USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 831 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 ASN : amide:sc= -0.849 K(o=-0.23,f=-2) USER MOD Set 1.2: A 76 ASN : amide:sc= 0.618 K(o=-0.23,f=-1.4) USER MOD Set 2.1: A 52 THR OG1 : rot 20:sc= 0.159 USER MOD Set 2.2: A 54 MET CE :methyl -173:sc= -0.0719 (180deg=-0.126) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot -179:sc= 0.0936 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= 0.863 K(o=0.86,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 0.685 K(o=0.68,f=-0.024) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 2:sc= 0.00265 USER MOD Single : A 37 GLN : amide:sc= 1.16 K(o=1.2,f=-0.018) USER MOD Single : A 41 GLN : amide:sc= -0.511 X(o=-0.51,f=-0.054) USER MOD Single : A 42 ASN : amide:sc= 1.46 K(o=1.5,f=-7.4!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl 174:sc= 0 (180deg=-0.031) USER MOD Single : A 51 THR OG1 : rot 74:sc= 0.675 USER MOD Single : A 55 CYS SG : rot -170:sc= -1.96 USER MOD Single : A 60 MET CE :methyl -150:sc= -0.145 (180deg=-0.849) USER MOD Single : A 63 SER OG : rot 57:sc= 1.25 USER MOD Single : A 70 LYS NZ :NH3+ 145:sc= 0.0745 (180deg=-0.304) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= -1 K(o=-1,f=-2.3) USER MOD Single : A 83 THR OG1 : rot 75:sc= 1.2 USER MOD Single : A 89 THR OG1 : rot 72:sc= 0.334 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0.024 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 2 22.072 -3.532 -16.468 1.00 0.00 N ATOM 2 CA MET A 2 21.132 -2.408 -16.535 1.00 0.00 C ATOM 3 C MET A 2 21.191 -1.632 -15.229 1.00 0.00 C ATOM 4 O MET A 2 21.568 -2.205 -14.205 1.00 0.00 O ATOM 5 CB MET A 2 19.715 -2.901 -16.843 1.00 0.00 C ATOM 6 CG MET A 2 18.947 -1.880 -17.681 1.00 0.00 C ATOM 7 SD MET A 2 17.326 -2.446 -18.242 1.00 0.00 S ATOM 8 CE MET A 2 16.828 -0.974 -19.168 1.00 0.00 C ATOM 0 HA MET A 2 21.416 -1.740 -17.348 1.00 0.00 H new ATOM 0 HB2 MET A 2 19.765 -3.850 -17.377 1.00 0.00 H new ATOM 0 HB3 MET A 2 19.181 -3.087 -15.911 1.00 0.00 H new ATOM 0 HG2 MET A 2 18.818 -0.970 -17.095 1.00 0.00 H new ATOM 0 HG3 MET A 2 19.548 -1.616 -18.551 1.00 0.00 H new ATOM 0 HE1 MET A 2 15.838 -1.131 -19.597 1.00 0.00 H new ATOM 0 HE2 MET A 2 16.801 -0.115 -18.498 1.00 0.00 H new ATOM 0 HE3 MET A 2 17.544 -0.788 -19.968 1.00 0.00 H new ATOM 18 N SER A 3 20.799 -0.356 -15.244 1.00 0.00 N ATOM 19 CA SER A 3 20.498 0.398 -14.030 1.00 0.00 C ATOM 20 C SER A 3 19.466 -0.344 -13.168 1.00 0.00 C ATOM 21 O SER A 3 18.764 -1.251 -13.638 1.00 0.00 O ATOM 22 CB SER A 3 20.025 1.802 -14.414 1.00 0.00 C ATOM 23 OG SER A 3 21.021 2.447 -15.194 1.00 0.00 O ATOM 0 H SER A 3 20.682 0.183 -16.102 1.00 0.00 H new ATOM 0 HA SER A 3 21.399 0.493 -13.424 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.093 1.741 -14.976 1.00 0.00 H new ATOM 0 HB3 SER A 3 19.819 2.385 -13.516 1.00 0.00 H new ATOM 0 HG SER A 3 20.714 3.345 -15.439 1.00 0.00 H new ATOM 29 N LYS A 4 19.425 -0.013 -11.879 1.00 0.00 N ATOM 30 CA LYS A 4 18.729 -0.773 -10.854 1.00 0.00 C ATOM 31 C LYS A 4 18.497 0.150 -9.662 1.00 0.00 C ATOM 32 O LYS A 4 19.124 -0.029 -8.619 1.00 0.00 O ATOM 33 CB LYS A 4 19.597 -2.000 -10.490 1.00 0.00 C ATOM 34 CG LYS A 4 18.887 -2.971 -9.527 1.00 0.00 C ATOM 35 CD LYS A 4 18.823 -4.420 -10.034 1.00 0.00 C ATOM 36 CE LYS A 4 18.046 -4.462 -11.351 1.00 0.00 C ATOM 37 NZ LYS A 4 17.544 -5.806 -11.702 1.00 0.00 N ATOM 0 H LYS A 4 19.891 0.817 -11.512 1.00 0.00 H new ATOM 0 HA LYS A 4 17.760 -1.138 -11.194 1.00 0.00 H new ATOM 0 HB2 LYS A 4 19.866 -2.532 -11.402 1.00 0.00 H new ATOM 0 HB3 LYS A 4 20.527 -1.659 -10.034 1.00 0.00 H new ATOM 0 HG2 LYS A 4 19.402 -2.956 -8.567 1.00 0.00 H new ATOM 0 HG3 LYS A 4 17.872 -2.614 -9.350 1.00 0.00 H new ATOM 0 HD2 LYS A 4 19.830 -4.811 -10.180 1.00 0.00 H new ATOM 0 HD3 LYS A 4 18.339 -5.056 -9.293 1.00 0.00 H new ATOM 0 HE2 LYS A 4 17.203 -3.774 -11.287 1.00 0.00 H new ATOM 0 HE3 LYS A 4 18.690 -4.103 -12.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 17.028 -5.759 -12.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 18.345 -6.463 -11.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 16.904 -6.144 -10.955 1.00 0.00 H new ATOM 51 N LYS A 5 17.594 1.125 -9.774 1.00 0.00 N ATOM 52 CA LYS A 5 17.243 2.010 -8.667 1.00 0.00 C ATOM 53 C LYS A 5 15.740 2.232 -8.703 1.00 0.00 C ATOM 54 O LYS A 5 15.225 2.794 -9.669 1.00 0.00 O ATOM 55 CB LYS A 5 18.076 3.307 -8.738 1.00 0.00 C ATOM 56 CG LYS A 5 17.933 4.199 -7.491 1.00 0.00 C ATOM 57 CD LYS A 5 16.718 5.137 -7.557 1.00 0.00 C ATOM 58 CE LYS A 5 16.401 5.776 -6.206 1.00 0.00 C ATOM 59 NZ LYS A 5 17.225 6.962 -5.914 1.00 0.00 N ATOM 0 H LYS A 5 17.086 1.322 -10.636 1.00 0.00 H new ATOM 0 HA LYS A 5 17.486 1.566 -7.702 1.00 0.00 H new ATOM 0 HB2 LYS A 5 19.126 3.048 -8.871 1.00 0.00 H new ATOM 0 HB3 LYS A 5 17.774 3.875 -9.618 1.00 0.00 H new ATOM 0 HG2 LYS A 5 17.849 3.567 -6.607 1.00 0.00 H new ATOM 0 HG3 LYS A 5 18.838 4.794 -7.372 1.00 0.00 H new ATOM 0 HD2 LYS A 5 16.907 5.920 -8.291 1.00 0.00 H new ATOM 0 HD3 LYS A 5 15.849 4.578 -7.904 1.00 0.00 H new ATOM 0 HE2 LYS A 5 15.349 6.059 -6.184 1.00 0.00 H new ATOM 0 HE3 LYS A 5 16.549 5.037 -5.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 16.961 7.348 -4.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 18.230 6.693 -5.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 17.067 7.684 -6.646 1.00 0.00 H new ATOM 73 N VAL A 6 15.049 1.797 -7.656 1.00 0.00 N ATOM 74 CA VAL A 6 13.604 1.907 -7.492 1.00 0.00 C ATOM 75 C VAL A 6 13.259 3.212 -6.753 1.00 0.00 C ATOM 76 O VAL A 6 14.069 3.728 -5.981 1.00 0.00 O ATOM 77 CB VAL A 6 13.138 0.611 -6.787 1.00 0.00 C ATOM 78 CG1 VAL A 6 11.683 0.643 -6.301 1.00 0.00 C ATOM 79 CG2 VAL A 6 13.309 -0.574 -7.748 1.00 0.00 C ATOM 0 H VAL A 6 15.500 1.338 -6.864 1.00 0.00 H new ATOM 0 HA VAL A 6 13.069 1.982 -8.439 1.00 0.00 H new ATOM 0 HB VAL A 6 13.761 0.510 -5.898 1.00 0.00 H new ATOM 0 HG11 VAL A 6 11.439 -0.304 -5.819 1.00 0.00 H new ATOM 0 HG12 VAL A 6 11.556 1.457 -5.587 1.00 0.00 H new ATOM 0 HG13 VAL A 6 11.019 0.799 -7.151 1.00 0.00 H new ATOM 0 HG21 VAL A 6 12.982 -1.491 -7.257 1.00 0.00 H new ATOM 0 HG22 VAL A 6 12.708 -0.407 -8.642 1.00 0.00 H new ATOM 0 HG23 VAL A 6 14.358 -0.667 -8.028 1.00 0.00 H new ATOM 89 N THR A 7 12.056 3.756 -6.958 1.00 0.00 N ATOM 90 CA THR A 7 11.606 5.015 -6.361 1.00 0.00 C ATOM 91 C THR A 7 10.280 4.832 -5.622 1.00 0.00 C ATOM 92 O THR A 7 9.603 3.811 -5.762 1.00 0.00 O ATOM 93 CB THR A 7 11.457 6.076 -7.466 1.00 0.00 C ATOM 94 OG1 THR A 7 10.327 5.787 -8.261 1.00 0.00 O ATOM 95 CG2 THR A 7 12.674 6.211 -8.376 1.00 0.00 C ATOM 0 H THR A 7 11.353 3.323 -7.557 1.00 0.00 H new ATOM 0 HA THR A 7 12.349 5.343 -5.634 1.00 0.00 H new ATOM 0 HB THR A 7 11.346 7.027 -6.945 1.00 0.00 H new ATOM 0 HG1 THR A 7 10.246 6.458 -8.971 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.484 6.979 -9.125 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.544 6.491 -7.781 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.865 5.259 -8.872 1.00 0.00 H new ATOM 103 N LYS A 8 9.845 5.853 -4.871 1.00 0.00 N ATOM 104 CA LYS A 8 8.519 5.846 -4.283 1.00 0.00 C ATOM 105 C LYS A 8 7.437 5.860 -5.353 1.00 0.00 C ATOM 106 O LYS A 8 6.360 5.312 -5.145 1.00 0.00 O ATOM 107 CB LYS A 8 8.369 7.012 -3.301 1.00 0.00 C ATOM 108 CG LYS A 8 8.915 8.369 -3.764 1.00 0.00 C ATOM 109 CD LYS A 8 8.221 9.563 -3.084 1.00 0.00 C ATOM 110 CE LYS A 8 8.700 9.897 -1.661 1.00 0.00 C ATOM 111 NZ LYS A 8 10.051 10.501 -1.638 1.00 0.00 N ATOM 0 H LYS A 8 10.396 6.686 -4.663 1.00 0.00 H new ATOM 0 HA LYS A 8 8.393 4.919 -3.724 1.00 0.00 H new ATOM 0 HB2 LYS A 8 7.310 7.130 -3.071 1.00 0.00 H new ATOM 0 HB3 LYS A 8 8.869 6.742 -2.371 1.00 0.00 H new ATOM 0 HG2 LYS A 8 9.985 8.413 -3.558 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.794 8.453 -4.844 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.361 10.444 -3.710 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.150 9.364 -3.049 1.00 0.00 H new ATOM 0 HE2 LYS A 8 7.992 10.583 -1.196 1.00 0.00 H new ATOM 0 HE3 LYS A 8 8.703 8.987 -1.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 10.323 10.706 -0.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 10.735 9.838 -2.