 68 3.217 -0.002 -9.851 1.00 0.00 N ATOM 1067 CA PHE A 68 2.254 0.964 -10.444 1.00 0.00 C ATOM 1068 C PHE A 68 2.953 2.311 -10.627 1.00 0.00 C ATOM 1069 O PHE A 68 3.319 2.700 -11.718 1.00 0.00 O ATOM 1070 CB PHE A 68 1.065 1.108 -9.478 1.00 0.00 C ATOM 1071 CG PHE A 68 0.536 2.525 -9.467 1.00 0.00 C ATOM 1072 CD1 PHE A 68 0.291 3.194 -10.672 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.315 3.173 -8.249 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -0.180 4.511 -10.654 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.151 4.489 -8.232 1.00 0.00 C ATOM 1076 CZ PHE A 68 -0.399 5.158 -9.432 1.00 0.00 C ATOM 0 H PHE A 68 2.831 -0.601 -9.122 1.00 0.00 H new ATOM 0 HA PHE A 68 1.899 0.616 -11.414 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.270 0.423 -9.772 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.374 0.825 -8.472 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.465 2.694 -11.614 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.505 2.656 -7.320 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.375 5.028 -11.582 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.320 4.990 -7.290 1.00 0.00 H new ATOM 0 HZ PHE A 68 -0.760 6.176 -9.418 1.00 0.00 H new ATOM 1086 N GLU A 69 3.125 3.021 -9.554 1.00 0.00 N ATOM 1087 CA GLU A 69 3.789 4.354 -9.627 1.00 0.00 C ATOM 1088 C GLU A 69 4.059 4.865 -8.209 1.00 0.00 C ATOM 1089 O GLU A 69 3.175 4.918 -7.378 1.00 0.00 O ATOM 1090 CB GLU A 69 2.874 5.341 -10.356 1.00 0.00 C ATOM 1091 CG GLU A 69 3.687 6.555 -10.809 1.00 0.00 C ATOM 1092 CD GLU A 69 4.429 6.222 -12.105 1.00 0.00 C ATOM 1093 OE1 GLU A 69 4.739 5.058 -12.306 1.00 0.00 O ATOM 1094 OE2 GLU A 69 4.676 7.135 -12.876 1.00 0.00 O ATOM 0 H GLU A 69 2.833 2.736 -8.619 1.00 0.00 H new ATOM 0 HA GLU A 69 4.730 4.262 -10.169 1.00 0.00 H new ATOM 0 HB2 GLU A 69 2.413 4.857 -11.217 1.00 0.00 H new ATOM 0 HB3 GLU A 69 2.065 5.657 -9.697 1.00 0.00 H new ATOM 0 HG2 GLU A 69 3.028 7.409 -10.965 1.00 0.00 H new ATOM 0 HG3 GLU A 69 4.398 6.839 -10.033 1.00 0.00 H new ATOM 1101 N LYS A 70 5.279 5.230 -7.926 1.00 0.00 N ATOM 1102 CA LYS A 70 5.622 5.724 -6.576 1.00 0.00 C ATOM 1103 C LYS A 70 5.424 7.240 -6.506 1.00 0.00 C ATOM 1104 O LYS A 70 5.527 7.937 -7.496 1.00 0.00 O ATOM 1105 CB LYS A 70 7.086 5.398 -6.318 1.00 0.00 C ATOM 1106 CG LYS A 70 7.925 5.894 -7.496 1.00 0.00 C ATOM 1107 CD LYS A 70 9.392 6.000 -7.075 1.00 0.00 C ATOM 1108 CE LYS A 70 10.006 4.602 -6.994 1.00 0.00 C ATOM 1109 NZ LYS A 70 11.428 4.656 -7.439 1.00 0.00 N ATOM 0 H LYS A 70 6.057 5.204 -8.585 1.00 0.00 H new ATOM 0 HA LYS A 70 4.981 5.252 -5.831 1.00 0.00 H new ATOM 0 HB2 LYS A 70 7.419 5.871 -5.394 1.00 0.00 H new ATOM 0 HB3 LYS A 70 7.215 4.323 -6.191 1.00 0.00 H new ATOM 0 HG2 LYS A 70 7.827 5.210 -8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.561 6.866 -7.831 1.00 0.00 H new ATOM 0 HD2 LYS A 70 9.943 6.609 -7.792 1.00 0.00 H new ATOM 0 HD3 LYS A 70 9.468 6.498 -6.108 1.00 0.00 H new ATOM 0 HE2 LYS A 70 9.948 4.226 -5.972 1.00 0.00 H new ATOM 0 HE3 LYS A 70 9.444 3.910 -7.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 11.845 3.705 -7.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 11.472 4.997 -8.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 11.960 5.304 -6.823 1.00 0.00 H new ATOM 1123 N LEU A 71 5.162 7.756 -5.338 1.00 0.00 N ATOM 1124 CA LEU A 71 4.981 9.229 -5.196 1.00 0.00 C ATOM 1125 C LEU A 71 5.898 9.740 -4.093 1.00 0.00 C ATOM 1126 O LEU A 71 6.894 9.127 -3.762 1.00 0.00 O ATOM 1127 CB LEU A 71 3.523 9.563 -4.854 1.00 0.00 C ATOM 1128 CG LEU A 71 3.221 9.248 -3.386 1.00 0.00 C ATOM 1129 CD1 LEU A 71 2.708 10.512 -2.700 1.00 0.00 C ATOM 1130 CD2 LEU A 71 2.136 8.173 -3.297 1.00 0.00 C ATOM 0 H LEU A 71 5.065 7.222 -4.475 1.00 0.00 H new ATOM 0 HA LEU A 71 5.232 9.711 -6.141 1.00 0.00 H new ATOM 0 HB2 LEU A 71 3.331 10.618 -5.051 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.854 8.992 -5.498 1.00 0.00 H new ATOM 0 HG LEU A 71 4.131 8.893 -2.902 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.491 10.296 -1.654 1.00 0.00 H new ATOM 0 HD12 LEU A 71 3.467 11.292 -2.759 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.799 10.852 -3.197 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.926 7.954 -2.250 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.228 8.532 -3.782 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.480 7.267 -3.796 1.00 0.00 H new ATOM 1142 N GLU A 72 5.575 10.861 -3.524 1.00 0.00 N ATOM 1143 CA GLU A 72 6.440 11.411 -2.441 1.00 0.00 C ATOM 1144 C GLU A 72 5.666 12.437 -1.611 1.00 0.00 C ATOM 1145 O GLU A 72 4.625 12.922 -2.009 1.00 0.00 O ATOM 1146 CB GLU A 72 7.664 12.085 -3.065 1.00 0.00 C ATOM 1147 CG GLU A 72 8.871 11.150 -2.963 1.00 0.00 C ATOM 1148 CD GLU A 72 9.717 11.268 -4.233 1.00 0.00 C ATOM 1149 OE1 GLU A 72 9.433 10.552 -5.179 1.00 0.00 O ATOM 1150 OE2 GLU A 72 10.635 12.072 -4.238 1.00 0.00 O ATOM 0 H GLU A 72 4.755 11.421 -3.757 1.00 0.00 H new ATOM 0 HA GLU A 72 6.755 10.595 -1.791 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.466 12.327 -4.109 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.875 13.025 -2.554 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.470 11.406 -2.089 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.537 10.121 -2.830 1.00 0.00 H new ATOM 1157 N TYR A 73 6.183 12.778 -0.461 1.00 0.00 N ATOM 1158 CA TYR A 73 5.502 13.780 0.407 1.00 0.00 C ATOM 1159 C TYR A 73 6.547 14.484 1.278 1.00 0.00 C ATOM 1160 O TYR A 73 7.715 14.149 1.255 1.00 0.00 O ATOM 1161 CB TYR A 73 4.481 13.080 1.305 1.00 0.00 C ATOM 1162 CG TYR A 73 3.255 13.951 1.437 1.00 0.00 C ATOM 1163 CD1 TYR A 73 2.547 14.340 0.294 1.00 0.00 C ATOM 1164 CD2 TYR A 73 2.826 14.373 2.703 1.00 0.00 C ATOM 1165 CE1 TYR A 73 1.412 15.149 0.414 1.00 0.00 C ATOM 1166 CE2 TYR A 73 1.690 15.183 2.823 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.982 15.571 1.678 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.138 16.367 1.795 1.00 0.00 O ATOM 0 H TYR A 73 7.053 12.403 -0.084 1.00 0.00 H new ATOM 0 HA TYR A 73 4.988 14.511 -0.218 1.00 0.00 H new ATOM 0 HB2 TYR A 73 4.210 12.112 0.882 1.00 0.00 H new ATOM 0 HB3 TYR A 73 4.913 12.889 2.287 1.00 0.00 H new ATOM 0 HD1 TYR A 73 2.877 14.015 -0.682 1.00 0.00 H new ATOM 0 HD2 TYR A 73 3.371 14.073 3.586 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.867 15.448 -0.469 1.00 0.00 H new ATOM 0 HE2 TYR A 73 1.360 15.509 3.798 1.00 0.00 H new ATOM 0 HH TYR A 73 -0.299 16.568 2.740 1.00 0.00 H new ATOM 1178 N GLU A 74 6.140 15.463 2.039 1.00 0.00 N ATOM 1179 CA GLU A 74 7.111 16.192 2.902 1.00 0.00 C ATOM 1180 C GLU A 74 6.363 16.921 4.014 1.00 0.00 C ATOM 1181 O GLU A 74 5.683 17.900 3.782 1.00 0.00 O ATOM 1182 CB GLU A 74 7.869 17.208 2.051 1.00 0.00 C ATOM 1183 CG GLU A 74 9.255 17.441 2.648 1.00 0.00 C ATOM 1184 CD GLU A 74 9.326 18.850 3.238 1.00 0.00 C ATOM 1185 OE1 GLU A 74 8.323 19.299 3.769 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.381 19.456 3.148 1.00 0.00 O ATOM 0 H GLU A 74 5.176 15.790 2.100 1.00 0.00 H new ATOM 0 HA GLU A 74 7.811 15.483 3.344 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.959 16.845 1.027 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.317 18.147 2.009 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.459 16.701 3.422 1.00 0.00 H new ATOM 0 HG3 GLU A 74 10.019 17.318 1.880 1.00 0.00 H new ATOM 1193 N PHE A 75 6.496 16.459 5.223 1.00 0.00 N ATOM 1194 CA PHE A 75 5.810 17.132 6.354 1.00 0.00 C ATOM 1195 C PHE A 75 6.626 18.361 6.753 1.00 0.00 C ATOM 1196 O PHE A 75 7.678 18.605 6.193 1.00 0.00 O ATOM 1197 CB PHE A 75 5.727 16.166 7.537 1.00 0.00 C ATOM 1198 CG PHE A 75 4.289 15.767 7.768 1.00 0.00 C ATOM 1199 CD1 PHE A 75 3.532 15.239 6.715 1.00 0.00 C ATOM 1200 CD2 PHE A 75 3.713 15.919 9.035 1.00 0.00 C ATOM 1201 CE1 PHE A 75 2.200 14.863 6.930 1.00 0.00 C ATOM 1202 CE2 PHE A 75 2.382 15.544 9.250 1.00 0.00 C ATOM 1203 CZ PHE A 75 1.625 15.014 