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 10.046 11.384 -2.187 1.00 0.00 H new ATOM 125 N GLU A 9 7.729 6.478 -6.492 1.00 0.00 N ATOM 126 CA GLU A 9 6.827 6.524 -7.623 1.00 0.00 C ATOM 127 C GLU A 9 6.579 5.107 -8.151 1.00 0.00 C ATOM 128 O GLU A 9 5.442 4.761 -8.466 1.00 0.00 O ATOM 129 CB GLU A 9 7.420 7.460 -8.686 1.00 0.00 C ATOM 130 CG GLU A 9 6.326 8.021 -9.595 1.00 0.00 C ATOM 131 CD GLU A 9 6.870 8.927 -10.702 1.00 0.00 C ATOM 132 OE1 GLU A 9 7.853 9.673 -10.491 1.00 0.00 O ATOM 133 OE2 GLU A 9 6.276 8.908 -11.805 1.00 0.00 O ATOM 0 H GLU A 9 8.611 6.965 -6.652 1.00 0.00 H new ATOM 0 HA GLU A 9 5.855 6.922 -7.330 1.00 0.00 H new ATOM 0 HB2 GLU A 9 7.949 8.279 -8.199 1.00 0.00 H new ATOM 0 HB3 GLU A 9 8.153 6.918 -9.284 1.00 0.00 H new ATOM 0 HG2 GLU A 9 5.778 7.194 -10.047 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.613 8.583 -8.991 1.00 0.00 H new ATOM 141 N ASP A 10 7.614 4.264 -8.187 1.00 0.00 N ATOM 142 CA ASP A 10 7.542 2.904 -8.709 1.00 0.00 C ATOM 143 C ASP A 10 6.735 2.043 -7.762 1.00 0.00 C ATOM 144 O ASP A 10 5.883 1.271 -8.188 1.00 0.00 O ATOM 145 CB ASP A 10 8.928 2.262 -8.834 1.00 0.00 C ATOM 146 CG ASP A 10 9.793 2.864 -9.927 1.00 0.00 C ATOM 147 OD1 ASP A 10 10.984 3.118 -9.661 1.00 0.00 O ATOM 148 OD2 ASP A 10 9.267 3.058 -11.050 1.00 0.00 O ATOM 0 H ASP A 10 8.542 4.516 -7.847 1.00 0.00 H new ATOM 0 HA ASP A 10 7.082 2.965 -9.695 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.448 2.356 -7.881 1.00 0.00 H new ATOM 0 HB3 ASP A 10 8.807 1.196 -9.027 1.00 0.00 H new ATOM 154 N VAL A 11 6.995 2.179 -6.466 1.00 0.00 N ATOM 155 CA VAL A 11 6.322 1.432 -5.411 1.00 0.00 C ATOM 156 C VAL A 11 4.827 1.758 -5.381 1.00 0.00 C ATOM 157 O VAL A 11 4.001 0.873 -5.158 1.00 0.00 O ATOM 158 CB VAL A 11 7.073 1.733 -4.102 1.00 0.00 C ATOM 159 CG1 VAL A 11 6.420 1.105 -2.870 1.00 0.00 C ATOM 160 CG2 VAL A 11 8.516 1.199 -4.172 1.00 0.00 C ATOM 0 H VAL A 11 7.697 2.828 -6.112 1.00 0.00 H new ATOM 0 HA VAL A 11 6.354 0.356 -5.582 1.00 0.00 H new ATOM 0 HB VAL A 11 7.048 2.818 -3.999 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.000 1.357 -1.982 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.405 1.488 -2.761 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.388 0.022 -2.987 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.032 1.421 -3.238 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.498 0.121 -4.329 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.041 1.677 -4.999 1.00 0.00 H new ATOM 170 N LEU A 12 4.447 2.999 -5.696 1.00 0.00 N ATOM 171 CA LEU A 12 3.054 3.398 -5.759 1.00 0.00 C ATOM 172 C LEU A 12 2.422 2.749 -6.972 1.00 0.00 C ATOM 173 O LEU A 12 1.325 2.216 -6.888 1.00 0.00 O ATOM 174 CB LEU A 12 2.961 4.925 -5.858 1.00 0.00 C ATOM 175 CG LEU A 12 3.130 5.586 -4.484 1.00 0.00 C ATOM 176 CD1 LEU A 12 3.513 7.059 -4.657 1.00 0.00 C ATOM 177 CD2 LEU A 12 1.850 5.466 -3.641 1.00 0.00 C ATOM 0 H LEU A 12 5.103 3.750 -5.913 1.00 0.00 H new ATOM 0 HA LEU A 12 2.527 3.079 -4.860 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.728 5.294 -6.538 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.997 5.206 -6.282 1.00 0.00 H new ATOM 0 HG LEU A 12 3.927 5.065 -3.954 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.631 7.522 -3.677 1.00 0.00 H new ATOM 0 HD12 LEU A 12 4.452 7.129 -5.207 1.00 0.00 H new ATOM 0 HD13 LEU A 12 2.729 7.576 -5.210 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.005 5.945 -2.674 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.025 5.955 -4.160 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.611 4.413 -3.490 1.00 0.00 H new ATOM 189 N ASN A 13 3.106 2.787 -8.108 1.00 0.00 N ATOM 190 CA ASN A 13 2.658 2.174 -9.333 1.00 0.00 C ATOM 191 C ASN A 13 2.535 0.658 -9.194 1.00 0.00 C ATOM 192 O ASN A 13 1.624 0.065 -9.763 1.00 0.00 O ATOM 193 CB ASN A 13 3.666 2.567 -10.408 1.00 0.00 C ATOM 194 CG ASN A 13 3.225 3.836 -11.112 1.00 0.00 C ATOM 195 OD1 ASN A 13 2.262 3.836 -11.868 1.00 0.00 O ATOM 196 ND2 ASN A 13 3.867 4.951 -10.812 1.00 0.00 N ATOM 0 H ASN A 13 4.007 3.257 -8.196 1.00 0.00 H new ATOM 0 HA ASN A 13 1.659 2.521 -9.598 1.00 0.00 H new ATOM 0 HB2 ASN A 13 4.647 2.716 -9.957 1.00 0.00 H new ATOM 0 HB3 ASN A 13 3.768 1.759 -11.132 1.00 0.00 H new ATOM 0 HD21 ASN A 13 3.563 5.838 -11.213 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.667 4.925 -10.179 1.00 0.00 H new ATOM 203 N ALA A 14 3.394 0.018 -8.398 1.00 0.00 N ATOM 204 CA ALA A 14 3.382 -1.415 -8.193 1.00 0.00 C ATOM 205 C ALA A 14 2.104 -1.783 -7.474 1.00 0.00 C ATOM 206 O ALA A 14 1.408 -2.715 -7.873 1.00 0.00 O ATOM 207 CB ALA A 14 4.593 -1.834 -7.355 1.00 0.00 C ATOM 0 H ALA A 14 4.126 0.497 -7.873 1.00 0.00 H new ATOM 0 HA ALA A 14 3.432 -1.930 -9.152 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.576 -2.914 -7.206 1.00 0.00 H new ATOM 0 HB2 ALA A 14 5.509 -1.554 -7.874 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.557 -1.333 -6.388 1.00 0.00 H new ATOM 213 N LEU A 15 1.804 -1.026 -6.418 1.00 0.00 N ATOM 214 CA LEU A 15 0.698 -1.301 -5.529 1.00 0.00 C ATOM 215 C LEU A 15 -0.669 -1.000 -6.159 1.00 0.00 C ATOM 216 O LEU A 15 -1.690 -1.341 -5.568 1.00 0.00 O ATOM 217 CB LEU A 15 0.904 -0.548 -4.203 1.00 0.00 C ATOM 218 CG LEU A 15 1.986 -1.158 -3.289 1.00 0.00 C ATOM 219 CD1 LEU A 15 2.283 -0.192 -2.137 1.00 0.00 C ATOM 220 CD2 LEU A 15 1.541 -2.507 -2.710 1.00 0.00 C ATOM 0 H LEU A 15 2.336 -0.195 -6.161 1.00 0.00 H new ATOM 0 HA LEU A 15 0.688 -2.372 -5.329 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.171 0.486 -4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.042 -0.524 -3.661 1.00 0.00 H new ATOM 0 HG LEU A 15 2.880 -1.322 -3.890 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.048 -0.622 -1.490 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.639 0.756 -2.540 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.373 -0.022 -1.561 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.329 -2.906 -2.071 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.633 -2.369 -2.123 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.345 -3.205 -3.524 1.00 0.00 H new ATOM 232 N LYS A 16 -0.736 -0.421 -7.365 1.00 0.00 N ATOM 233 CA LYS A 16 -1.964 -0.285 -8.168 1.00 0.00 C ATOM 234 C LYS A 16 -2.367 -1.623 -8.816 1.00 0.00 C ATOM 235 O LYS A 16 -2.888 -1.658 -9.933 1.00 0.00 O ATOM 236 CB LYS A 16 -1.768 0.821 -9.218 1.00 0.00 C ATOM 237 CG LYS A 16 -1.676 2.203 -8.557 1.00 0.00 C ATOM 238 CD LYS A 16 -1.255 3.289 -9.548 1.00 0.00 C ATOM 239 CE LYS A 16 -0.615 4.466 -8.815 1.00 0.00 C ATOM 240 NZ LYS A 16 -0.423 5.621 -9.712 1.00 0.00 N ATOM 0 H LYS A 16 0.083 -0.023 -7.824 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.786 -0.001 -7.511 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.860 0.627 -9.789 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.598 0.807 -9.924 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.642 2.462 -8.125 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.960 2.165 -7.736 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -0.550 2.877 -10.270 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -2.123 3.632 -10.110 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -1.244 4.758 -7.974 1.00 0.00 H new ATOM 0 HE3 LYS A 16 0.347 4.160 -8.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 0.013 6.403 -9.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 0.197 5.348 -10.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -1.344 5.927 -10.085 1.00 0.00 H new ATOM 254 N ASN A 17 -2.046 -2.730 -8.153 1.00 0.00 N ATOM 255 CA ASN A 17 -2.377 -4.084 -8.539 1.00 0.00 C ATOM 256 C ASN A 17 -2.762 -4.915 -7.302 1.00 0.00 C ATOM 257 O ASN A 17 -2.934 -6.128 -7.413 1.00 0.00 O ATOM 258 CB ASN A 17 -1.165 -4.704 -9.252 1.00 0.00 C ATOM 259 CG ASN A 17 -0.792 -4.007 -10.555 1.00 0.00 C ATOM 260 OD1 ASN A 17 -1.307 -4.320 -11.624 1.00 0.00 O ATOM 261 ND2 ASN A 17 0.146 -3.070 -10.507 1.00 0.00 N ATOM 0 H ASN A 17 -1.517 -2.696 -7.282 1.00 0.00 H new ATOM 0 HA ASN A 17 -3.232 -4.076 -9.215 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.308 -4.678 -8.579 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.376 -5.753 -9.460 1.00 0.00 H new ATOM 0 HD21 ASN A 17 0.445 -2.603 -11.363 1.00 0.00 H new ATOM 0 HD22 ASN A 17 0.568 -2.816 -9.614 1.00 0.00 H new ATOM 268 N VAL A 18 -2.848 -4.310 -6.111 1.00 0.00 N ATOM 269 CA VAL A 18 -3.055 -4.968 -4.840 1.00 0.00 C ATOM 270 C VAL A 18 -4.441 -4.516 -4.391 1.00 0.00 C ATOM 271 O VAL A 18 -4.617 -3.552 -3.635 1.00 0.00 O ATOM 272 CB VAL A 18 -1.856 -4.619 -3.941 1.00 0.00 C ATOM 273 CG1 VAL A 18 -2.058 -4.920 -2.466 1.00 0.00 C ATOM 274 CG2 VAL A 18 -0.635 -5.403 -4.425 1.00 0.00 C ATOM 0 H VAL A 18 -2.770 -3.297 -6.016 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.070 -6.058 -4.840 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.725 -3.540 -4.022 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.162 -4.642 -1.912 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.908 -4.350 -2.091 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -2.249 -5.985 -2.335 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.223 -5.165 -3.796 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.842 -6.472 -4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.414 -5.132 -5.457 1.00 0.00 H new ATOM 284 N ILE A 19 -5.438 -5.181 -4.969 1.00 0.00 N ATOM 285 CA ILE A 19 -6.837 -4.839 -4.850 1.00 0.00 C ATOM 286 C ILE A 19 -7.370 -5.641 -3.667 1.00 0.00 C ATOM 287 O ILE A 19 -7.398 -6.874 -3.723 1.00 0.00 O ATOM 288 CB ILE A 19 -7.594 -5.194 -6.138 1.00 0.00 C ATOM 289 CG1 ILE A 19 -6.973 -4.643 -7.448 1.00 0.00 C ATOM 290 CG2 ILE A 19 -9.079 -4.833 -5.987 1.00 0.00 C ATOM 291 CD1 ILE A 19 -7.513 -3.292 -7.926 1.00 0.00 C ATOM 0 H ILE A 19 -5.279 -6.002 -5.553 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.972 -3.769 -4.693 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.497 -6.273 -6.259 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -5.896 -4.553 -7.307 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.131 -5.376 -8.239 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -9.610 -5.087 -6.904 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -9.506 -5.391 -5.154 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.176 -3.764 -5.796 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.009 -3.004 -8.849 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.585 -3.372 -8.108 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -7.331 -2.536 -7.162 1.00 0.00 H new ATOM 303 N ASP A 20 -7.801 -4.927 -2.638 1.00 0.00 N ATOM 304 CA ASP A 20 -8.343 -5.481 -1.397 1.00 0.00 C ATOM 305 C ASP A 20 -9.584 -6.287 -1.764 1.00 0.00 C ATOM 306 O ASP A 20 -10.575 -5.737 -2.228 1.00 0.00 O ATOM 307 CB ASP A 20 -8.660 -4.366 -0.390 1.00 0.00 C ATOM 308 CG ASP A 20 -7.875 -4.540 0.900 1.00 0.00 C ATOM 309 OD1 ASP A 20 -8.471 -5.082 1.859 1.00 0.00 O ATOM 310 OD2 ASP A 20 -6.697 -4.111 0.953 1.00 0.00 O ATOM 0 H ASP A 20 -7.784 -3.907 -2.640 1.00 0.00 H new ATOM 0 HA ASP A 20 -7.613 -6.128 -0.911 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.425 -3.398 -0.832 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.728 -4.366 -0.170 1.00 0.00 H new ATOM 316 N PHE A 21 -9.534 -7.607 -1.640 1.00 0.00 N ATOM 317 CA PHE A 21 -10.593 -8.512 -2.059 1.00 0.00 C ATOM 318 C PHE A 21 -11.928 -8.148 -1.389 1.00 0.00 C ATOM 319 O PHE A 21 -12.995 -8.216 -2.014 1.00 0.00 O ATOM 320 CB PHE A 21 -10.138 -9.935 -1.700 1.00 0.00 C ATOM 321 CG PHE A 21 -10.847 -11.062 -2.421 1.00 0.00 C ATOM 322 CD1 PHE A 21 -10.687 -11.215 -3.812 1.00 0.00 C ATOM 323 CD2 PHE A 21 -11.596 -12.006 -1.696 1.00 0.00 C ATOM 324 CE1 PHE A 21 -11.291 -12.296 -4.476 1.00 0.00 C ATOM 325 CE2 PHE A 21 -12.187 -13.095 -2.362 1.00 0.00 C ATOM 326 CZ PHE A 21 -12.047 -13.235 -3.754 1.00 0.00 C ATOM 0 H PHE A 21 -8.733 -8.090 -1.234 1.00 0.00 H new ATOM 0 HA PHE A 21 -10.768 -8.437 -3.132 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -9.070 -10.015 -1.903 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -10.270 -10.077 -0.627 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -10.099 -10.500 -4.369 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -11.717 -11.895 -0.629 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -11.174 -12.405 -5.544 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -12.751 -13.826 -1.802 1.00 0.00 H new ATOM 0 HZ PHE A 21 -12.518 -14.061 -4.266 1.00 0.00 H new ATOM 336 N GLU A 22 -11.869 -7.723 -0.125 1.00 0.00 N ATOM 337 CA GLU A 22 -12.977 -7.303 0.709 1.00 0.00 C ATOM 338 C GLU A 22 -13.437 -5.864 0.376 1.00 0.00 C ATOM 339 O GLU A 22 -14.554 -5.474 0.741 1.00 0.00 O ATOM 340 CB GLU A 22 -12.453 -7.451 2.150 1.00 0.00 C ATOM 341 CG GLU A 22 -13.451 -7.158 3.269 1.00 0.00 C ATOM 342 CD GLU A 22 -14.482 -8.269 3.496 1.00 0.00 C ATOM 343 OE1 GLU A 22 -14.515 -8.844 4.609 1.00 0.00 O ATOM 344 OE2 GLU A 22 -15.288 -8.543 2.570 1.00 0.00 O ATOM 0 H GLU A 22 -10.979 -7.662 0.369 1.00 0.00 H new ATOM 0 HA GLU A 22 -13.871 -7.906 0.549 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -12.086 -8.470 2.277 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.598 -6.787 2.272 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -12.902 -6.992 4.196 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.976 -6.231 3.039 1.00 0.00 H new ATOM 352 N LEU A 23 -12.608 -5.052 -0.298 1.00 0.00 N ATOM 353 CA LEU A 23 -12.894 -3.662 -0.660 1.00 0.00 C ATOM 354 C LEU A 23 -12.263 -3.367 -2.021 1.00 0.00 C ATOM 355 O LEU A 23 -11.177 -2.800 -2.068 1.00 0.00 O ATOM 356 CB LEU A 23 -12.348 -2.648 0.355 1.00 0.00 C ATOM 357 CG LEU A 23 -13.097 -2.612 1.692 1.00 0.00 C ATOM 358 CD1 LEU A 23 -12.403 -3.505 2.721 1.00 0.00 C ATOM 359 CD2 LEU A 23 -13.145 -1.183 2.225 1.00 0.00 C ATOM 0 H LEU A 23 -11.689 -5.360 -0.615 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.978 -3.554 -0.680 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.300 -2.876 0.548 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.381 -1.654 -0.091 1.00 0.00 H new ATOM 0 HG LEU A 23 -14.110 -2.978 1.525 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -12.949 -3.466 3.663 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.381 -4.532 2.356 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.383 -3.154 2.878 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -13.679 -1.167 3.175 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -12.130 -0.816 2.373 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.661 -0.544 1.508 1.00 0.00 H new ATOM 371 N GLY A 24 -12.919 -3.773 -3.111 1.00 0.00 N ATOM 372 CA GLY A 24 -12.280 -4.083 -4.387 1.00 0.00 C ATOM 373 C GLY A 24 -11.824 -2.886 -5.211 1.00 0.00 C ATOM 374 O GLY A 24 -12.264 -2.724 -6.349 1.00 0.00 O ATOM 0 H GLY A 24 -13.931 -3.897 -3.129 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.415 -4.717 -4.193 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -12.976 -4.669 -4.987 1.00 0.00 H new ATOM 378 N LEU A 25 -10.926 -2.087 -4.653 1.00 0.00 N ATOM 379 CA LEU A 25 -10.067 -1.052 -5.198 1.00 0.00 C ATOM 380 C LEU A 25 -8.709 -1.316 -4.569 1.00 0.00 C ATOM 381 O LEU A 25 -8.563 -2.019 -3.567 1.00 0.00 O ATOM 382 CB LEU A 25 -10.599 0.346 -4.812 1.00 0.00 C ATOM 383 CG LEU A 25 -11.662 0.993 -5.726 1.00 0.00 C ATOM 384 CD1 LEU A 25 -11.158 1.188 -7.157 1.00 0.00 C ATOM 385 CD2 LEU A 25 -13.016 0.277 -5.764 1.00 0.00 C ATOM 0 H LEU A 25 -10.762 -2.167 -3.649 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.022 -1.071 -6.287 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -11.018 0.279 -3.808 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.748 1.024 -4.757 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.833 1.961 -5.256 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -11.942 1.646 -7.760 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -10.281 1.836 -7.149 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -10.891 0.221 -7.584 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -13.691 0.810 -6.434 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -12.878 -0.743 -6.124 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -13.443 0.253 -4.762 1.00 0.00 H new ATOM 397 N ASP A 26 -7.695 -0.772 -5.221 1.00 0.00 N ATOM 398 CA ASP A 26 -6.326 -0.965 -4.798 1.00 0.00 C ATOM 399 C ASP A 26 -6.101 -0.272 -3.459 1.00 0.00 C ATOM 400 O ASP A 26 -6.695 0.775 -3.201 1.00 0.00 O ATOM 401 CB ASP A 26 -5.396 -0.321 -5.803 1.00 0.00 C ATOM 402 CG ASP A 26 -5.194 -1.070 -7.097 1.00 0.00 C ATOM 403 OD1 ASP A 26 -4.638 -2.178 -7.034 1.00 0.00 O ATOM 404 OD2 ASP A 26 -5.509 -0.456 -8.149 1.00 0.00 O ATOM 0 H ASP A 26 -7.800 -0.189 -6.052 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.131 -2.034 -4.715 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -5.780 0.672 -6.038 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -4.423 -0.184 -5.331 1.00 0.00 H new ATOM 410 N VAL A 27 -5.130 -0.724 -2.672 1.00 0.00 N ATOM 411 CA VAL A 27 -4.591 0.019 -1.545 1.00 0.00 C ATOM 412 C VAL A 27 -4.237 1.471 -1.899 1.00 0.00 C ATOM 413 O VAL A 27 -4.375 2.373 -1.067 1.00 0.00 O ATOM 414 CB VAL A 27 -3.372 -0.734 -0.990 1.00 0.00 C ATOM 415 CG1 VAL A 27 -3.782 -2.093 -0.412 1.00 0.00 C ATOM 416 CG2 VAL A 27 -2.238 -0.936 -1.998 1.00 0.00 C ATOM 0 H VAL A 27 -4.689 -1.634 -2.805 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.365 0.085 -0.781 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.981 -0.088 -0.204 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.901 -2.605 -0.026 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -4.498 -1.944 0.396 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.240 -2.698 -1.195 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.419 -1.476 -1.522 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.605 -1.511 -2.848 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.881 0.034 -2.343 1.00 0.00 H new ATOM 426 N VAL A 28 -3.732 1.731 -3.106 1.00 0.00 N ATOM 427 CA VAL A 28 -3.329 3.079 -3.508 1.00 0.00 C ATOM 428 C VAL A 28 -4.600 3.906 -3.750 1.00 0.00 C ATOM 429 O VAL A 28 -4.679 5.056 -3.326 1.00 0.00 O ATOM 430 CB VAL A 28 -2.420 3.020 -4.752 1.00 0.00 C ATOM 431 CG1 VAL A 28 -1.799 4.391 -5.051 1.00 0.00 C ATOM 432 CG2 VAL A 28 -1.275 2.027 -4.541 1.00 0.00 C ATOM 0 H VAL A 28 -3.592 1.021 -3.825 1.00 0.00 H new ATOM 0 HA VAL A 28 -2.744 3.558 -2.723 1.00 0.00 H new ATOM 0 HB VAL A 28 -3.047 2.705 -5.586 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -1.163 4.318 -5.933 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.591 5.117 -5.234 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.201 4.713 -4.199 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.647 2.002 -5.431 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.678 2.337 -3.684 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.684 1.034 -4.357 1.00 0.00 H new ATOM 442 N SER A 29 -5.623 3.289 -4.346 1.00 0.00 N ATOM 443 CA SER A 29 -6.947 3.874 -4.549 1.00 0.00 C ATOM 444 C SER A 29 -7.670 4.122 -3.223 1.00 0.00 C ATOM 445 O SER A 29 -8.411 5.095 -3.083 1.00 0.00 O ATOM 446 CB SER A 29 -7.795 2.913 -5.388 1.00 0.00 C ATOM 447 OG SER A 29 -7.581 3.077 -6.774 1.00 0.00 O ATOM 0 H SER A 29 -5.549 2.340 -4.711 1.00 0.00 H new ATOM 0 HA SER A 29 -6.814 4.830 -5.055 1.00 0.00 H new ATOM 0 HB2 SER A 29 -7.562 1.886 -5.106 1.00 0.00 H new ATOM 0 HB3 SER A 29 -8.850 3.073 -5.164 1.00 0.00 H new ATOM 0 HG SER A 29 -8.141 2.443 -7.269 1.00 0.00 H new ATOM 453 N LEU A 30 -7.486 3.242 -2.240 1.00 0.00 N ATOM 454 CA LEU A 30 -7.925 3.423 -0.864 1.00 0.00 C ATOM 455 C LEU A 30 -7.162 4.565 -0.188 1.00 0.00 C ATOM 456 O LEU A 30 -7.508 4.938 0.924 1.00 0.00 O ATOM 457 CB LEU A 30 -7.750 2.101 -0.086 1.00 0.00 C ATOM 458 CG LEU A 30 -9.015 1.215 -0.067 1.00 0.00 C ATOM 459 CD1 LEU A 30 -8.699 -0.255 -0.347 1.00 0.00 C ATOM 460 CD2 LEU A 30 -9.701 1.299 1.300 1.00 0.00 C ATOM 0 H LEU A 30 -7.010 2.352 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 30 -8.981 3.694 -0.864 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -6.929 1.536 -0.528 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -7.463 2.330 0.940 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.668 1.591 -0.855 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.621 -0.836 -0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.238 -0.347 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.013 -0.631 0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.591 0.670 1.300 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -9.014 0.955 2.074 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -9.987 2.332 1.501 1.00 0.00 H new ATOM 472 N GLY A 31 -6.135 5.149 -0.809 1.00 0.00 N ATOM 473 CA GLY A 31 -5.393 6.232 -0.192 1.00 0.00 C ATOM 474 C GLY A 31 -4.707 5.769 1.089 1.00 0.00 C ATOM 475 O GLY A 31 -4.572 6.574 2.022 1.00 0.00 O ATOM 0 H GLY A 31 -5.804 4.885 -1.737 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.647 6.610 -0.891 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.068 7.058 0.032 1.00 0.00 H new ATOM 479 N LEU A 32 -4.314 4.484 1.163 1.00 0.00 N ATOM 480 CA LEU A 32 -3.470 3.973 2.241 1.00 0.00 C ATOM 481 C LEU A 32 -2.079 4.621 2.097 1.00 0.00 C ATOM 482 O LEU A 32 -1.931 5.630 1.409 1.00 0.00 O ATOM 483 CB LEU A 32 -3.418 2.423 2.250 1.00 0.00 C ATOM 484 CG LEU A 32 -4.768 1.679 2.154 1.00 0.00 C ATOM 485 CD1 LEU A 32 -4.596 0.160 2.190 1.00 0.00 C ATOM 486 CD2 LEU A 32 -5.779 2.080 3.226 1.00 0.00 C ATOM 0 H LEU A 32 -4.576 3.778 0.475 1.00 0.00 H new ATOM 0 HA LEU A 32 -3.891 4.242 3.210 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.792 2.100 1.418 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.920 2.105 3.166 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.167 1.985 1.187 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.573 -0.319 2.120 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -3.976 -0.156 1.351 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.116 -0.130 3.125 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.699 1.512 3.089 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -5.366 1.869 4.213 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.994 3.145 3.143 1.00 0.00 H new ATOM 498 N VAL A 33 -1.052 4.050 2.731 1.00 0.00 N ATOM 499 CA VAL A 33 0.342 4.502 2.714 1.00 0.00 C ATOM 500 C VAL A 33 0.508 5.839 3.463 1.00 0.00 C ATOM 501 O VAL A 33 -0.389 6.686 3.524 1.00 0.00 O ATOM 502 CB VAL A 33 0.885 4.496 1.261 1.00 0.00 C ATOM 503 CG1 VAL A 33 2.296 5.069 1.118 1.00 0.00 C ATOM 504 CG2 VAL A 33 0.886 3.090 0.639 1.00 0.00 C ATOM 0 H VAL A 33 -1.177 3.214 3.301 1.00 0.00 H new ATOM 0 HA VAL A 33 0.965 3.801 3.269 1.00 0.00 H new ATOM 0 HB VAL A 33 0.190 5.146 0.729 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.601 5.028 0.072 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.304 6.104 1.459 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.990 4.483 1.721 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.275 3.142 -0.378 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.515 2.429 1.235 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.132 2.701 0.618 1.00 0.00 H new ATOM 514 N TYR A 34 1.672 6.019 4.074 1.00 0.00 N ATOM 515 CA TYR A 34 2.119 7.219 4.756 1.00 0.00 C ATOM 516 C TYR A 34 3.501 7.555 4.200 1.00 0.00 C ATOM 517 O TYR A 34 3.632 8.485 3.404 1.00 0.00 O ATOM 518 CB TYR A 34 2.138 6.990 6.277 1.00 0.00 C ATOM 519 CG TYR A 34 0.786 7.009 6.971 1.00 0.00 C ATOM 520 CD1 TYR A 34 -0.014 8.171 6.961 1.00 0.00 C ATOM 521 CD2 TYR A 34 0.369 5.886 7.707 1.00 0.00 C ATOM 522 CE1 TYR A 34 -1.203 8.223 7.715 1.00 0.00 C ATOM 523 CE2 TYR A 34 -0.821 5.930 8.451 1.00 0.00 C ATOM 524 CZ TYR A 34 -1.608 7.100 8.475 1.00 0.00 C ATOM 525 OH TYR A 34 -2.747 7.114 9.212 1.00 0.00 O ATOM 0 H TYR A 34 2.373 5.279 4.106 1.00 0.00 H new ATOM 0 HA TYR A 34 1.444 8.057 4.585 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.612 6.028 6.474 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.768 7.754 6.732 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.287 9.025 6.372 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.966 4.986 7.700 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -1.805 9.120 7.713 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -1.136 5.061 9.009 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.208 7.970 9.086 1.00 0.00 H new ATOM 535 N ASP A 35 4.522 6.792 4.583 1.00 0.00 N ATOM 536 CA ASP A 35 5.922 6.985 4.198 1.00 0.00 C ATOM 537 C ASP A 35 6.269 6.009 3.076 1.00 0.00 C ATOM 538 O ASP A 35 5.712 4.908 3.061 1.00 0.00 O ATOM 539 CB ASP A 35 6.814 6.670 5.401 1.00 0.00 C ATOM 540 CG ASP A 35 8.195 7.312 5.284 1.00 0.00 C ATOM 541 OD1 ASP A 35 9.061 6.728 4.614 1.00 0.00 O ATOM 542 OD2 ASP A 35 8.452 8.323 5.990 1.00 0.00 O ATOM 0 H ASP A 35 4.393 5.987 5.196 1.00 0.00 H new ATOM 0 HA ASP A 35 6.075 8.012 3.868 1.00 0.00 H new ATOM 0 HB2 ASP A 35 6.329 7.021 6.312 1.00 0.00 H new ATOM 0 HB3 ASP A 35 6.925 5.590 5.495 1.00 0.00 H new ATOM 548 N ILE A 36 7.173 6.390 2.173 1.00 0.00 N ATOM 549 CA ILE A 36 7.725 5.556 1.113 1.00 0.00 C ATOM 550 C ILE A 36 9.173 6.017 0.931 1.00 0.00 C ATOM 551 O ILE A 36 9.438 7.018 0.252 1.00 0.00 O ATOM 552 CB ILE A 36 6.938 5.688 -0.216 1.00 0.00 C ATOM 553 CG1 ILE A 36 5.404 5.812 -0.096 1.00 0.00 C ATOM 554 CG2 ILE A 36 7.284 4.491 -1.126 1.00 0.00 C ATOM 555 CD1 ILE A 36 4.814 6.447 -1.354 1.00 0.00 C ATOM 0 H ILE A 36 7.557 7.335 2.163 1.00 0.00 H new ATOM 0 HA ILE A 36 7.659 4.503 1.386 1.00 0.00 H new ATOM 0 HB ILE A 36 7.258 6.641 -0.638 1.00 0.00 H new ATOM 0 HG12 ILE A 36 4.966 4.826 0.060 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.150 6.415 0.775 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.734 4.576 -2.063 1.00 0.00 H new ATOM 0 HG22 ILE A 36 8.354 4.488 -1.332 1.00 0.00 H new ATOM 0 HG23 ILE A 36 7.008 3.562 -0.626 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.732 6.525 -1.249 1.00 0.00 H new ATOM 0 HD12 ILE A 36 5.238 7.442 -1.493 1.00 0.00 H new ATOM 0 HD13 ILE A 36 5.051 5.828 -2.219 1.00 0.00 H new ATOM 567 N GLN A 37 10.124 5.303 1.518 1.00 0.00 N ATOM 568 CA GLN A 37 11.540 5.601 1.409 1.00 0.00 C ATOM 569 C GLN A 37 12.250 4.393 0.847 1.00 0.00 C ATOM 570 O GLN A 37 12.060 3.279 1.323 1.00 0.00 O ATOM 571 CB GLN A 37 12.132 6.033 2.744 1.00 0.00 C ATOM 572 CG GLN A 37 12.022 4.997 3.863 1.00 0.00 C ATOM 573 CD GLN A 37 12.388 5.623 5.196 1.00 0.00 C ATOM 574 OE1 GLN A 37 13.399 5.289 5.805 1.00 0.00 O ATOM 575 NE2 GLN A 37 11.612 6.581 5.657 1.00 0.00 N ATOM 0 H GLN A 37 9.926 4.485 2.094 1.00 0.00 H new ATOM 0 HA GLN A 37 11.676 6.444 0.732 1.00 0.00 H new ATOM 0 HB2 GLN A 37 13.184 6.276 2.596 1.00 0.00 H new ATOM 0 HB3 GLN A 37 11.635 6.948 3.066 1.00 0.00 H new ATOM 0 HG2 GLN A 37 11.007 4.603 3.905 1.00 0.00 H new ATOM 0 HG3 GLN A 37 12.682 4.155 3.655 1.00 0.00 H new ATOM 0 HE21 GLN A 37 10.774 6.850 5.142 1.00 0.00 H new ATOM 0 HE22 GLN A 37 11.849 7.054 6.529 1.00 0.00 H new ATOM 584 N ILE A 38 13.057 4.609 -0.182 1.00 0.00 N ATOM 585 CA ILE A 38 13.797 3.543 -0.816 1.00 0.00 C ATOM 586 C ILE A 38 15.257 3.898 -0.617 1.00 0.00 C ATOM 587 O ILE A 38 15.716 4.970 -1.030 1.00 0.00 O ATOM 588 CB ILE A 38 13.335 3.361 -2.270 1.00 0.00 C ATOM 589 CG1 ILE A 38 11.823 3.063 -2.342 1.00 0.00 C ATOM 590 CG2 ILE A 38 14.098 2.220 -2.942 1.00 0.00 C ATOM 591 CD1 ILE A 38 10.965 4.308 -2.359 1.00 0.00 C ATOM 0 H ILE A 38 13.213 5.528 -0.595 1.00 0.00 H new ATOM 0 HA ILE A 38 13.624 2.558 -0.382 1.00 0.00 H new ATOM 0 HB ILE A 38 13.540 4.295 -2.793 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.618 2.477 -3.238 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.540 2.448 -1.488 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.755 2.109 -3.971 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.165 2.443 -2.938 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.919 1.293 -2.398 1.00 0.00 H new ATOM 0 HD11 ILE A 38 9.914 4.025 -2.410 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.142 4.884 -1.451 1.00 0.00 H new ATOM 0 HD13 ILE A 38 11.220 4.914 -3.228 1.00 0.00 H new ATOM 603 N ASP A 39 15.967 3.056 0.128 1.00 0.00 N ATOM 604 CA ASP A 39 17.404 3.207 0.309 1.00 0.00 C ATOM 605 C ASP A 39 18.092 3.073 -1.043 1.00 0.00 C ATOM 606 O ASP A 39 17.505 2.575 -1.998 1.00 0.00 O ATOM 607 CB ASP A 39 17.933 2.132 1.260 1.00 0.00 C ATOM 608 CG ASP A 39 19.175 2.582 2.023 1.00 0.00 C ATOM 609 OD1 ASP A 39 20.171 1.817 2.012 1.00 0.00 O ATOM 610 OD2 ASP A 39 19.164 3.687 2.613 1.00 0.00 O ATOM 0 H ASP A 39 15.565 2.257 0.619 1.00 0.00 H new ATOM 0 HA ASP A 39 17.611 4.188 0.737 1.00 0.00 H new ATOM 0 HB2 ASP A 39 17.151 1.865 1.971 1.00 0.00 H new ATOM 0 HB3 ASP A 39 18.167 1.232 0.691 1.00 0.00 H new ATOM 616 N ASP A 40 19.361 3.432 -1.135 1.00 0.00 N ATOM 617 CA ASP A 40 20.143 3.253 -2.365 1.00 0.00 C ATOM 618 C ASP A 40 20.475 1.776 -2.587 1.00 0.00 C ATOM 619 O ASP A 40 20.815 1.350 -3.691 1.00 0.00 O ATOM 620 CB ASP A 40 21.410 4.113 -2.308 1.00 0.00 C ATOM 621 CG ASP A 40 21.137 5.577 -2.668 1.00 0.00 C ATOM 622 OD1 ASP A 40 22.120 6.358 -2.725 1.00 0.00 O ATOM 623 OD2 ASP A 40 19.975 5.962 -2.925 1.00 0.00 O ATOM 0 H ASP A 40 19.884 3.855 -0.368 1.00 0.00 H new ATOM 0 HA ASP A 40 19.547 3.582 -3.216 1.00 0.00 H new ATOM 0 HB2 ASP A 40 21.837 4.061 -1.306 1.00 0.00 H new ATOM 0 HB3 ASP A 40 22.154 3.706 -2.993 1.00 0.00 H new ATOM 629 N GLN A 41 20.310 0.960 -1.545 1.00 0.00 N ATOM 630 CA GLN A 41 20.242 -0.492 -1.621 1.00 0.00 C ATOM 631 C GLN A 41 18.903 -0.985 -2.179 1.00 0.00 C ATOM 632 O GLN A 41 18.697 -2.193 -2.225 1.00 0.00 O ATOM 633 CB GLN A 41 20.509 -1.073 -0.234 1.00 0.00 C ATOM 634 CG GLN A 41 21.851 -0.660 0.382 1.00 0.00 C ATOM 635 CD GLN A 41 23.060 -0.977 -0.487 1.00 0.00 C ATOM 636 OE1 GLN A 41 23.772 -1.945 -0.271 1.00 0.00 O ATOM 637 NE2 GLN A 41 23.326 -0.107 -1.443 1.00 0.00 N ATOM 0 H GLN A 41 20.217 1.310 -0.591 1.00 0.00 H new ATOM 0 HA GLN A 41 21.005 -0.837 -2.318 1.00 0.00 H new ATOM 0 HB2 GLN A 41 19.706 -0.765 0.436 1.00 0.00 H new ATOM 0 HB3 GLN A 41 20.472 -2.161 -0.296 1.00 0.00 H new ATOM 0 HG2 GLN A 41 21.832 0.411 0.582 1.00 0.00 H new ATOM 0 HG3 GLN A 41 21.967 -1.161 1.343 1.00 0.00 H new ATOM 0 HE21 GLN A 41 22.708 0.690 -1.594 1.00 0.00 H new ATOM 0 HE22 GLN A 41 24.150 -0.232 -2.031 1.00 0.00 H new ATOM 646 N ASN A 42 17.994 -0.093 -2.589 1.00 0.00 N ATOM 647 CA ASN A 42 16.601 -0.364 -2.946 1.00 0.00 C ATOM 648 C ASN A 42 15.896 -1.166 -1.860 1.00 0.00 C ATOM 649 O ASN A 42 15.053 -2.022 -2.144 1.00 0.00 O ATOM 650 CB ASN A 42 16.489 -1.047 -4.307 1.00 0.00 C ATOM 651 CG ASN A 42 17.016 -0.228 -5.454 1.00 0.00 C ATOM 652 OD1 ASN A 42 16.764 0.967 -5.544 1.00 0.00 O ATOM 653 ND2 ASN A 42 17.709 -0.881 -6.365 1.00 0.00 N ATOM 0 H ASN A 42 18.227 0.895 -2.685 1.00 0.00 H new ATOM 0 HA ASN A 42 16.094 0.598 -3.026 1.00 0.00 H new ATOM 0 HB2 ASN A 42 17.030 -1.993 -4.272 1.00 0.00 H new ATOM 0 HB3 ASN A 42 15.442 -1.285 -4.496 1.00 0.00 H new ATOM 0 HD21 ASN A 42 18.060 -0.390 -7.188 1.00 0.00 H new ATOM 0 HD22 ASN A 42 17.895 -1.877 -6.248 1.00 0.00 H new ATOM 660 N ASN A 43 16.236 -0.887 -0.602 1.00 0.00 N ATOM 661 CA ASN A 43 15.468 -1.369 0.531 1.00 0.00 C ATOM 662 C ASN A 43 14.224 -0.512 0.541 1.00 0.00 C ATOM 663 O ASN A 43 14.276 0.651 0.943 1.00 0.00 O ATOM 664 CB ASN A 43 16.250 -1.261 1.839 1.00 0.00 C ATOM 665 CG ASN A 43 17.555 -2.027 1.757 1.00 0.00 C ATOM 666 OD1 ASN A 43 17.640 -3.057 1.105 1.00 0.00 O ATOM 667 ND2 ASN A 43 18.617 -1.528 2.357 1.00 0.00 N ATOM 0 H ASN A 43 17.047 -0.324 -0.347 1.00 0.00 H new ATOM 0 HA ASN A 43 15.230 -2.429 0.441 1.00 0.00 H new ATOM 0 HB2 ASN A 43 16.453 -0.213 2.060 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.647 -1.649 2.660 1.00 0.00 H new ATOM 0 HD21 ASN A 43 19.517 -2.002 2.279 1.00 0.00 H new ATOM 0 HD22 ASN A 43 18.539 -0.668 2.900 1.00 0.00 H new ATOM 674 N VAL A 44 13.163 -1.025 -0.063 1.00 0.00 N ATOM 675 CA VAL A 44 11.897 -0.343 -0.195 1.00 0.00 C ATOM 676 C VAL A 44 11.215 -0.426 1.163 1.00 0.00 C ATOM 677 O VAL A 44 10.891 -1.531 1.613 1.00 0.00 O ATOM 678 CB VAL A 44 11.117 -1.021 -1.342 1.00 0.00 C ATOM 679 CG1 VAL A 44 9.636 -0.625 -1.352 1.00 0.00 C ATOM 680 CG2 VAL A 44 11.731 -0.679 -2.708 1.00 0.00 C ATOM 0 H VAL A 44 13.165 -1.954 -0.485 1.00 0.00 H new ATOM 0 HA VAL A 44 11.981 0.712 -0.458 1.00 0.00 H new ATOM 0 HB VAL A 44 11.188 -2.094 -1.164 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.131 -1.128 -2.177 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.174 -0.920 -0.410 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.549 0.454 -1.477 1.00 0.00 H new ATOM 0 HG21 VAL A 44 11.161 -1.170 -3.496 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.704 0.400 -2.859 1.00 0.00 H new ATOM 0 HG23 VAL A 44 12.765 -1.024 -2.739 1.00 0.00 H new ATOM 690 N LYS A 45 11.001 0.710 1.834 1.00 0.00 N ATOM 691 CA LYS A 45 10.349 0.749 3.113 1.00 0.00 C ATOM 692 C LYS A 45 9.132 1.624 2.953 1.00 0.00 C ATOM 693 O LYS A 45 9.216 2.726 2.407 1.00 0.00 O ATOM 694 CB LYS A 45 11.350 1.294 4.123 1.00 0.00 C ATOM 695 CG LYS A 45 10.743 1.250 5.520 1.00 0.00 C ATOM 696 CD LYS A 45 11.660 1.835 6.592 1.00 0.00 C ATOM 697 CE LYS A 45 10.716 2.075 7.760 1.00 0.00 C ATOM 698 NZ LYS A 45 11.405 2.542 8.980 1.00 0.00 N ATOM 0 H LYS A 45 11.284 1.627 1.488 1.00 0.00 H new ATOM 0 HA LYS A 45 10.023 -0.228 3.471 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.267 0.705 4.095 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.621 2.318 3.865 1.00 0.00 H new ATOM 0 HG2 LYS A 45 9.801 1.799 5.518 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.509 0.216 5.775 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.462 1.146 6.857 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.132 2.759 6.258 1.00 0.00 H new ATOM 0 HE2 LYS A 45 9.968 2.812 7.468 1.00 0.00 H new ATOM 0 HE3 LYS A 45 10.183 1.151 7.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.708 2.687 9.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.100 1.829 9.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.892 3.439 8.782 1.00 0.00 H new ATOM 712 N VAL A 46 8.004 1.100 3.400 1.00 0.00 N ATOM 713 CA VAL A 46 6.714 1.724 3.228 1.00 0.00 C ATOM 714 C VAL A 46 5.998 1.599 4.558 1.00 0.00 C ATOM 715 O VAL A 46 5.830 0.488 5.064 1.00 0.00 O ATOM 716 CB VAL A 46 5.942 1.064 2.068 1.00 0.00 C ATOM 717 CG1 VAL A 46 4.701 1.899 1.725 1.00 0.00 C ATOM 718 CG2 VAL A 46 6.803 0.908 0.805 1.00 0.00 C ATOM 0 H VAL A 46 7.964 0.213 3.901 1.00 0.00 H new ATOM 0 HA VAL A 46 6.802 2.776 2.955 1.00 0.00 H new ATOM 0 HB VAL A 46 5.653 0.068 2.403 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.160 1.427 0.905 1.00 0.00 H new ATOM 0 HG12 VAL A 46 4.052 1.962 2.599 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.008 2.902 1.428 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.213 0.438 0.018 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.139 1.889 0.470 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.669 0.285 1.030 1.00 0.00 H new ATOM 728 N LEU A 47 5.569 2.726 5.120 1.00 0.00 N ATOM 729 CA LEU A 47 4.587 2.747 6.192 1.00 0.00 C ATOM 730 C LEU A 47 3.230 2.636 5.513 1.00 0.00 C ATOM 731 O LEU A 47 2.767 3.621 4.935 1.00 0.00 O ATOM 732 CB LEU A 47 4.704 4.045 7.018 1.00 0.00 C ATOM 733 CG LEU A 47 5.474 3.893 8.334 1.00 0.00 C ATOM 734 CD1 LEU A 47 6.958 3.575 8.129 1.00 0.00 C ATOM 735 CD2 LEU A 47 5.365 5.184 9.146 1.00 0.00 C ATOM 0 H LEU A 47 5.896 3.651 4.842 1.00 0.00 H new ATOM 0 HA LEU A 47 4.740 1.929 6.896 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.195 4.805 6.410 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.702 4.412 7.238 1.00 0.00 H new ATOM 0 HG LEU A 47 5.023 3.053 8.861 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.447 3.480 9.098 1.00 0.00 H new ATOM 0 HD12 LEU A 47 7.057 2.639 7.579 1.00 0.00 H new ATOM 0 HD13 LEU A 47 7.428 4.380 7.563 1.00 0.00 H new ATOM 0 HD21 LEU A 47 5.914 5.073 10.081 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.787 6.010 8.574 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.317 5.390 9.362 1.00 0.00 H new ATOM 747 N MET A 48 2.599 1.460 5.537 1.00 0.00 N ATOM 748 CA MET A 48 1.205 1.311 5.122 1.00 0.00 C ATOM 749 C MET A 48 0.317 1.284 6.368 1.00 0.00 C ATOM 750 O MET A 48 0.799 1.390 7.496 1.00 0.00 O ATOM 751 CB MET A 48 1.033 0.123 4.149 1.00 0.00 C ATOM 752 CG MET A 48 -0.283 0.213 3.351 1.00 0.00 C ATOM 753 SD MET A 48 -0.384 -0.770 1.834 1.00 0.00 S ATOM 754 CE MET A 48 -1.087 -2.308 2.505 1.00 0.00 C ATOM 0 H MET A 48 3.037 0.591 5.842 1.00 0.00 H new ATOM 0 HA MET A 48 0.877 2.169 4.535 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.875 0.097 3.457 1.00 0.00 H new ATOM 0 HB3 MET A 48 1.053 -0.811 4.711 1.00 0.00 H new ATOM 0 HG2 MET A 48 -1.100 -0.089 4.007 1.00 0.00 H new ATOM 0 HG3 MET A 48 -0.452 1.258 3.091 1.00 0.00 H new ATOM 0 HE1 MET A 48 -1.217 -3.031 1.699 1.00 0.00 H new ATOM 0 HE2 MET A 48 -0.412 -2.719 3.256 1.00 0.00 H new ATOM 0 HE3 MET A 48 -2.054 -2.097 2.962 1.00 0.00 H new ATOM 764 N THR A 49 -0.992 1.248 6.167 1.00 0.00 N ATOM 765 CA THR A 49 -2.039 1.096 7.164 1.00 0.00 C ATOM 766 C THR A 49 -3.166 0.373 6.436 1.00 0.00 C ATOM 767 O THR A 49 -3.389 0.654 5.259 1.00 0.00 O ATOM 768 CB THR A 49 -2.440 2.479 7.728 1.00 0.00 C ATOM 769 OG1 THR A 49 -3.560 2.412 8.599 1.00 0.00 O ATOM 770 CG2 THR A 49 -2.738 3.535 6.655 1.00 0.00 C ATOM 0 H THR A 49 -1.379 1.331 5.227 1.00 0.00 H new ATOM 0 HA THR A 49 -1.734 0.522 8.039 1.00 0.00 H new ATOM 0 HB THR A 49 -1.553 2.790 8.280 1.00 0.00 H new ATOM 0 HG1 THR A 49 -3.772 3.310 8.929 1.00 0.00 H new ATOM 0 HG21 THR A 49 -3.011 4.475 7.135 1.00 0.00 H new ATOM 0 HG22 THR A 49 -1.852 3.687 6.038 1.00 0.00 H new ATOM 0 HG23 THR A 49 -3.563 3.195 6.029 1.00 0.00 H new ATOM 778 N MET A 50 -3.876 -0.531 7.107 1.00 0.00 N ATOM 779 CA MET A 50 -5.115 -1.106 6.583 1.00 0.00 C ATOM 780 C MET A 50 -6.269 -0.156 6.925 1.00 0.00 C ATOM 781 O MET A 50 -6.111 0.717 7.792 1.00 0.00 O ATOM 782 CB MET A 50 -5.339 -2.512 7.171 1.00 0.00 C ATOM 783 CG MET A 50 -4.672 -3.632 6.362 1.00 0.00 C ATOM 784 SD MET A 50 -2.892 -3.490 6.071 1.00 0.00 S ATOM 785 CE MET A 50 -2.678 -4.934 4.991 1.00 0.00 C ATOM 0 H MET A 50 -3.611 -0.885 8.026 1.00 0.00 H new ATOM 0 HA MET A 50 -5.058 -1.218 5.500 1.00 0.00 H new ATOM 0 HB2 MET A 50 -4.956 -2.535 8.191 1.00 0.00 H new ATOM 0 HB3 MET A 50 -6.410 -2.706 7.229 1.00 0.00 H new