8.198 1.00 0.00 C ATOM 0 H PHE A 75 7.052 15.642 5.476 1.00 0.00 H new ATOM 0 HA PHE A 75 4.803 17.432 6.063 1.00 0.00 H new ATOM 0 HB2 PHE A 75 6.333 15.282 7.340 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.132 16.637 8.433 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.975 15.122 5.737 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.297 16.326 9.847 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.616 14.456 6.118 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.939 15.663 10.228 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.599 14.722 8.364 1.00 0.00 H new ATOM 1213 N PRO A 76 6.122 19.102 7.706 1.00 0.00 N ATOM 1214 CA PRO A 76 6.795 20.316 8.206 1.00 0.00 C ATOM 1215 C PRO A 76 8.007 19.962 9.087 1.00 0.00 C ATOM 1216 O PRO A 76 8.337 20.685 10.007 1.00 0.00 O ATOM 1217 CB PRO A 76 5.728 21.022 9.053 1.00 0.00 C ATOM 1218 CG PRO A 76 4.522 20.055 9.189 1.00 0.00 C ATOM 1219 CD PRO A 76 4.828 18.808 8.346 1.00 0.00 C ATOM 0 HA PRO A 76 7.174 20.932 7.390 1.00 0.00 H new ATOM 0 HB2 PRO A 76 6.126 21.278 10.035 1.00 0.00 H new ATOM 0 HB3 PRO A 76 5.420 21.955 8.581 1.00 0.00 H new ATOM 0 HG2 PRO A 76 4.366 19.782 10.233 1.00 0.00 H new ATOM 0 HG3 PRO A 76 3.606 20.535 8.844 1.00 0.00 H new ATOM 0 HD2 PRO A 76 4.887 17.914 8.967 1.00 0.00 H new ATOM 0 HD3 PRO A 76 4.050 18.630 7.604 1.00 0.00 H new ATOM 1227 N ASP A 77 8.677 18.866 8.829 1.00 0.00 N ATOM 1228 CA ASP A 77 9.846 18.506 9.666 1.00 0.00 C ATOM 1229 C ASP A 77 10.737 17.513 8.924 1.00 0.00 C ATOM 1230 O ASP A 77 11.948 17.569 9.006 1.00 0.00 O ATOM 1231 CB ASP A 77 9.363 17.878 10.975 1.00 0.00 C ATOM 1232 CG ASP A 77 9.973 18.632 12.159 1.00 0.00 C ATOM 1233 OD1 ASP A 77 9.871 19.847 12.178 1.00 0.00 O ATOM 1234 OD2 ASP A 77 10.529 17.980 13.027 1.00 0.00 O ATOM 0 H ASP A 77 8.461 18.212 8.077 1.00 0.00 H new ATOM 0 HA ASP A 77 10.420 19.407 9.881 1.00 0.00 H new ATOM 0 HB2 ASP A 77 8.275 17.915 11.029 1.00 0.00 H new ATOM 0 HB3 ASP A 77 9.649 16.827 11.014 1.00 0.00 H new ATOM 1239 N ARG A 78 10.149 16.591 8.224 1.00 0.00 N ATOM 1240 CA ARG A 78 10.948 15.584 7.509 1.00 0.00 C ATOM 1241 C ARG A 78 10.398 15.375 6.097 1.00 0.00 C ATOM 1242 O ARG A 78 9.456 16.018 5.680 1.00 0.00 O ATOM 1243 CB ARG A 78 10.861 14.272 8.273 1.00 0.00 C ATOM 1244 CG ARG A 78 9.506 14.138 8.984 1.00 0.00 C ATOM 1245 CD ARG A 78 9.632 13.118 10.117 1.00 0.00 C ATOM 1246 NE ARG A 78 8.501 13.297 11.073 1.00 0.00 N ATOM 1247 CZ ARG A 78 8.255 12.385 11.976 1.00 0.00 C ATOM 1248 NH1 ARG A 78 8.457 11.124 11.707 1.00 0.00 N ATOM 1249 NH2 ARG A 78 7.806 12.737 13.151 1.00 0.00 N ATOM 0 H ARG A 78 9.139 16.496 8.119 1.00 0.00 H new ATOM 0 HA ARG A 78 11.982 15.923 7.439 1.00 0.00 H new ATOM 0 HB2 ARG A 78 10.999 13.437 7.586 1.00 0.00 H new ATOM 0 HB3 ARG A 78 11.667 14.219 9.005 1.00 0.00 H new ATOM 0 HG2 ARG A 78 9.193 15.104 9.381 1.00 0.00 H new ATOM 0 HG3 ARG A 78 8.740 13.821 8.276 1.00 0.00 H new ATOM 0 HD2 ARG A 78 9.624 12.106 9.712 1.00 0.00 H new ATOM 0 HD3 ARG A 78 10.583 13.247 10.633 1.00 0.00 H new ATOM 0 HE ARG A 78 7.919 14.133 11.022 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.808 10.848 10.790 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.264 10.414 12.414 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.648 13.722 13.362 1.00 0.00 H new ATOM 0 HH22 ARG A 78 7.613 12.027 13.857 1.00 0.00 H new ATOM 1263 N HIS A 79 10.980 14.464 5.367 1.00 0.00 N ATOM 1264 CA HIS A 79 10.500 14.187 3.986 1.00 0.00 C ATOM 1265 C HIS A 79 9.913 12.776 3.942 1.00 0.00 C ATOM 1266 O HIS A 79 10.548 11.818 4.337 1.00 0.00 O ATOM 1267 CB HIS A 79 11.671 14.289 3.006 1.00 0.00 C ATOM 1268 CG HIS A 79 12.600 15.388 3.447 1.00 0.00 C ATOM 1269 ND1 HIS A 79 12.368 16.689 3.825 1.00 0.00 N flip ATOM 1270 CD2 HIS A 79 13.971 15.207 3.538 1.00 0.00 C flip ATOM 1271 CE1 HIS A 79 13.575 17.304 4.147 1.00 0.00 C flip ATOM 1272 NE2 HIS A 79 14.507 16.367 3.957 1.00 0.00 N flip ATOM 0 H HIS A 79 11.772 13.897 5.670 1.00 0.00 H new ATOM 0 HA HIS A 79 9.737 14.913 3.705 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.207 13.341 2.963 1.00 0.00 H new ATOM 0 HB3 HIS A 79 11.301 14.492 2.001 1.00 0.00 H new ATOM 0 HD1 HIS A 79 11.452 17.136 3.864 1.00 0.00 H new ATOM 0 HD2 HIS A 79 14.511 14.299 3.313 1.00 0.00 H new ATOM 0 HE1 HIS A 79 13.725 18.321 4.479 1.00 0.00 H new ATOM 1280 N ILE A 80 8.704 12.638 3.476 1.00 0.00 N ATOM 1281 CA ILE A 80 8.085 11.285 3.423 1.00 0.00 C ATOM 1282 C ILE A 80 8.306 10.672 2.039 1.00 0.00 C ATOM 1283 O ILE A 80 8.377 11.362 1.043 1.00 0.00 O ATOM 1284 CB ILE A 80 6.582 11.389 3.697 1.00 0.00 C ATOM 1285 CG1 ILE A 80 6.300 12.601 4.591 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.105 10.118 4.405 1.00 0.00 C ATOM 1287 CD1 ILE A 80 7.130 12.498 5.872 1.00 0.00 C ATOM 0 H ILE A 80 8.120 13.400 3.131 1.00 0.00 H new ATOM 0 HA ILE A 80 8.548 10.653 4.181 1.00 0.00 H new ATOM 0 HB ILE A 80 6.052 11.506 2.752 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.544 13.521 4.061 1.00 0.00 H new ATOM 0 HG13 ILE A 80 5.239 12.646 4.836 1.00 0.00 H new ATOM 0 HG21 ILE A 80 5.035 10.190 4.601 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.300 9.253 3.771 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.640 10.004 5.348 1.00 0.00 H new ATOM 0 HD11 ILE A 80 6.928 13.361 6.507 1.00 0.00 H new ATOM 0 HD12 ILE A 80 6.864 11.585 6.405 1.00 0.00 H new ATOM 0 HD13 ILE A 80 8.190 12.474 5.618 1.00 0.00 H new ATOM 1299 N THR A 81 8.410 9.374 1.972 1.00 0.00 N ATOM 1300 CA THR A 81 8.618 8.704 0.659 1.00 0.00 C ATOM 1301 C THR A 81 8.144 7.254 0.773 1.00 0.00 C ATOM 1302 O THR A 81 8.770 6.436 1.418 1.00 0.00 O ATOM 1303 CB THR A 81 10.105 8.737 0.297 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.503 10.083 0.074 1.00 0.00 O ATOM 1305 CG2 THR A 81 10.343 7.915 -0.971 1.00 0.00 C ATOM 0 H THR A 81 8.360 8.746 2.774 1.00 0.00 H new ATOM 0 HA THR A 81 8.054 9.219 -0.119 1.00 0.00 H new ATOM 0 HB THR A 81 10.689 8.314 1.114 1.00 0.00 H new ATOM 0 HG1 THR A 81 9.712 10.661 0.064 1.00 0.00 H new ATOM 0 HG21 THR A 81 11.402 7.940 -1.227 1.00 0.00 H new ATOM 0 HG22 THR A 81 10.035 6.884 -0.799 1.00 0.00 H new ATOM 0 HG23 THR A 81 9.761 8.335 -1.792 1.00 0.00 H new ATOM 1313 N LEU A 82 7.033 6.931 0.170 1.00 0.00 N ATOM 1314 CA LEU A 82 6.514 5.536 0.271 1.00 0.00 C ATOM 1315 C LEU A 82 6.031 5.054 -1.099 1.00 0.00 C ATOM 1316 O LEU A 82 5.262 5.718 -1.765 1.00 0.00 O ATOM 1317 CB LEU A 82 5.348 5.512 1.263 1.00 0.00 C ATOM 1318 CG LEU A 82 4.716 4.121 1.286 1.00 0.00 C ATOM 1319 CD1 LEU A 82 4.820 3.541 2.697 1.00 0.00 C ATOM 1320 CD2 LEU A 82 3.243 4.226 0.884 1.00 0.00 C ATOM 0 H LEU A 82 6.464 7.569 -0.386 1.00 0.00 H new ATOM 0 HA LEU A 82 7.310 4.876 0.615 1.00 0.00 H new ATOM 0 HB2 LEU A 82 5.701 5.778 2.260 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.603 6.255 0.980 1.00 0.00 H new ATOM 0 HG LEU A 82 5.238 3.470 0.585 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.370 2.548 2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 82 5.869 3.469 2.985 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.295 4.191 3.397 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.790 3.235 0.900 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.720 4.875 1.586 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.169 4.643 -0.120 1.00 0.00 H new ATOM 1332 N TRP A 83 6.478 3.900 -1.527 1.00 0.00 N ATOM 1333 CA TRP A 83 6.047 3.378 -2.848 1.00 0.00 C ATOM 1334 C TRP A 83 5.316 2.047 -2.674 1.00 0.00 C ATOM 1335 O TRP A 83 5.602 1.279 -1.777 1.00 0.00 O ATOM 1336 CB TRP A 83 7.267 3.142 -3.737 1.00 0.00 C ATOM 1337 CG TRP A 83 8.502 2.968 -2.913 1.00 0.00 C ATOM 1338 CD1 TRP A 83 8.740 1.927 -2.084 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.672 3.832 -2.835 1.00 0.00 C ATOM 1340 NE1 TRP A 83 9.988 2.093 -1.507 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.600 3.255 -1.936 1.00 0.00 C ATOM 1342 CE3 TRP A 83 10.016 5.047 -3.453 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.824 3.862 -1.658 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 11.248 5.663 -3.175 1.00 0.00 C ATOM 1345 CH2 TRP A 83 12.150 5.071 -2.280 1.00 0.00 C ATOM 0 H TRP A 83 7.124 3.300 -1.014 1.00 0.00 H new ATOM 0 HA TRP A 83 5.383 4.111 -3.307 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.108 2.256 -4.352 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.395 3.984 -4.417 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.068 1.102 -1.902 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.405 1.437 -0.846 1.00 0.00 H new ATOM 0 HE3 TRP A 83 9.329 5.510 -4.146 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.515 3.402 -0.