ATOM 0 HG2 MET A 50 -4.857 -4.576 6.875 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.169 -3.692 5.394 1.00 0.00 H new ATOM 0 HE1 MET A 50 -1.656 -4.958 4.614 1.00 0.00 H new ATOM 0 HE2 MET A 50 -2.878 -5.844 5.557 1.00 0.00 H new ATOM 0 HE3 MET A 50 -3.372 -4.868 4.153 1.00 0.00 H new ATOM 795 N THR A 51 -7.434 -0.345 6.291 1.00 0.00 N ATOM 796 CA THR A 51 -8.656 0.400 6.620 1.00 0.00 C ATOM 797 C THR A 51 -9.042 0.217 8.090 1.00 0.00 C ATOM 798 O THR A 51 -9.432 1.180 8.756 1.00 0.00 O ATOM 799 CB THR A 51 -9.821 0.023 5.668 1.00 0.00 C ATOM 800 OG1 THR A 51 -11.014 0.685 6.007 1.00 0.00 O ATOM 801 CG2 THR A 51 -10.141 -1.474 5.543 1.00 0.00 C ATOM 0 H THR A 51 -7.556 -1.019 5.535 1.00 0.00 H new ATOM 0 HA THR A 51 -8.448 1.459 6.471 1.00 0.00 H new ATOM 0 HB THR A 51 -9.439 0.349 4.701 1.00 0.00 H new ATOM 0 HG1 THR A 51 -10.953 1.626 5.741 1.00 0.00 H new ATOM 0 HG21 THR A 51 -10.972 -1.612 4.851 1.00 0.00 H new ATOM 0 HG22 THR A 51 -9.265 -2.003 5.168 1.00 0.00 H new ATOM 0 HG23 THR A 51 -10.414 -1.871 6.521 1.00 0.00 H new ATOM 809 N THR A 52 -8.967 -1.020 8.594 1.00 0.00 N ATOM 810 CA THR A 52 -9.535 -1.375 9.882 1.00 0.00 C ATOM 811 C THR A 52 -8.714 -2.516 10.494 1.00 0.00 C ATOM 812 O THR A 52 -8.354 -3.433 9.749 1.00 0.00 O ATOM 813 CB THR A 52 -10.995 -1.827 9.686 1.00 0.00 C ATOM 814 OG1 THR A 52 -11.073 -2.988 8.870 1.00 0.00 O ATOM 815 CG2 THR A 52 -11.901 -0.780 9.025 1.00 0.00 C ATOM 0 H THR A 52 -8.510 -1.796 8.115 1.00 0.00 H new ATOM 0 HA THR A 52 -9.512 -0.514 10.550 1.00 0.00 H new ATOM 0 HB THR A 52 -11.345 -2.011 10.702 1.00 0.00 H new ATOM 0 HG1 THR A 52 -10.203 -3.439 8.859 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.909 -1.182 8.926 1.00 0.00 H new ATOM 0 HG22 THR A 52 -11.927 0.119 9.641 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.511 -0.532 8.038 1.00 0.00 H new ATOM 823 N PRO A 53 -8.500 -2.559 11.818 1.00 0.00 N ATOM 824 CA PRO A 53 -7.752 -3.627 12.476 1.00 0.00 C ATOM 825 C PRO A 53 -8.522 -4.955 12.540 1.00 0.00 C ATOM 826 O PRO A 53 -7.962 -5.966 12.970 1.00 0.00 O ATOM 827 CB PRO A 53 -7.437 -3.080 13.870 1.00 0.00 C ATOM 828 CG PRO A 53 -8.623 -2.162 14.162 1.00 0.00 C ATOM 829 CD PRO A 53 -8.941 -1.571 12.789 1.00 0.00 C ATOM 0 HA PRO A 53 -6.851 -3.877 11.916 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -7.355 -3.879 14.607 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -6.493 -2.535 13.885 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -9.470 -2.713 14.571 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -8.367 -1.388 14.886 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.008 -1.372 12.687 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -8.425 -0.622 12.643 1.00 0.00 H new ATOM 837 N MET A 54 -9.788 -4.987 12.109 1.00 0.00 N ATOM 838 CA MET A 54 -10.590 -6.205 12.021 1.00 0.00 C ATOM 839 C MET A 54 -10.053 -7.156 10.947 1.00 0.00 C ATOM 840 O MET A 54 -10.091 -8.361 11.170 1.00 0.00 O ATOM 841 CB MET A 54 -12.048 -5.841 11.713 1.00 0.00 C ATOM 842 CG MET A 54 -12.699 -5.108 12.890 1.00 0.00 C ATOM 843 SD MET A 54 -14.341 -4.450 12.533 1.00 0.00 S ATOM 844 CE MET A 54 -13.873 -3.037 11.506 1.00 0.00 C ATOM 0 H MET A 54 -10.289 -4.151 11.807 1.00 0.00 H new ATOM 0 HA MET A 54 -10.532 -6.718 12.981 1.00 0.00 H new ATOM 0 HB2 MET A 54 -12.088 -5.212 10.823 1.00 0.00 H new ATOM 0 HB3 MET A 54 -12.612 -6.747 11.489 1.00 0.00 H new ATOM 0 HG2 MET A 54 -12.770 -5.792 13.736 1.00 0.00 H new ATOM 0 HG3 MET A 54 -12.050 -4.288 13.197 1.00 0.00 H new ATOM 0 HE1 MET A 54 -14.756 -2.434 11.292 1.00 0.00 H new ATOM 0 HE2 MET A 54 -13.139 -2.430 12.035 1.00 0.00 H new ATOM 0 HE3 MET A 54 -13.442 -3.394 10.571 1.00 0.00 H new ATOM 854 N CYS A 55 -9.587 -6.625 9.805 1.00 0.00 N ATOM 855 CA CYS A 55 -8.738 -7.231 8.776 1.00 0.00 C ATOM 856 C CYS A 55 -8.970 -8.739 8.568 1.00 0.00 C ATOM 857 O CYS A 55 -8.445 -9.558 9.335 1.00 0.00 O ATOM 858 CB CYS A 55 -7.278 -6.897 9.028 1.00 0.00 C ATOM 859 SG CYS A 55 -6.451 -6.715 7.425 1.00 0.00 S ATOM 0 H CYS A 55 -9.821 -5.663 9.558 1.00 0.00 H new ATOM 0 HA CYS A 55 -9.037 -6.784 7.828 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -7.193 -5.977 9.606 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -6.804 -7.685 9.613 1.00 0.00 H new ATOM 0 HG CYS A 55 -5.166 -6.637 7.606 1.00 0.00 H new ATOM 865 N PRO A 56 -9.767 -9.152 7.574 1.00 0.00 N ATOM 866 CA PRO A 56 -10.413 -10.454 7.606 1.00 0.00 C ATOM 867 C PRO A 56 -9.424 -11.594 7.339 1.00 0.00 C ATOM 868 O PRO A 56 -9.306 -12.545 8.111 1.00 0.00 O ATOM 869 CB PRO A 56 -11.510 -10.355 6.538 1.00 0.00 C ATOM 870 CG PRO A 56 -10.982 -9.331 5.532 1.00 0.00 C ATOM 871 CD PRO A 56 -10.143 -8.390 6.394 1.00 0.00 C ATOM 0 HA PRO A 56 -10.825 -10.692 8.587 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -11.689 -11.320 6.064 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -12.457 -10.032 6.971 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -10.383 -9.804 4.753 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -11.794 -8.802 5.033 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.260 -8.049 5.853 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -10.712 -7.502 6.669 1.00 0.00 H new ATOM 879 N LEU A 57 -8.689 -11.475 6.239 1.00 0.00 N ATOM 880 CA LEU A 57 -7.704 -12.415 5.735 1.00 0.00 C ATOM 881 C LEU A 57 -6.388 -11.658 5.597 1.00 0.00 C ATOM 882 O LEU A 57 -5.757 -11.704 4.543 1.00 0.00 O ATOM 883 CB LEU A 57 -8.202 -13.107 4.440 1.00 0.00 C ATOM 884 CG LEU A 57 -9.048 -12.270 3.449 1.00 0.00 C ATOM 885 CD1 LEU A 57 -8.349 -11.010 2.927 1.00 0.00 C ATOM 886 CD2 LEU A 57 -9.455 -13.121 2.243 1.00 0.00 C ATOM 0 H LEU A 57 -8.775 -10.658 5.635 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.542 -13.245 6.423 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -7.329 -13.479 3.903 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -8.791 -13.976 4.731 1.00 0.00 H new ATOM 0 HG LEU A 57 -9.916 -11.947 4.024 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.012 -10.484 2.240 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -8.103 -10.357 3.764 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -7.434 -11.291 2.405 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -10.049 -12.518 1.556 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.561 -13.479 1.732 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -10.045 -13.973 2.581 1.00 0.00 H new ATOM 898 N ALA A 58 -5.992 -10.932 6.654 1.00 0.00 N ATOM 899 CA ALA A 58 -4.913 -9.954 6.595 1.00 0.00 C ATOM 900 C ALA A 58 -3.655 -10.567 6.003 1.00 0.00 C ATOM 901 O ALA A 58 -3.033 -9.937 5.167 1.00 0.00 O ATOM 902 CB ALA A 58 -4.568 -9.410 7.982 1.00 0.00 C ATOM 0 H ALA A 58 -6.419 -11.013 7.577 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.268 -9.140 5.963 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -3.759 -8.684 7.897 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.446 -8.927 8.412 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -4.253 -10.231 8.627 1.00 0.00 H new ATOM 908 N GLY A 59 -3.300 -11.792 6.401 1.00 0.00 N ATOM 909 CA GLY A 59 -2.104 -12.469 5.920 1.00 0.00 C ATOM 910 C GLY A 59 -2.068 -12.613 4.400 1.00 0.00 C ATOM 911 O GLY A 59 -0.993 -12.561 3.804 1.00 0.00 O ATOM 0 H GLY A 59 -3.841 -12.340 7.070 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.224 -11.916 6.248 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.046 -13.458 6.374 1.00 0.00 H new ATOM 915 N MET A 60 -3.230 -12.758 3.766 1.00 0.00 N ATOM 916 CA MET A 60 -3.366 -12.874 2.323 1.00 0.00 C ATOM 917 C MET A 60 -3.172 -11.501 1.668 1.00 0.00 C ATOM 918 O MET A 60 -2.422 -11.398 0.699 1.00 0.00 O ATOM 919 CB MET A 60 -4.735 -13.496 2.015 1.00 0.00 C ATOM 920 CG MET A 60 -4.742 -14.319 0.725 1.00 0.00 C ATOM 921 SD MET A 60 -3.947 -15.955 0.825 1.00 0.00 S ATOM 922 CE MET A 60 -2.344 -15.617 0.040 1.00 0.00 C ATOM 0 H MET A 60 -4.123 -12.799 4.258 1.00 0.00 H new ATOM 0 HA MET A 60 -2.598 -13.525 1.906 1.00 0.00 H new ATOM 0 HB2 MET A 60 -5.034 -14.133 2.847 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.479 -12.703 1.937 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.776 -14.457 0.410 1.00 0.00 H new ATOM 0 HG3 MET A 60 -4.246 -13.742 -0.055 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.981 -16.521 -0.449 1.00 0.00 H new ATOM 0 HE2 MET A 60 -2.461 -14.826 -0.701 1.00 0.00 H new ATOM 0 HE3 MET A 60 -1.627 -15.301 0.798 1.00 0.00 H new ATOM 932 N ILE A 61 -3.771 -10.443 2.233 1.00 0.00 N ATOM 933 CA ILE A 61 -3.551 -9.058 1.800 1.00 0.00 C ATOM 934 C ILE A 61 -2.060 -8.718 1.924 1.00 0.00 C ATOM 935 O ILE A 61 -1.447 -8.171 1.015 1.00 0.00 O ATOM 936 CB ILE A 61 -4.398 -8.049 2.627 1.00 0.00 C ATOM 937 CG1 ILE A 61 -5.863 -8.498 2.843 1.00 0.00 C ATOM 938 CG2 ILE A 61 -4.369 -6.684 1.925 1.00 0.00 C ATOM 939 CD1 ILE A 61 -6.742 -7.487 3.592 1.00 0.00 C ATOM 0 H ILE A 61 -4.427 -10.526 3.010 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.869 -8.974 0.761 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.950 -7.991 3.619 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.313 -8.700 1.871 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.863 -9.438 3.396 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.960 -5.968 2.496 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -3.340 -6.332 1.856 