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 11.501 6.598 -3.653 1.00 0.00 H new ATOM 0 HH2 TRP A 83 13.096 5.548 -2.071 1.00 0.00 H new ATOM 1356 N PHE A 84 4.383 1.766 -3.540 1.00 0.00 N ATOM 1357 CA PHE A 84 3.634 0.489 -3.458 1.00 0.00 C ATOM 1358 C PHE A 84 3.701 -0.193 -4.826 1.00 0.00 C ATOM 1359 O PHE A 84 3.308 0.377 -5.825 1.00 0.00 O ATOM 1360 CB PHE A 84 2.171 0.775 -3.111 1.00 0.00 C ATOM 1361 CG PHE A 84 1.819 2.203 -3.454 1.00 0.00 C ATOM 1362 CD1 PHE A 84 2.278 3.250 -2.649 1.00 0.00 C ATOM 1363 CD2 PHE A 84 1.033 2.478 -4.579 1.00 0.00 C ATOM 1364 CE1 PHE A 84 1.952 4.574 -2.968 1.00 0.00 C ATOM 1365 CE2 PHE A 84 0.707 3.800 -4.899 1.00 0.00 C ATOM 1366 CZ PHE A 84 1.166 4.847 -4.094 1.00 0.00 C ATOM 0 H PHE A 84 4.107 2.377 -4.309 1.00 0.00 H new ATOM 0 HA PHE A 84 4.067 -0.152 -2.690 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.521 0.092 -3.657 1.00 0.00 H new ATOM 0 HB3 PHE A 84 2.001 0.597 -2.049 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.884 3.038 -1.781 1.00 0.00 H new ATOM 0 HD2 PHE A 84 0.678 1.669 -5.200 1.00 0.00 H new ATOM 0 HE1 PHE A 84 2.306 5.383 -2.347 1.00 0.00 H new ATOM 0 HE2 PHE A 84 0.101 4.012 -5.767 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.914 5.868 -4.341 1.00 0.00 H new ATOM 1376 N TRP A 85 4.191 -1.401 -4.899 1.00 0.00 N ATOM 1377 CA TRP A 85 4.258 -2.066 -6.232 1.00 0.00 C ATOM 1378 C TRP A 85 2.971 -2.862 -6.463 1.00 0.00 C ATOM 1379 O TRP A 85 2.906 -4.059 -6.277 1.00 0.00 O ATOM 1380 CB TRP A 85 5.499 -2.971 -6.333 1.00 0.00 C ATOM 1381 CG TRP A 85 5.410 -4.119 -5.378 1.00 0.00 C ATOM 1382 CD1 TRP A 85 4.499 -4.248 -4.390 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.263 -5.298 -5.303 1.00 0.00 C ATOM 1384 NE1 TRP A 85 4.727 -5.439 -3.724 1.00 0.00 N ATOM 1385 CE2 TRP A 85 5.809 -6.117 -4.244 1.00 0.00 C ATOM 1386 CE3 TRP A 85 7.376 -5.732 -6.046 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 6.433 -7.325 -3.934 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 8.008 -6.947 -5.735 1.00 0.00 C ATOM 1389 CH2 TRP A 85 7.539 -7.740 -4.680 1.00 0.00 C ATOM 0 H TRP A 85 4.541 -1.947 -4.112 1.00 0.00 H new ATOM 0 HA TRP A 85 4.349 -1.307 -7.009 1.00 0.00 H new ATOM 0 HB2 TRP A 85 5.596 -3.348 -7.351 1.00 0.00 H new ATOM 0 HB3 TRP A 85 6.396 -2.388 -6.123 1.00 0.00 H new ATOM 0 HD1 TRP A 85 3.720 -3.537 -4.158 1.00 0.00 H new ATOM 0 HE1 TRP A 85 4.163 -5.775 -2.943 1.00 0.00 H new ATOM 0 HE3 TRP A 85 7.747 -5.127 -6.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 6.064 -7.935 -3.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 8.861 -7.272 -6.313 1.00 0.00 H new ATOM 0 HH2 TRP A 85 8.032 -8.671 -4.443 1.00 0.00 H new ATOM 1400 N LEU A 86 1.937 -2.185 -6.871 1.00 0.00 N ATOM 1401 CA LEU A 86 0.642 -2.853 -7.110 1.00 0.00 C ATOM 1402 C LEU A 86 0.856 -4.180 -7.828 1.00 0.00 C ATOM 1403 O LEU A 86 1.391 -4.231 -8.917 1.00 0.00 O ATOM 1404 CB LEU A 86 -0.221 -1.942 -7.986 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.134 -1.044 -7.137 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -1.661 -1.796 -5.921 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.351 0.181 -6.666 1.00 0.00 C ATOM 0 H LEU A 86 1.940 -1.181 -7.050 1.00 0.00 H new ATOM 0 HA LEU A 86 0.151 -3.044 -6.156 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.421 -1.322 -8.611 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -0.828 -2.550 -8.657 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.980 -0.737 -7.752 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.304 -1.138 -5.337 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.232 -2.664 -6.250 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.824 -2.125 -5.305 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.999 0.818 -6.064 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.501 -0.140 -6.067 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.005 0.740 -7.531 1.00 0.00 H new ATOM 1419 N VAL A 87 0.425 -5.255 -7.234 1.00 0.00 N ATOM 1420 CA VAL A 87 0.584 -6.570 -7.891 1.00 0.00 C ATOM 1421 C VAL A 87 -0.627 -6.812 -8.794 1.00 0.00 C ATOM 1422 O VAL A 87 -1.589 -6.070 -8.757 1.00 0.00 O ATOM 1423 CB VAL A 87 0.659 -7.650 -6.827 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.789 -7.336 -5.848 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.666 -7.711 -6.075 1.00 0.00 C ATOM 0 H VAL A 87 -0.030 -5.275 -6.321 1.00 0.00 H new ATOM 0 HA VAL A 87 1.496 -6.591 -8.487 1.00 0.00 H new ATOM 0 HB VAL A 87 0.855 -8.611 -7.302 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.838 -8.115 -5.087 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.736 -7.295 -6.386 1.00 0.00 H new ATOM 0 HG13 VAL A 87 1.601 -6.374 -5.371 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.615 -8.486 -5.310 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.861 -6.748 -5.603 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.470 -7.943 -6.773 1.00 0.00 H new ATOM 1435 N GLU A 88 -0.595 -7.826 -9.615 1.00 0.00 N ATOM 1436 CA GLU A 88 -1.758 -8.065 -10.517 1.00 0.00 C ATOM 1437 C GLU A 88 -2.342 -9.466 -10.304 1.00 0.00 C ATOM 1438 O GLU A 88 -3.472 -9.725 -10.665 1.00 0.00 O ATOM 1439 CB GLU A 88 -1.307 -7.917 -11.971 1.00 0.00 C ATOM 1440 CG GLU A 88 -1.600 -6.495 -12.454 1.00 0.00 C ATOM 1441 CD GLU A 88 -0.735 -6.183 -13.676 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -1.144 -6.530 -14.771 1.00 0.00 O ATOM 1443 OE2 GLU A 88 0.322 -5.601 -13.495 1.00 0.00 O ATOM 0 H GLU A 88 0.174 -8.491 -9.701 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.532 -7.332 -10.287 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.241 -8.129 -12.056 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -1.827 -8.640 -12.599 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -2.655 -6.396 -12.707 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -1.395 -5.780 -11.658 1.00 0.00 H new ATOM 1450 N ARG A 89 -1.601 -10.378 -9.731 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.164 -11.741 -9.520 1.00 0.00 C ATOM 1452 C ARG A 89 -1.333 -12.502 -8.490 1.00 0.00 C ATOM 1453 O ARG A 89 -0.168 -12.222 -8.285 1.00 0.00 O ATOM 1454 CB ARG A 89 -2.172 -12.511 -10.841 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.837 -12.314 -11.554 1.00 0.00 C ATOM 1456 CD ARG A 89 -0.988 -11.242 -12.633 1.00 0.00 C ATOM 1457 NE ARG A 89 -2.135 -11.589 -13.522 1.00 0.00 N ATOM 1458 CZ ARG A 89 -2.366 -12.835 -13.838 1.00 0.00 C ATOM 1459 NH1 ARG A 89 -1.389 -13.593 -14.255 1.00 0.00 N ATOM 1460 NH2 ARG A 89 -3.573 -13.323 -13.736 1.00 0.00 N ATOM 0 H ARG A 89 -0.644 -10.240 -9.405 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.185 -11.644 -9.152 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.344 -13.571 -10.655 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.989 -12.162 -11.473 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.070 -12.019 -10.838 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.510 -13.252 -12.002 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.153 -10.268 -12.172 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.071 -11.167 -13.217 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.740 -10.852 -13.884 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -0.446 -13.212 -14.334 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.568 -14.566 -14.502 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -4.337 -12.731 -13.409 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -3.752 -14.296 -13.983 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.920 -13.480 -7.855 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.162 -14.280 -6.854 1.00 0.00 C ATOM 1476 C TRP A 90 -2.070 -15.313 -6.201 1.00 0.00 C ATOM 1477 O TRP A 90 -3.181 -15.558 -6.628 1.00 0.00 O ATOM 1478 CB TRP A 90 -0.583 -13.370 -5.762 1.00 0.00 C ATOM 1479 CG TRP A 90 -1.614 -13.064 -4.718 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -1.815 -13.794 -3.596 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -2.579 -11.974 -4.673 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -2.833 -13.218 -2.861 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -3.337 -12.098 -3.481 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -2.868 -10.902 -5.535 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -4.343 -11.194 -3.156 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -3.885 -9.989 -5.206 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -4.620 -10.136 -4.019 1.00 0.00 C ATOM 0 H TRP A 90 -2.892 -13.759 -7.987 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.349 -14.784 -7.376 1.00 0.00 H new ATOM 0 HB2 TRP A 90 0.277 -13.853 -5.299 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -0.225 -12.442 -6.208 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -1.268 -14.683 -3.320 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -3.170 -13.579 -1.968 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -2.308 -10.780 -6.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -4.905 -11.311 -2.241 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -4.103 -9.167 -5.872 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -5.400 -9.429 -3.775 1.00 0.00 H new ATOM 1498 N GLU A 91 -1.578 -15.919 -5.168 1.00 0.00 N ATOM 1499 CA GLU A 91 -2.352 -16.945 -4.451 1.00 0.00 C ATOM 1500 C GLU A 91 -1.998 -16.916 -2.959 1.00 0.00 C ATOM 1501 O GLU A 91 -0.843 -16.978 -2.591 1.00 0.00 O ATOM 1502 CB GLU A 91 -1.961 -18.287 -5.029 1.00 0.00 C ATOM 1503 CG GLU A 91 -3.144 -19.233 -4.922 1.00 0.00 C ATOM 1504 CD GLU A 91 -2.677 -20.677 -5.106 1.00 0.00 C ATOM 1505 OE1 GLU A 91 -1.486 -20.913 -4.998 1.00 0.00 O ATOM 1506 OE2 GLU A 91 -3.520 -21.525 -5.353 1.00 0.00 O ATOM 0 H GLU A 91 -0.650 -15.739 -4.785 1.00 0.00 H new ATOM 0 HA GLU A 91 -3.421 -16.765 -4.560 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.661 -18.175 -6.071 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.104 -18.693 -4.492 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.625 -19.119 -3.951 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.889 -18.984 -5.678 1.00 0.00 H new ATOM 1513 N GLY A 92 -2.978 -16.838 -2.097 1.00 0.00 N ATOM 1514 CA GLY A 92 -2.681 -16.822 -0.633 1.00 0.00 C ATOM 1515 C GLY A 92 -3.201 -15.528 0.000 1.00 0.00 C ATOM 1516 O GLY A 92 -3.977 -14.805 -0.588 1.00 0.00 O ATOM 0 H GLY A 92 -3.967 -16.785 -2.341 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.145 -17.683 -0.151 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -1.606 -16.908 -0.472 1.00 0.00 H new ATOM 1520 N GLU A 93 -2.778 -15.232 1.202 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.244 -13.985 1.872 1.00 0.00 C ATOM 1522 C GLU A 93 -2.067 -13.004 1.980 1.00 0.00 C ATOM 1523 O GLU A 93 -1.183 -13.198 2.783 1.00 0.00 O ATOM 1524 CB GLU A 93 -3.757 -14.322 3.276 1.00 0.00 C ATOM 1525 CG GLU A 93 -5.210 -13.867 3.415 1.00 0.00 C ATOM 1526 CD GLU A 93 -5.574 -13.767 4.897 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -4.676 -13.551 5.695 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -6.745 -13.909 5.211 1.00 0.00 O ATOM 0 H GLU A 93 -2.130 -15.801 1.747 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.048 -13.533 1.292 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.683 -15.395 3.453 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.138 -13.831 4.027 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -5.348 -12.901 2.930 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -5.873 -14.572 2.914 1.00 0.00 H new ATOM 1535 N PRO A 94 -2.083 -11.992 1.147 1.00 0.00 N ATOM 1536 CA PRO A 94 -1.010 -10.973 1.103 1.00 0.00 C ATOM 1537 C PRO A 94 -0.820 -10.241 2.440 1.00 0.00 C ATOM 1538 O PRO A 94 -1.533 -10.460 3.399 1.00 0.00 O ATOM 1539 CB PRO A 94 -1.458 -9.987 0.024 1.00 0.00 C ATOM 1540 CG PRO A 94 -2.796 -10.493 -0.565 1.00 0.00 C ATOM 1541 CD PRO A 94 -3.171 -11.781 0.175 1.00 0.00 C ATOM 0 HA PRO A 94 -0.047 -11.439 0.894 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -1.581 -8.990 0.447 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -0.703 -9.910 -0.758 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -3.576 -9.741 -0.444 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -2.697 -10.681 -1.634 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -4.134 -11.683 0.676 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -3.254 -12.622 -0.513 1.00 0.00 H new ATOM 1549 N TRP A 95 0.168 -9.373 2.492 1.00 0.00 N ATOM 1550 CA TRP A 95 0.471 -8.601 3.734 1.00 0.00 C ATOM 1551 C TRP A 95 0.410 -7.103 3.441 1.00 0.00 C ATOM 1552 O TRP A 95 -0.156 -6.666 2.459 1.00 0.00 O ATOM 1553 CB TRP A 95 1.898 -8.928 4.190 1.00 0.00 C ATOM 1554 CG TRP A 95 2.758 -9.153 2.988 1.00 0.00 C ATOM 1555 CD1 TRP A 95 3.176 -10.356 2.535 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.304 -8.164 2.074 1.00 0.00 C ATOM 1557 NE1 TRP A 95 3.932 -10.170 1.399 1.00 0.00 N ATOM 1558 CE2 TRP A 95 4.047 -8.834 1.074 1.00 0.00 C ATOM 1559 CE3 TRP A 95 3.227 -6.764 2.014 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 4.691 -8.137 0.051 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 3.874 -6.061 0.988 1.00 0.00 C ATOM 1562 CH2 TRP A 95 4.604 -6.747 0.009 1.00 0.00 C ATOM 0 H TRP A 95 0.786 -9.167 1.707 1.00 0.00 H new ATOM 0 HA TRP A 95 -0.256 -8.866 4.502 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.297 -8.110 4.790 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.896 -9.816 4.822 1.00 0.00 H new ATOM 0 HD1 TRP A 95 2.953 -11.309 2.991 1.00 0.00 H new ATOM 0 HE1 TRP A 95 4.355 -10.928 0.863 1.00 0.00 H new ATOM 0 HE3 TRP A 95 2.666 -6.225 2.763 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 5.252 -8.670 -0.702 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 3.809 -4.984 0.952 1.00 0.00 H new ATOM 0 HH2 TRP A 95 5.099 -6.199 -0.778 1.00 0.00 H new ATOM 1573 N GLY A 96 1.006 -6.319 4.297 1.00 0.00 N ATOM 1574 CA GLY A 96 1.021 -4.850 4.106 1.00 0.00 C ATOM 1575 C GLY A 96 1.465 -4.216 5.420 1.00 0.00 C ATOM 1576 O GLY A 96 2.615 -4.306 5.803 1.00 0.00 O ATOM 0 H GLY A 96 1.490 -6.645 5.134 1.00 0.00 H new ATOM 0 HA2 GLY A 96 1.702 -4.576 3.300 1.00 0.00 H new ATOM 0 HA3 GLY A 96 0.031 -4.491 3.823 1.00 0.00 H new ATOM 1580 N LYS A 97 0.570 -3.600 6.131 1.00 0.00 N ATOM 1581 CA LYS A 97 0.957 -2.992 7.434 1.00 0.00 C ATOM 1582 C LYS A 97 1.466 -4.102 8.358 1.00 0.00 C ATOM 1583 O LYS A 97 1.521 -5.255 7.981 1.00 0.00 O ATOM 1584 CB LYS A 97 -0.259 -2.314 8.070 1.00 0.00 C ATOM 1585 CG LYS A 97 0.207 -1.139 8.930 1.00 0.00 C ATOM 1586 CD LYS A 97 -0.846 -0.029 8.895 1.00 0.00 C ATOM 1587 CE LYS A 97 -0.413 1.114 9.816 1.00 0.00 C ATOM 1588 NZ LYS A 97 0.432 2.071 9.052 1.00 0.00 N ATOM 0 H LYS A 97 -0.410 -3.490 5.871 1.00 0.00 H new ATOM 0 HA LYS A 97 1.737 -2.246 7.279 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.941 -1.964 7.295 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -0.810 -3.029 8.680 1.00 0.00 H new ATOM 0 HG2 LYS A 97 0.369 -1.468 9.956 1.00 0.00 H new ATOM 0 HG3 LYS A 97 1.161 -0.761 8.562 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.970 0.338 7.876 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -1.813 -0.420 9.213 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -1.289 1.625 10.217 1.00 0.00 H new ATOM 0 HE3 LYS A 97 0.143 0.720 10.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 0.727 2.849 9.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 1.274 1.579 8.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -0.113 2.456 8.254 1.00 0.00 H new ATOM 1602 N GLU A 98 1.837 -3.772 9.565 1.00 0.00 N ATOM 1603 CA GLU A 98 2.338 -4.825 10.495 1.00 0.00 C ATOM 1604 C GLU A 98 1.244 -5.188 11.501 1.00 0.00 C ATOM 1605 O GLU A 98 0.643 -6.242 11.422 1.00 0.00 O ATOM 1606 CB GLU A 98 3.568 -4.309 11.245 1.00 0.00 C ATOM 1607 CG GLU A 98 4.764 -5.213 10.938 1.00 0.00 C ATOM 1608 CD GLU A 98 4.538 -6.589 11.566 1.00 0.00 C ATOM 1609 OE1 GLU A 98 3.839 -7.386 10.962 1.00 0.00 O ATOM 1610 OE2 GLU A 98 5.068 -6.823 12.639 1.00 0.00 O ATOM 0 H GLU A 98 1.816 -2.826 9.946 1.00 0.00 H new ATOM 0 HA GLU A 98 2.609 -5.710 9.919 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.786 -3.284 10.946 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.374 -4.294 12.318 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.893 -5.310 9.860 1.00 0.00 H new ATOM 0 HG3 GLU A 98 5.679 -4.769 11.329 1.00 0.00 H new ATOM 1617 N GLY A 99 0.980 -4.328 12.445 1.00 0.00 N ATOM 1618 CA GLY A 99 -0.073 -4.631 13.455 1.00 0.00 C ATOM 1619 C GLY A 99 -1.449 -4.274 12.891 1.00 0.00 C ATOM 1620 O GLY A 99 -2.434 -4.250 13.603 1.00 0.00 O ATOM 0 H GLY A 99 1.447 -3.429 12.561 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.042 -5.688 13.721 1.00 0.00 H new ATOM 0 HA3 GLY A 99 0.113 -4.067 14.369 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.531 -3.992 11.619 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.843 -3.637 11.019 1.00 0.00 C ATOM 1626 C GLN A 100 -3.303 -4.770 10.087 1.00 0.00 C ATOM 1627 O GLN A 100 -2.602 -5.121 9.158 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.688 -2.344 10.223 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.420 -1.214 10.946 1.00 0.00 C ATOM 1630 CD GLN A 100 -4.249 -0.414 9.941 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -4.923 -0.981 9.106 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -4.225 0.889 9.988 1.00 0.00 N ATOM 0 H GLN A 100 -0.743 -3.993 10.971 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.586 -3.497 11.804 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.632 -2.096 10.112 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -3.093 -2.471 9.219 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.067 -1.624 11.722 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -2.702 -0.561 11.442 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -3.658 1.364 10.691 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -4.773 1.434 9.322 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.464 -5.317 10.366 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.026 -6.419 9.562 1.00 0.00 C ATOM 1643 C PRO A 101 -5.349 -5.957 8.144 1.00 0.00 C ATOM 1644 O PRO A 101 -4.931 -6.552 7.169 1.00 0.00 O ATOM 1645 CB PRO A 101 -6.314 -6.821 10.292 1.00 0.00 C ATOM 1646 CG PRO A 101 -6.506 -5.846 11.481 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.304 -4.890 11.499 1.00 0.00 C ATOM 0 HA PRO A 101 -4.322 -7.246 9.466 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.168 -6.772 9.616 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -6.247 -7.849 10.648 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.436 -5.289 11.372 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -6.572 -6.396 12.420 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.622 -3.853 11.387 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -4.760 -4.956 12.441 1.00 0.00 H new ATOM 1655 N GLY A 102 -6.103 -4.913 8.028 1.00 0.00 N ATOM 1656 CA GLY A 102 -6.486 -4.405 6.679 1.00 0.00 C ATOM 1657 C GLY A 102 -7.791 -5.080 6.254 1.00 0.00 C ATOM 1658 O GLY A 102 -8.265 -5.985 6.911 1.00 0.00 O ATOM 0 H GLY A 102 -6.478 -4.379 8.812 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.611 -3.323 6.704 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -5.698 -4.618 5.957 1.00 0.00 H new ATOM 1662 N GLU A 103 -8.387 -4.659 5.170 1.00 0.00 N ATOM 1663 CA GLU A 103 -9.662 -5.308 4.748 1.00 0.00 C ATOM 1664 C GLU A 103 -9.696 -5.469 3.227 1.00 0.00 C ATOM 1665 O GLU A 103 -9.204 -4.638 2.491 1.00 0.00 O ATOM 1666 CB GLU A 103 -10.848 -4.452 5.201 1.00 0.00 C ATOM 1667 CG GLU A 103 -10.902 -3.161 4.380 1.00 0.00 C ATOM 1668 CD GLU A 103 -12.275 -2.510 4.550 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -12.599 -2.137 5.665 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -12.980 -2.396 3.561 1.00 0.00 O ATOM 0 H GLU A 103 -8.053 -3.907 4.568 1.00 0.00 H new ATOM 0 HA GLU A 103 -9.726 -6.294 5.209 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -11.777 -5.009 5.080 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -10.753 -4.216 6.261 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.119 -2.476 4.706 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.718 -3.378 3.328 1.00 0.00 H new ATOM 1677 N TRP A 104 -10.282 -6.538 2.751 1.00 0.00 N ATOM 1678 CA TRP A 104 -10.357 -6.757 1.277 1.00 0.00 C ATOM 1679 C TRP A 104 -11.641 -6.121 0.738 1.00 0.00 C ATOM 1680 O TRP A 104 -12.728 -6.619 0.954 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.377 -8.260 0.961 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.797 -9.045 2.096 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -8.705 -8.693 2.812 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -10.259 -10.312 2.652 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -8.468 -9.661 3.772 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -9.399 -10.679 3.712 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -11.331 -11.167 2.339 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -9.596 -11.855 4.439 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -11.532 -12.350 3.068 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -10.665 -12.694 4.115 1.00 0.00 C ATOM 0 H TRP A 104 -10.711 -7.268 3.320 1.00 0.00 H new ATOM 0 HA TRP A 104 -9.484 -6.303 0.808 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.401 -8.584 0.773 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -9.810 -8.453 0.051 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -8.114 -7.802 2.659 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -7.700 -9.627 4.442 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -12.003 -10.912 1.533 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -8.927 -12.114 5.246 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -12.359 -12.999 2.821 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -10.823 -13.607 4.670 1.00 0.00 H new ATOM 1701 N MET A 105 -11.528 -5.023 0.039 1.00 0.00 N ATOM 1702 CA MET A 105 -12.747 -4.363 -0.507 1.00 0.00 C ATOM 1703 C MET A 105 -12.962 -4.798 -1.959 1.00 0.00 C ATOM 1704 O MET A 105 -12.029 -5.129 -2.661 1.00 0.00 O ATOM 1705 CB MET A 105 -12.568 -2.844 -0.455 1.00 0.00 C ATOM 1706 CG MET A 105 -13.876 -2.192 -0.013 1.00 0.00 C ATOM 1707 SD MET A 105 -13.661 -0.397 0.060 1.00 0.00 S ATOM 1708 CE MET A 105 -12.148 -0.391 1.051 1.00 0.00 C ATOM 0 H MET A 105 -10.647 -4.557 -0.176 1.00 0.00 H new ATOM 0 HA MET A 105 -13.612 -4.652 0.090 1.00 0.00 H new ATOM 0 HB2 MET A 105 -11.768 -2.585 0.238 1.00 0.00 H new ATOM 0 HB3 MET A 105 -12.275 -2.468 -1.435 1.00 0.00 H new ATOM 0 HG2 MET A 105 -14.675 -2.445 -0.710 1.00 0.00 H new ATOM 0 HG3 MET A 105 -14.173 -2.573 0.964 1.00 0.00 H new ATOM 0 HE1 MET A 105 -12.170 0.450 1.744 1.00 0.00 H new ATOM 0 HE2 MET A 105 -12.077 -1.322 1.613 1.00 0.00 H new ATOM 0 HE3 MET A 105 -11.283 -0.297 0.394 1.00 0.00 H new ATOM 1718 N SER A 106 -14.187 -4.801 -2.412 1.00 0.00 N ATOM 1719 CA SER A 106 -14.463 -5.212 -3.819 1.00 0.00 C ATOM 1720 C SER A 106 -14.847 -3.981 -4.641 1.00 0.00 C ATOM 1721 O SER A 106 -15.939 -3.459 -4.521 1.00 0.00 O ATOM 1722 CB SER A 106 -15.615 -6.217 -3.837 1.00 0.00 C ATOM 1723 OG SER A 106 -15.148 -7.458 -4.349 1.00 0.00 O ATOM 0 H SER A 106 -15.009 -4.537 -1.868 1.00 0.00 H new ATOM 0 HA SER A 106 -13.572 -5.672 -4.247 1.00 0.00 H new ATOM 0 HB2 SER A 106 -16.011 -6.352 -2.830 1.00 0.00 H new ATOM 0 HB3 SER A 106 -16.432 -5.841 -4.453 1.00 0.00 H new ATOM 0 HG SER A 106 -15.884 -8.105 -4.360 1.00 0.00 H new ATOM 1729 N LEU A 107 -13.960 -3.508 -5.475 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.281 -2.307 -6.298 1.00 0.00 C ATOM 1731 C LEU A 107 -13.560 -2.399 -7.647 1.00 0.00 C ATOM 1732 O LEU A 107 -14.179 -2.515 -8.683 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.822 -1.049 -5.559 1.00 0.00 C ATOM 1734 CG LEU A 107 -14.756 -0.780 -4.378 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -14.084 0.192 -3.405 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -16.061 -0.167 -4.890 1.00 0.00 C ATOM 0 H LEU A 107 -13.030 -3.900 -5.622 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.357 -2.260 -6.467 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -12.799 -1.175 -5.205 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -13.822 -0.196 -6.237 1.00 0.00 H new ATOM 0 HG LEU A 107 -14.970 -1.717 -3.864 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -14.750 0.383 -2.564 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -13.154 -0.244 -3.040 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -13.869 1.129 -3.918 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -16.727 0.025 -4.049 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -15.846 0.770 -5.404 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -16.541 -0.859 -5.582 1.00 0.00 H new ATOM 1748 N VAL A 108 -12.254 -2.350 -7.634 1.00 0.00 N ATOM 1749 CA VAL A 108 -11.481 -2.435 -8.902 1.00 0.00 C ATOM 1750 C VAL A 108 -11.536 -1.089 -9.636 1.00 0.00 C ATOM 1751 O VAL A 108 -10.929 -0.903 -10.673 1.00 0.00 O ATOM 1752 CB VAL A 108 -12.066 -3.574 -9.737 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -12.956 -3.044 -10.872 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -10.926 -4.402 -10.332 1.00 0.00 C ATOM 0 H VAL A 108 -11.688 -2.254 -6.791 1.00 0.00 H new ATOM 0 HA VAL A 108 -10.429 -2.647 -8.709 1.00 0.00 H new ATOM 0 HB VAL A 108 -12.683 -4.191 -9.083 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -13.354 -3.882 -11.444 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -13.780 -2.469 -10.450 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -12.366 -2.404 -11.529 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -11.340 -5.215 -10.928 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -10.307 -3.767 -10.965 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -10.318 -4.815 -9.527 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.243 -0.146 -9.083 1.00 0.00 N ATOM 1765 CA GLY A 109 -12.334 1.202 -9.701 1.00 0.00 C ATOM 1766 C GLY A 109 -12.252 2.218 -8.571 1.00 0.00 C ATOM 1767 O GLY A 109 -12.753 3.322 -8.661 1.00 0.00 O ATOM 0 H GLY A 109 -12.769 -0.255 -8.216 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.525 1.354 -10.415 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -13.269 1.312 -10.251 1.00 0.00 H new ATOM 1771 N LEU A 110 -11.628 1.828 -7.491 1.00 0.00 N ATOM 1772 CA LEU A 110 -11.502 2.724 -6.319 1.00 0.00 C ATOM 1773 C LEU A 110 -11.219 4.152 -6.777 1.00 0.00 C ATOM 1774 O LEU A 110 -10.532 4.380 -7.753 1.00 0.00 O ATOM 1775 CB LEU A 110 -10.355 2.230 -5.442 1.00 0.00 C ATOM 1776 CG LEU A 110 -10.890 1.901 -4.050 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -9.728 1.511 -3.134 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -11.603 3.127 -3.477 1.00 0.00 C ATOM 0 H LEU A 110 -11.196 0.911 -7.376 1.00 0.00 H new ATOM 0 HA LEU A 110 -12.434 2.717 -5.754 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -9.897 1.346 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.579 2.992 -5.375 1.00 0.00 H new ATOM 0 HG LEU A 110 -11.592 1.070 -4.117 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -10.111 1.276 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -9.220 0.638 -3.543 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -9.025 2.341 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -11.986 2.894 -2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -10.901 3.958 -3.410 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -12.431 3.404 -4.129 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.737 5.117 -6.072 1.00 0.00 N ATOM 1791 CA ASN A 111 -11.493 6.533 -6.455 1.00 0.00 C ATOM 1792 C ASN A 111 -10.658 7.206 -5.366 1.00 0.00 C ATOM 1793 O ASN A 111 -10.178 6.562 -4.454 1.00 0.00 O ATOM 1794 CB ASN A 111 -12.827 7.266 -6.602 1.00 0.00 C ATOM 1795 CG ASN A 111 -12.802 8.118 -7.871 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -12.187 9.166 -7.901 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -13.448 7.711 -8.928 1.00 0.00 N ATOM 0 H ASN A 111 -12.320 4.985 -5.245 1.00 0.00 H new ATOM 0 HA ASN A 111 -10.960 6.568 -7.405 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -13.646 6.548 -6.649 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -13.006 7.897 -5.731 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -13.437 8.272 -9.780 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -13.964 6.832 -8.903 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.484 8.494 -5.448 1.00 0.00 N ATOM 1805 CA ALA A 112 -9.682 9.200 -4.412 1.00 0.00 C ATOM 1806 C ALA A 112 -10.610 9.676 -3.291 1.00 0.00 C ATOM 1807 O ALA A 112 -10.222 10.441 -2.431 1.00 0.00 O ATOM 1808 CB ALA A 112 -8.984 10.404 -5.045 1.00 0.00 C ATOM 0 H ALA A 112 -10.862 9.088 -6.186 1.00 0.00 H new ATOM 0 HA ALA A 112 -8.934 8.522 -4.001 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -8.396 10.923 -4.288 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -8.327 10.064 -5.845 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -9.731 11.084 -5.453 1.00 0.00 H new ATOM 1814 N ASP A 113 -11.838 9.235 -3.301 1.00 0.00 N ATOM 1815 CA ASP A 113 -12.796 9.658 -2.253 1.00 0.00 C ATOM 1816 C ASP A 113 -12.667 8.748 -1.033 1.00 0.00 C ATOM 1817 O ASP A 113 -12.655 9.201 0.094 1.00 0.00 O ATOM 1818 CB ASP A 113 -14.207 9.558 -2.810 1.00 0.00 C ATOM 1819 CG ASP A 113 -15.086 10.649 -2.194 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -14.730 11.140 -1.134 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -16.096 10.978 -2.792 1.00 0.00 O ATOM 0 H ASP A 113 -12.217 8.594 -3.998 1.00 0.00 H new ATOM 0 HA ASP A 113 -12.582 10.684 -1.955 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -14.188 9.663 -3.895 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.625 8.575 -2.592 1.00 0.00 H new ATOM 1826 N ASP A 114 -12.570 7.464 -1.248 1.00 0.00 N ATOM 1827 CA ASP A 114 -12.441 6.533 -0.097 1.00 0.00 C ATOM 1828 C ASP A 114 -10.996 6.551 0.388 1.00 0.00 C ATOM 1829 O ASP A 114 -10.689 6.100 1.472 1.00 0.00 O ATOM 1830 CB ASP A 114 -12.823 5.117 -0.532 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.038 4.648 0.270 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.003 5.392 0.335 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -13.983 3.553 0.807 1.00 0.00 O ATOM 0 H ASP A 114 -12.575 7.023 -2.168 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.106 6.845 0.708 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -13.049 5.101 -1.598 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -11.985 4.438 -0.374 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.102 7.081 -0.402 1.00 0.00 N ATOM 1839 CA PHE A 115 -8.680 7.130 0.038 1.00 0.00 C ATOM 1840 C PHE A 115 -8.397 8.507 0.645 1.00 0.00 C ATOM 1841 O PHE A 115 -8.879 9.507 0.153 1.00 0.00 O ATOM 1842 CB PHE A 115 -7.749 6.872 -1.149 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.421 5.397 -1.202 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -7.097 4.707 -0.026 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -7.450 4.715 -2.424 