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.787 -6.781 0.923 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -7.750 -7.888 3.696 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -6.322 -7.301 4.580 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -6.779 -6.552 3.032 1.00 0.00 H new ATOM 951 N LEU A 62 -1.469 -9.038 3.076 1.00 0.00 N ATOM 952 CA LEU A 62 -0.085 -8.748 3.422 1.00 0.00 C ATOM 953 C LEU A 62 0.875 -9.512 2.508 1.00 0.00 C ATOM 954 O LEU A 62 1.963 -9.012 2.221 1.00 0.00 O ATOM 955 CB LEU A 62 0.150 -9.114 4.900 1.00 0.00 C ATOM 956 CG LEU A 62 -0.529 -8.162 5.904 1.00 0.00 C ATOM 957 CD1 LEU A 62 -0.568 -8.801 7.298 1.00 0.00 C ATOM 958 CD2 LEU A 62 0.201 -6.819 5.986 1.00 0.00 C ATOM 0 H LEU A 62 -1.966 -9.526 3.821 1.00 0.00 H new ATOM 0 HA LEU A 62 0.109 -7.685 3.281 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.214 -10.127 5.074 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.223 -9.123 5.094 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.544 -7.983 5.550 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.050 -8.118 7.998 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.130 -9.734 7.255 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.449 -9.006 7.633 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.305 -6.173 6.703 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.229 -6.983 6.308 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.199 -6.344 5.005 1.00 0.00 H new ATOM 970 N SER A 63 0.485 -10.705 2.047 1.00 0.00 N ATOM 971 CA SER A 63 1.220 -11.446 1.033 1.00 0.00 C ATOM 972 C SER A 63 1.140 -10.711 -0.308 1.00 0.00 C ATOM 973 O SER A 63 2.186 -10.480 -0.904 1.00 0.00 O ATOM 974 CB SER A 63 0.702 -12.884 0.919 1.00 0.00 C ATOM 975 OG SER A 63 0.836 -13.571 2.156 1.00 0.00 O ATOM 0 H SER A 63 -0.356 -11.181 2.373 1.00 0.00 H new ATOM 0 HA SER A 63 2.267 -11.506 1.329 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.345 -12.875 0.615 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.255 -13.413 0.143 1.00 0.00 H new ATOM 0 HG SER A 63 0.359 -13.079 2.857 1.00 0.00 H new ATOM 981 N ASP A 64 -0.056 -10.313 -0.759 1.00 0.00 N ATOM 982 CA ASP A 64 -0.284 -9.653 -2.055 1.00 0.00 C ATOM 983 C ASP A 64 0.462 -8.320 -2.143 1.00 0.00 C ATOM 984 O ASP A 64 1.148 -8.029 -3.125 1.00 0.00 O ATOM 985 CB ASP A 64 -1.787 -9.413 -2.254 1.00 0.00 C ATOM 986 CG ASP A 64 -2.138 -8.868 -3.645 1.00 0.00 C ATOM 987 OD1 ASP A 64 -1.476 -9.204 -4.653 1.00 0.00 O ATOM 988 OD2 ASP A 64 -3.135 -8.110 -3.714 1.00 0.00 O ATOM 0 H ASP A 64 -0.913 -10.443 -0.222 1.00 0.00 H new ATOM 0 HA ASP A 64 0.097 -10.308 -2.839 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -2.321 -10.349 -2.093 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -2.139 -8.711 -1.498 1.00 0.00 H new ATOM 994 N ALA A 65 0.388 -7.520 -1.073 1.00 0.00 N ATOM 995 CA ALA A 65 1.106 -6.263 -0.944 1.00 0.00 C ATOM 996 C ALA A 65 2.597 -6.494 -1.155 1.00 0.00 C ATOM 997 O ALA A 65 3.209 -5.880 -2.032 1.00 0.00 O ATOM 998 CB ALA A 65 0.808 -5.626 0.420 1.00 0.00 C ATOM 0 H ALA A 65 -0.187 -7.740 -0.260 1.00 0.00 H new ATOM 0 HA ALA A 65 0.769 -5.566 -1.711 1.00 0.00 H new ATOM 0 HB1 ALA A 65 1.350 -4.685 0.508 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -0.262 -5.438 0.508 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.124 -6.302 1.214 1.00 0.00 H new ATOM 1004 N GLU A 66 3.193 -7.397 -0.377 1.00 0.00 N ATOM 1005 CA GLU A 66 4.583 -7.760 -0.513 1.00 0.00 C ATOM 1006 C GLU A 66 4.880 -8.303 -1.918 1.00 0.00 C ATOM 1007 O GLU A 66 5.915 -7.978 -2.485 1.00 0.00 O ATOM 1008 CB GLU A 66 4.890 -8.805 0.561 1.00 0.00 C ATOM 1009 CG GLU A 66 6.390 -8.876 0.858 1.00 0.00 C ATOM 1010 CD GLU A 66 6.894 -10.294 1.131 1.00 0.00 C ATOM 1011 OE1 GLU A 66 6.078 -11.220 1.335 1.00 0.00 O ATOM 1012 OE2 GLU A 66 8.099 -10.551 0.923 1.00 0.00 O ATOM 0 H GLU A 66 2.710 -7.896 0.370 1.00 0.00 H new ATOM 0 HA GLU A 66 5.218 -6.884 -0.381 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.348 -8.560 1.474 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.536 -9.782 0.232 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.939 -8.461 0.013 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.611 -8.248 1.721 1.00 0.00 H new ATOM 1020 N GLU A 67 4.003 -9.134 -2.485 1.00 0.00 N ATOM 1021 CA GLU A 67 4.117 -9.777 -3.794 1.00 0.00 C ATOM 1022 C GLU A 67 4.188 -8.752 -4.931 1.00 0.00 C ATOM 1023 O GLU A 67 4.877 -8.988 -5.926 1.00 0.00 O ATOM 1024 CB GLU A 67 2.961 -10.783 -3.951 1.00 0.00 C ATOM 1025 CG GLU A 67 2.947 -11.520 -5.295 1.00 0.00 C ATOM 1026 CD GLU A 67 1.909 -12.646 -5.366 1.00 0.00 C ATOM 1027 OE1 GLU A 67 2.025 -13.494 -6.287 1.00 0.00 O ATOM 1028 OE2 GLU A 67 1.007 -12.757 -4.513 1.00 0.00 O ATOM 0 H GLU A 67 3.138 -9.392 -2.010 1.00 0.00 H new ATOM 0 HA GLU A 67 5.057 -10.325 -3.855 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.022 -11.517 -3.148 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.015 -10.255 -3.829 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.748 -10.803 -6.091 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.937 -11.937 -5.482 1.00 0.00 H new ATOM 1036 N ALA A 68 3.538 -7.597 -4.782 1.00 0.00 N ATOM 1037 CA ALA A 68 3.665 -6.498 -5.730 1.00 0.00 C ATOM 1038 C ALA A 68 4.964 -5.753 -5.471 1.00 0.00 C ATOM 1039 O ALA A 68 5.720 -5.446 -6.389 1.00 0.00 O ATOM 1040 CB ALA A 68 2.488 -5.539 -5.591 1.00 0.00 C ATOM 0 H ALA A 68 2.911 -7.401 -4.002 1.00 0.00 H new ATOM 0 HA ALA A 68 3.670 -6.903 -6.742 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.597 -4.723 -6.306 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.558 -6.073 -5.789 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.466 -5.134 -4.579 1.00 0.00 H new ATOM 1046 N ILE A 69 5.244 -5.453 -4.203 1.00 0.00 N ATOM 1047 CA ILE A 69 6.432 -4.703 -3.834 1.00 0.00 C ATOM 1048 C ILE A 69 7.684 -5.450 -4.322 1.00 0.00 C ATOM 1049 O ILE A 69 8.573 -4.820 -4.873 1.00 0.00 O ATOM 1050 CB ILE A 69 6.400 -4.378 -2.324 1.00 0.00 C ATOM 1051 CG1 ILE A 69 5.247 -3.389 -2.017 1.00 0.00 C ATOM 1052 CG2 ILE A 69 7.731 -3.756 -1.895 1.00 0.00 C ATOM 1053 CD1 ILE A 69 4.941 -3.240 -0.517 1.00 0.00 C ATOM 0 H ILE A 69 4.657 -5.722 -3.414 1.00 0.00 H new ATOM 0 HA ILE A 69 6.462 -3.733 -4.331 1.00 0.00 H new ATOM 0 HB ILE A 69 6.238 -5.303 -1.771 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.501 -2.411 -2.426 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.346 -3.725 -2.531 1.00 0.00 H new ATOM 0 HG21 ILE A 69 7.700 -3.530 -0.829 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.541 -4.457 -2.094 1.00 0.00 H new ATOM 0 HG23 ILE A 69 7.901 -2.837 -2.456 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.123 -2.532 -0.381 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.655 -4.208 -0.106 1.00 0.00 H new ATOM 0 HD13 ILE A 69 5.828 -2.874 0.001 1.00 0.00 H new ATOM 1065 N LYS A 70 7.747 -6.777 -4.213 1.00 0.00 N ATOM 1066 CA LYS A 70 8.906 -7.590 -4.580 1.00 0.00 C ATOM 1067 C LYS A 70 9.036 -7.838 -6.089 1.00 0.00 C ATOM 1068 O LYS A 70 9.978 -8.522 -6.486 1.00 0.00 O ATOM 1069 CB LYS A 70 8.900 -8.905 -3.771 1.00 0.00 C ATOM 1070 CG LYS A 70 7.850 -9.923 -4.246 1.00 0.00 C ATOM 1071 CD LYS A 70 7.753 -11.189 -3.378 1.00 0.00 C ATOM 1072 CE LYS A 70 7.253 -10.910 -1.952 1.00 0.00 C ATOM 1073 NZ LYS A 70 6.090 -11.732 -1.534 1.00 0.00 N ATOM 0 H LYS A 70 6.969 -7.332 -3.856 1.00 0.00 H new ATOM 0 HA LYS A 70 9.796 -7.018 -4.319 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.888 -9.362 -3.831 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.719 -8.674 -2.721 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.875 -9.437 -4.268 1.00 0.00 H new ATOM 0 HG3 LYS A 70 8.083 -10.216 -5.270 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.081 -11.900 -3.859 1.00 0.00 H new ATOM 0 HD3 LYS A 70 8.734 -11.662 -3.326 1.00 0.00 H new ATOM 0 HE2 LYS A 70 8.072 -11.081 -1.254 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.983 -9.857 -1.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.168 -11.954 -0.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 5.211 -11.203 -1.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.075 -12.616 -2.081 1.00 0.00 H new ATOM 1087 N LYS A 71 8.136 -7.341 -6.947 1.00 0.00 N ATOM 1088 CA LYS A 71 8.244 -7.538 -8.404 1.00 0.00 C ATOM 1089 C LYS A 71 8.915 -6.365 -9.129 1.00 0.00 C ATOM 1090 O LYS A 71 9.041 -6.400 -10.352 1.00 0.00 O ATOM 1091 CB LYS A 71 6.890 -7.949 -9.005 1.00 0.00 C ATOM 1092 CG LYS A 71 5.914 -6.774 -9.111 1.00 0.00 C ATOM 1093 CD LYS A 71 5.219 -6.677 -10.467 1.00 0.00 C ATOM 1094 CE LYS A 71 3.915 -7.477 -10.454 1.00 0.00 C ATOM 1095 NZ LYS A 71 3.073 -7.156 -11.618 1.00 0.00 N ATOM 0 H LYS A 71 7.322 -6.798 -6.659 1.00 0.00 H new ATOM 0 HA LYS A 71 8.926 -8.372 -8.569 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.050 -8.374 -9.996 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.446 -8.732 -8.390 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.159 -6.869 -8.331 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.454 -5.846 -8.921 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.011 -5.633 -10.703 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.878 -7.055 -11.249 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.141 -8.543 -10.450 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.366 -7.265 -9.