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -6.803 3.341 -0.074 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -7.156 3.347 -2.471 1.00 0.00 C ATOM 1848 CZ PHE A 115 -6.833 2.660 -1.296 1.00 0.00 C ATOM 0 H PHE A 115 -10.292 7.478 -1.322 1.00 0.00 H new ATOM 0 HA PHE A 115 -8.501 6.357 0.785 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.226 7.186 -2.077 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -6.836 7.458 -1.046 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -7.074 5.231 0.918 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -7.699 5.245 -3.332 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.552 2.811 0.833 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -7.179 2.822 -3.415 1.00 0.00 H new ATOM 0 HZ PHE A 115 -6.607 1.605 -1.332 1.00 0.00 H new ATOM 1858 N PRO A 116 -7.640 8.515 1.713 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.304 9.761 2.423 1.00 0.00 C ATOM 1860 C PRO A 116 -6.410 10.654 1.547 1.00 0.00 C ATOM 1861 O PRO A 116 -5.589 10.161 0.799 1.00 0.00 O ATOM 1862 CB PRO A 116 -6.551 9.301 3.677 1.00 0.00 C ATOM 1863 CG PRO A 116 -6.430 7.760 3.620 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.057 7.295 2.298 1.00 0.00 C ATOM 0 HA PRO A 116 -8.187 10.352 2.668 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -5.563 9.760 3.719 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.084 9.609 4.577 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.385 7.455 3.676 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -6.941 7.304 4.468 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -6.309 6.857 1.637 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -7.818 6.533 2.467 1.00 0.00 H new ATOM 1872 N PRO A 117 -6.604 11.945 1.668 1.00 0.00 N ATOM 1873 CA PRO A 117 -5.831 12.936 0.895 1.00 0.00 C ATOM 1874 C PRO A 117 -4.344 12.862 1.259 1.00 0.00 C ATOM 1875 O PRO A 117 -3.976 12.929 2.415 1.00 0.00 O ATOM 1876 CB PRO A 117 -6.415 14.295 1.300 1.00 0.00 C ATOM 1877 CG PRO A 117 -7.511 14.038 2.367 1.00 0.00 C ATOM 1878 CD PRO A 117 -7.607 12.520 2.581 1.00 0.00 C ATOM 0 HA PRO A 117 -5.900 12.762 -0.179 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.635 14.942 1.701 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -6.837 14.804 0.433 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -7.261 14.541 3.301 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -8.469 14.439 2.036 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -7.398 12.253 3.617 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -8.607 12.151 2.353 1.00 0.00 H new ATOM 1886 N ALA A 118 -3.494 12.730 0.274 1.00 0.00 N ATOM 1887 CA ALA A 118 -2.025 12.653 0.530 1.00 0.00 C ATOM 1888 C ALA A 118 -1.363 11.947 -0.652 1.00 0.00 C ATOM 1889 O ALA A 118 -0.244 12.237 -1.024 1.00 0.00 O ATOM 1890 CB ALA A 118 -1.759 11.856 1.811 1.00 0.00 C ATOM 0 H ALA A 118 -3.759 12.672 -0.709 1.00 0.00 H new ATOM 0 HA ALA A 118 -1.618 13.657 0.648 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -0.685 11.804 1.991 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.245 12.348 2.653 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.158 10.847 1.701 1.00 0.00 H new ATOM 1896 N ASN A 119 -2.064 11.023 -1.245 1.00 0.00 N ATOM 1897 CA ASN A 119 -1.534 10.281 -2.396 1.00 0.00 C ATOM 1898 C ASN A 119 -2.356 10.670 -3.622 1.00 0.00 C ATOM 1899 O ASN A 119 -2.812 9.839 -4.359 1.00 0.00 O ATOM 1900 CB ASN A 119 -1.709 8.794 -2.114 1.00 0.00 C ATOM 1901 CG ASN A 119 -0.680 8.335 -1.079 1.00 0.00 C ATOM 1902 OD1 ASN A 119 0.413 7.939 -1.423 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -0.990 8.368 0.189 1.00 0.00 N ATOM 0 H ASN A 119 -3.006 10.752 -0.964 1.00 0.00 H new ATOM 0 HA ASN A 119 -0.481 10.505 -2.568 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.717 8.601 -1.748 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.590 8.224 -3.035 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -0.313 8.061 0.888 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -1.909 8.701 0.481 1.00 0.00 H new ATOM 1910 N GLU A 120 -2.577 11.933 -3.814 1.00 0.00 N ATOM 1911 CA GLU A 120 -3.400 12.399 -4.974 1.00 0.00 C ATOM 1912 C GLU A 120 -2.789 12.007 -6.343 1.00 0.00 C ATOM 1913 O GLU A 120 -3.516 11.642 -7.244 1.00 0.00 O ATOM 1914 CB GLU A 120 -3.529 13.921 -4.910 1.00 0.00 C ATOM 1915 CG GLU A 120 -3.909 14.343 -3.490 1.00 0.00 C ATOM 1916 CD GLU A 120 -4.400 15.792 -3.504 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -5.213 16.112 -4.355 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -3.955 16.555 -2.663 1.00 0.00 O ATOM 0 H GLU A 120 -2.222 12.678 -3.214 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.372 11.912 -4.899 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -2.588 14.389 -5.200 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.286 14.262 -5.617 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -4.688 13.687 -3.100 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.049 14.245 -2.827 1.00 0.00 H new ATOM 1925 N PRO A 121 -1.488 12.127 -6.482 1.00 0.00 N ATOM 1926 CA PRO A 121 -0.791 11.826 -7.755 1.00 0.00 C ATOM 1927 C PRO A 121 -0.849 10.330 -8.095 1.00 0.00 C ATOM 1928 O PRO A 121 -0.824 9.947 -9.249 1.00 0.00 O ATOM 1929 CB PRO A 121 0.662 12.255 -7.515 1.00 0.00 C ATOM 1930 CG PRO A 121 0.782 12.699 -6.035 1.00 0.00 C ATOM 1931 CD PRO A 121 -0.608 12.566 -5.395 1.00 0.00 C ATOM 0 HA PRO A 121 -1.255 12.345 -8.594 1.00 0.00 H new ATOM 0 HB2 PRO A 121 1.344 11.431 -7.724 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.935 13.072 -8.183 1.00 0.00 H new ATOM 0 HG2 PRO A 121 1.507 12.080 -5.507 1.00 0.00 H new ATOM 0 HG3 PRO A 121 1.136 13.728 -5.972 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -0.599 11.843 -4.579 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -0.942 13.515 -4.976 1.00 0.00 H new ATOM 1939 N VAL A 122 -0.920 9.483 -7.108 1.00 0.00 N ATOM 1940 CA VAL A 122 -0.972 8.018 -7.378 1.00 0.00 C ATOM 1941 C VAL A 122 -2.431 7.582 -7.391 1.00 0.00 C ATOM 1942 O VAL A 122 -2.863 6.809 -8.219 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.228 7.265 -6.274 1.00 0.00 C ATOM 1944 CG1 VAL A 122 1.221 7.026 -6.702 1.00 0.00 C ATOM 1945 CG2 VAL A 122 -0.255 8.077 -4.982 1.00 0.00 C ATOM 0 H VAL A 122 -0.944 9.742 -6.122 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.503 7.799 -8.337 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.717 6.306 -6.103 1.00 0.00 H new ATOM 0 HG11 VAL A 122 1.749 6.489 -5.914 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.237 6.435 -7.617 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.710 7.984 -6.880 1.00 0.00 H new ATOM 0 HG21 VAL A 122 0.277 7.535 -4.200 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.227 9.040 -5.148 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.288 8.237 -4.674 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.187 8.103 -6.477 1.00 0.00 N ATOM 1956 CA ILE A 123 -4.629 7.782 -6.399 1.00 0.00 C ATOM 1957 C ILE A 123 -5.258 8.172 -7.724 1.00 0.00 C ATOM 1958 O ILE A 123 -6.152 7.520 -8.223 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.250 8.601 -5.274 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -4.675 8.129 -3.933 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -6.767 8.425 -5.288 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -5.386 6.851 -3.478 1.00 0.00 C ATOM 0 H ILE A 123 -2.858 8.753 -5.764 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.789 6.722 -6.202 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.018 9.657 -5.414 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.605 7.944 -4.032 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.796 8.909 -3.181 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.209 9.012 -4.483 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.164 8.765 -6.244 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.012 7.372 -5.147 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -4.971 6.523 -2.525 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.451 7.049 -3.361 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.242 6.069 -4.224 1.00 0.00 H new ATOM 1974 N ALA A 124 -4.777 9.234 -8.306 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.329 9.666 -9.613 1.00 0.00 C ATOM 1976 C ALA A 124 -5.279 8.477 -10.573 1.00 0.00 C ATOM 1977 O ALA A 124 -6.185 8.254 -11.351 1.00 0.00 O ATOM 1978 CB ALA A 124 -4.491 10.818 -10.173 1.00 0.00 C ATOM 0 H ALA A 124 -4.028 9.818 -7.933 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.357 10.007 -9.492 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -4.900 11.132 -11.133 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.514 11.656 -9.477 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.461 10.487 -10.308 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.224 7.707 -10.517 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.114 6.530 -11.419 1.00 0.00 C ATOM 1986 C LYS A 125 -4.927 5.362 -10.850 1.00 0.00 C ATOM 1987 O LYS A 125 -5.458 4.550 -11.581 1.00 0.00 O ATOM 1988 CB LYS A 125 -2.648 6.113 -11.546 1.00 0.00 C ATOM 1989 CG LYS A 125 -1.893 7.133 -12.401 1.00 0.00 C ATOM 1990 CD LYS A 125 -1.608 6.530 -13.778 1.00 0.00 C ATOM 1991 CE LYS A 125 -0.498 7.326 -14.464 1.00 0.00 C ATOM 1992 NZ LYS A 125 -0.115 6.647 -15.734 1.00 0.00 N ATOM 0 H LYS A 125 -3.436 7.845 -9.885 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.503 6.797 -12.402 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.193 6.044 -10.558 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.579 5.124 -11.998 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.483 8.044 -12.506 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.959 7.412 -11.914 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -1.311 5.486 -13.675 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -2.511 6.546 -14.388 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -0.837 8.341 -14.669 1.00 0.00 H new ATOM 0 HE3 LYS A 125 0.367 7.406 -13.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 0.640 7.187 -16.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 0.225 5.686 -15.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.942 6.593 -16.362 1.00 0.00 H new ATOM 2006 N LEU A 126 -5.026 5.272 -9.549 1.00 0.00 N ATOM 2007 CA LEU A 126 -5.797 4.167 -8.929 1.00 0.00 C ATOM 2008 C LEU A 126 -7.225 4.191 -9.462 1.00 0.00 C ATOM 2009 O LEU A 126 -7.911 3.188 -9.489 1.00 0.00 O ATOM 2010 CB LEU A 126 -5.813 4.381 -7.425 1.00 0.00 C ATOM 2011 CG LEU A 126 -4.705 3.556 -6.768 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -3.404 3.709 -7.560 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -4.486 4.057 -5.343 1.00 0.00 C ATOM 0 H LEU A 126 -4.601 5.924 -8.890 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.341 3.206 -9.166 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.674 5.438 -7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.782 4.093 -7.019 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.997 2.506 -6.754 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.619 3.119 -7.087 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.556 3.359 -8.581 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.109 4.758 -7.577 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.697 3.473 -4.869 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.195 5.107 -5.367 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.409 3.949 -4.774 1.00 0.00 H new ATOM 2025 N LYS A 127 -7.676 5.333 -9.893 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.041 5.436 -10.436 1.00 0.00 C ATOM 2027 C LYS A 127 -9.180 4.438 -11.582 1.00 0.00 C ATOM 2028 O LYS A 127 -10.139 3.699 -11.671 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.232 6.854 -10.954 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.359 7.815 -9.769 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.824 9.187 -10.261 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.487 10.246 -9.210 1.00 0.00 C ATOM 2033 NZ LYS A 127 -8.879 11.434 -9.876 1.00 0.00 N ATOM 0 H LYS A 127 -7.146 6.204 -9.889 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.789 5.217 -9.674 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.387 7.141 -11.580 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.124 6.908 -11.578 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -10.069 7.419 -9.043 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.400 7.907 -9.260 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -9.339 9.430 -11.206 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.898 9.174 -10.448 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -10.389 10.539 -8.672 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -8.796 9.836 -8.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -8.650 12.154 -9.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -8.010 11.148 -10.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -9.553 11.830 -10.562 1.00 0.00 H new ATOM 2047 N ARG A 128 -8.213 4.413 -12.454 1.00 0.00 N ATOM 2048 CA ARG A 128 -8.254 3.475 -13.592 1.00 0.00 C ATOM 2049 C ARG A 128 -7.699 2.116 -13.154 1.00 0.00 C ATOM 2050 O ARG A 128 -7.748 1.153 -13.892 1.00 0.00 O ATOM 2051 CB ARG A 128 -7.395 4.038 -14.720 1.00 0.00 C ATOM 2052 CG ARG A 128 -8.277 4.818 -15.696 1.00 0.00 C ATOM 2053 CD ARG A 128 -7.420 5.343 -16.849 1.00 0.00 C ATOM 2054 NE ARG A 128 -7.684 6.797 -17.041 1.00 0.00 N ATOM 2055 CZ ARG A 128 -6.870 7.520 -17.764 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -6.261 6.988 -18.788 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -6.664 8.774 -17.461 1.00 0.00 N ATOM 0 H ARG A 128 -7.389 5.013 -12.420 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.281 3.348 -13.934 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -6.622 4.690 -14.312 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -6.886 3.228 -15.242 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -9.069 4.175 -16.081 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -8.762 5.648 -15.182 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -6.364 5.179 -16.635 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -7.648 4.797 -17.764 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.501 7.228 -16.608 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -6.420 6.009 -19.024 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -5.626 7.552 -19.353 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -7.139 9.190 -16.660 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -6.028 9.337 -18.026 1.00 0.00 H new ATOM 2071 N LEU A 129 -7.168 2.036 -11.960 1.00 0.00 N ATOM 2072 CA LEU A 129 -6.606 0.739 -11.476 1.00 0.00 C ATOM 2073 C LEU A 129 -7.525 -0.412 -11.892 1.00 0.00 C ATOM 2074 O LEU A 129 -7.086 -1.242 -12.670 1.00 0.00 O ATOM 2075 CB LEU A 129 -6.494 0.765 -9.949 1.00 0.00 C ATOM 2076 CG LEU A 129 -5.286 -0.060 -9.506 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -4.178 0.876 -9.019 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -5.698 -0.989 -8.362 1.00 0.00 C ATOM 2079 OXT LEU A 129 -8.651 -0.444 -11.424 1.00 0.00 O ATOM 0 H LEU A 129 -7.100 2.811 -11.301 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.619 0.594 -11.915 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.392 1.793 -9.600 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.404 0.365 -9.501 1.00 0.00 H new ATOM 0 HG LEU A 129 -4.922 -0.650 -10.347 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -3.317 0.287 -8.703 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.884 1.544 -9.829 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -4.543 1.465 -8.178 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -4.838 -1.579 -8.044 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.060 -0.395 -7.523 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -6.490 -1.657 -8.702 1.00 0.00 H new TER 2091 LEU A 129