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.197 -7.716 -11.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.837 -6.143 -11.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.589 -7.382 -12.492 1.00 0.00 H new ATOM 1109 N ILE A 72 9.322 -5.313 -8.414 1.00 0.00 N ATOM 1110 CA ILE A 72 9.736 -4.025 -9.003 1.00 0.00 C ATOM 1111 C ILE A 72 11.155 -4.092 -9.634 1.00 0.00 C ATOM 1112 O ILE A 72 11.694 -3.090 -10.109 1.00 0.00 O ATOM 1113 CB ILE A 72 9.519 -2.891 -7.961 1.00 0.00 C ATOM 1114 CG1 ILE A 72 8.083 -2.953 -7.391 1.00 0.00 C ATOM 1115 CG2 ILE A 72 9.688 -1.477 -8.558 1.00 0.00 C ATOM 1116 CD1 ILE A 72 7.823 -1.971 -6.241 1.00 0.00 C ATOM 0 H ILE A 72 9.376 -5.326 -7.396 1.00 0.00 H new ATOM 0 HA ILE A 72 9.102 -3.785 -9.856 1.00 0.00 H new ATOM 0 HB ILE A 72 10.276 -3.054 -7.194 1.00 0.00 H new ATOM 0 HG12 ILE A 72 7.375 -2.750 -8.195 1.00 0.00 H new ATOM 0 HG13 ILE A 72 7.886 -3.966 -7.041 1.00 0.00 H new ATOM 0 HG21 ILE A 72 9.524 -0.732 -7.780 1.00 0.00 H new ATOM 0 HG22 ILE A 72 10.696 -1.369 -8.957 1.00 0.00 H new ATOM 0 HG23 ILE A 72 8.963 -1.331 -9.359 1.00 0.00 H new ATOM 0 HD11 ILE A 72 6.794 -2.077 -5.898 1.00 0.00 H new ATOM 0 HD12 ILE A 72 8.504 -2.186 -5.418 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.986 -0.951 -6.590 1.00 0.00 H new ATOM 1128 N GLU A 73 11.777 -5.270 -9.688 1.00 0.00 N ATOM 1129 CA GLU A 73 13.040 -5.528 -10.377 1.00 0.00 C ATOM 1130 C GLU A 73 14.159 -4.562 -9.946 1.00 0.00 C ATOM 1131 O GLU A 73 14.901 -4.014 -10.763 1.00 0.00 O ATOM 1132 CB GLU A 73 12.801 -5.598 -11.896 1.00 0.00 C ATOM 1133 CG GLU A 73 13.763 -6.603 -12.532 1.00 0.00 C ATOM 1134 CD GLU A 73 13.590 -6.688 -14.049 1.00 0.00 C ATOM 1135 OE1 GLU A 73 12.715 -7.448 -14.515 1.00 0.00 O ATOM 1136 OE2 GLU A 73 14.351 -6.028 -14.801 1.00 0.00 O ATOM 0 H GLU A 73 11.400 -6.102 -9.235 1.00 0.00 H new ATOM 0 HA GLU A 73 13.417 -6.505 -10.074 1.00 0.00 H new ATOM 0 HB2 GLU A 73 11.771 -5.891 -12.097 1.00 0.00 H new ATOM 0 HB3 GLU A 73 12.945 -4.613 -12.341 1.00 0.00 H new ATOM 0 HG2 GLU A 73 14.789 -6.318 -12.301 1.00 0.00 H new ATOM 0 HG3 GLU A 73 13.599 -7.587 -12.094 1.00 0.00 H new ATOM 1144 N GLY A 74 14.297 -4.365 -8.637 1.00 0.00 N ATOM 1145 CA GLY A 74 15.349 -3.566 -8.025 1.00 0.00 C ATOM 1146 C GLY A 74 15.242 -3.597 -6.507 1.00 0.00 C ATOM 1147 O GLY A 74 16.256 -3.564 -5.832 1.00 0.00 O ATOM 0 H GLY A 74 13.658 -4.771 -7.954 1.00 0.00 H new ATOM 0 HA2 GLY A 74 16.324 -3.944 -8.333 1.00 0.00 H new ATOM 0 HA3 GLY A 74 15.281 -2.537 -8.377 1.00 0.00 H new ATOM 1151 N VAL A 75 14.004 -3.689 -6.017 1.00 0.00 N ATOM 1152 CA VAL A 75 13.442 -3.897 -4.680 1.00 0.00 C ATOM 1153 C VAL A 75 14.081 -5.021 -3.846 1.00 0.00 C ATOM 1154 O VAL A 75 13.465 -6.010 -3.456 1.00 0.00 O ATOM 1155 CB VAL A 75 11.929 -4.027 -4.855 1.00 0.00 C ATOM 1156 CG1 VAL A 75 11.673 -5.201 -5.810 1.00 0.00 C ATOM 1157 CG2 VAL A 75 11.188 -4.113 -3.516 1.00 0.00 C ATOM 0 H VAL A 75 13.232 -3.602 -6.678 1.00 0.00 H new ATOM 0 HA VAL A 75 13.686 -3.035 -4.059 1.00 0.00 H new ATOM 0 HB VAL A 75 11.513 -3.125 -5.303 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.600 -5.323 -5.958 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.151 -5.001 -6.769 1.00 0.00 H new ATOM 0 HG13 VAL A 75 12.086 -6.115 -5.382 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.117 -4.204 -3.698 1.00 0.00 H new ATOM 0 HG22 VAL A 75 11.537 -4.984 -2.962 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.382 -3.212 -2.934 1.00 0.00 H new ATOM 1167 N ASN A 76 15.356 -4.849 -3.586 1.00 0.00 N ATOM 1168 CA ASN A 76 16.237 -5.757 -2.891 1.00 0.00 C ATOM 1169 C ASN A 76 15.609 -6.297 -1.608 1.00 0.00 C ATOM 1170 O ASN A 76 15.412 -7.503 -1.476 1.00 0.00 O ATOM 1171 CB ASN A 76 17.461 -4.933 -2.559 1.00 0.00 C ATOM 1172 CG ASN A 76 18.407 -5.653 -1.604 1.00 0.00 C ATOM 1173 OD1 ASN A 76 18.767 -6.808 -1.830 1.00 0.00 O ATOM 1174 ND2 ASN A 76 18.796 -5.015 -0.518 1.00 0.00 N ATOM 0 H ASN A 76 15.842 -4.002 -3.879 1.00 0.00 H new ATOM 0 HA ASN A 76 16.463 -6.629 -3.505 1.00 0.00 H new ATOM 0 HB2 ASN A 76 17.993 -4.691 -3.479 1.00 0.00 H new ATOM 0 HB3 ASN A 76 17.149 -3.988 -2.113 1.00 0.00 H new ATOM 0 HD21 ASN A 76 19.407 -5.478 0.154 1.00 0.00 H new ATOM 0 HD22 ASN A 76 18.486 -4.058 -0.350 1.00 0.00 H new ATOM 1181 N ASN A 77 15.335 -5.406 -0.655 1.00 0.00 N ATOM 1182 CA ASN A 77 14.676 -5.752 0.596 1.00 0.00 C ATOM 1183 C ASN A 77 13.373 -4.975 0.740 1.00 0.00 C ATOM 1184 O ASN A 77 13.158 -3.969 0.055 1.00 0.00 O ATOM 1185 CB ASN A 77 15.573 -5.408 1.774 1.00 0.00 C ATOM 1186 CG ASN A 77 15.026 -5.989 3.068 1.00 0.00 C ATOM 1187 OD1 ASN A 77 14.523 -7.108 3.107 1.00 0.00 O ATOM 1188 ND2 ASN A 77 15.059 -5.208 4.119 1.00 0.00 N ATOM 0 H ASN A 77 15.568 -4.416 -0.734 1.00 0.00 H new ATOM 0 HA ASN A 77 14.470 -6.822 0.585 1.00 0.00 H new ATOM 0 HB2 ASN A 77 16.577 -5.793 1.595 1.00 0.00 H new ATOM 0 HB3 ASN A 77 15.658 -4.325 1.866 1.00 0.00 H new ATOM 0 HD21 ASN A 77 14.659 -5.525 5.002 1.00 0.00 H new ATOM 0 HD22 ASN A 77 15.484 -4.283 4.054 1.00 0.00 H new ATOM 1195 N VAL A 78 12.519 -5.443 1.649 1.00 0.00 N ATOM 1196 CA VAL A 78 11.101 -5.170 1.615 1.00 0.00 C ATOM 1197 C VAL A 78 10.663 -4.889 3.051 1.00 0.00 C ATOM 1198 O VAL A 78 10.200 -5.773 3.766 1.00 0.00 O ATOM 1199 CB VAL A 78 10.391 -6.366 0.924 1.00 0.00 C ATOM 1200 CG1 VAL A 78 8.911 -6.053 0.682 1.00 0.00 C ATOM 1201 CG2 VAL A 78 11.066 -6.726 -0.414 1.00 0.00 C ATOM 0 H VAL A 78 12.805 -6.028 2.434 1.00 0.00 H new ATOM 0 HA VAL A 78 10.832 -4.292 1.028 1.00 0.00 H new ATOM 0 HB VAL A 78 10.473 -7.221 1.595 1.00 0.00 H new ATOM 0 HG11 VAL A 78 8.434 -6.905 0.197 1.00 0.00 H new ATOM 0 HG12 VAL A 78 8.420 -5.856 1.635 1.00 0.00 H new ATOM 0 HG13 VAL A 78 8.825 -5.175 0.041 1.00 0.00 H new ATOM 0 HG21 VAL A 78 10.544 -7.567 -0.870 1.00 0.00 H new ATOM 0 HG22 VAL A 78 11.026 -5.867 -1.084 1.00 0.00 H new ATOM 0 HG23 VAL A 78 12.106 -6.999 -0.235 1.00 0.00 H new ATOM 1211 N GLU A 79 10.886 -3.663 3.517 1.00 0.00 N ATOM 1212 CA GLU A 79 10.727 -3.272 4.910 1.00 0.00 C ATOM 1213 C GLU A 79 9.273 -2.809 5.050 1.00 0.00 C ATOM 1214 O GLU A 79 8.948 -1.626 4.934 1.00 0.00 O ATOM 1215 CB GLU A 79 11.742 -2.162 5.230 1.00 0.00 C ATOM 1216 CG GLU A 79 13.213 -2.563 5.062 1.00 0.00 C ATOM 1217 CD GLU A 79 13.790 -3.208 6.319 1.00 0.00 C ATOM 1218 OE1 GLU A 79 14.453 -2.490 7.102 1.00 0.00 O ATOM 1219 OE2 GLU A 79 13.595 -4.431 6.527 1.00 0.00 O ATOM 0 H GLU A 79 11.190 -2.895 2.918 1.00 0.00 H new ATOM 0 HA GLU A 79 10.919 -4.081 5.614 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.538 -1.307 4.586 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.586 -1.832 6.257 1.00 0.00 H new ATOM 0 HG2 GLU A 79 13.304 -3.257 4.227 1.00 0.00 H new ATOM 0 HG3 GLU A 79 13.800 -1.680 4.808 1.00 0.00 H new ATOM 1227 N VAL A 80 8.351 -3.755 5.136 1.00 0.00 N ATOM 1228 CA VAL A 80 6.921 -3.471 5.159 1.00 0.00 C ATOM 1229 C VAL A 80 6.554 -3.113 6.600 1.00 0.00 C ATOM 1230 O VAL A 80 6.387 -3.998 7.439 1.00 0.00 O ATOM 1231 CB VAL A 80 6.149 -4.679 4.575 1.00 0.00 C ATOM 1232 CG1 VAL A 80 4.640 -4.702 4.862 1.00 0.00 C ATOM 1233 CG2 VAL A 80 6.333 -4.701 3.050 1.00 0.00 C ATOM 0 H VAL A 80 8.573 -4.749 5.192 1.00 0.00 H new ATOM 0 HA VAL A 80 6.644 -2.624 4.531 1.00 0.00 H new ATOM 0 HB VAL A 80 6.572 -5.552 5.073 1.00 0.00 H new ATOM 0 HG11 VAL A 80 4.197 -5.589 4.409 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.475 -4.724 5.939 1.00 0.00 H new ATOM 0 HG13 VAL A 80 4.176 -3.809 4.442 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.792 -5.549 2.630 1.00 0.00 H new ATOM 0 HG22 VAL A 80 5.945 -3.776 2.623 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.393 -4.793 2.813 1.00 0.00 H new ATOM 1243 N GLU A 81 6.462 -1.820 6.913 1.00 0.00 N ATOM 1244 CA GLU A 81 5.938 -1.366 8.192 1.00 0.00 C ATOM 1245 C GLU A 81 4.413 -1.284 8.085 1.00 0.00 C ATOM 1246 O GLU A 81 3.858 -0.938 7.034 1.00 0.00 O ATOM 1247 CB GLU A 81 6.527 0.003 8.549 1.00 0.00 C ATOM 1248 CG GLU A 81 6.769 0.198 10.047 1.00 0.00 C ATOM 1249 CD GLU A 81 8.078 -0.453 10.504 1.00 0.00 C ATOM 1250 OE1 GLU A 81 8.024 -1.502 11.176 1.00 0.00 O ATOM 1251 OE2 GLU A 81 9.168 0.097 10.194 1.00 0.00 O ATOM 0 H GLU A 81 6.748 -1.066 6.288 1.00 0.00 H new ATOM 0 HA GLU A 81 6.215 -2.065 8.981 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.470 0.132 8.018 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.852 0.782 8.195 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.795 1.264 10.275 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.937 -0.228 10.608 1.00 0.00 H new ATOM 1259 N LEU A 82 3.731 -1.537 9.195 1.00 0.00 N ATOM 1260 CA LEU A 82 2.282 -1.504 9.299 1.00 0.00 C ATOM 1261 C LEU A 82 1.908 -0.615 10.459 1.00 0.00 C ATOM 1262 O LEU A 82 1.998 -0.990 11.629 1.00 0.00 O ATOM 1263 CB LEU A 82 1.702 -2.917 9.402 1.00 0.00 C ATOM 1264 CG LEU A 82 0.170 -2.966 9.539 1.00 0.00 C ATOM 1265 CD1 LEU A 82 -0.568 -2.166 8.462 1.00 0.00 C ATOM 1266 CD2 LEU A 82 -0.281 -4.430 9.466 1.00 0.00 C ATOM 0 H LEU A 82 4.188 -1.778 10.074 1.00 0.00 H new ATOM 0 HA LEU A 82 1.844 -1.082 8.394 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.994 -3.482 8.517 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.148 -3.418 10.261 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.080 -2.510 10.497 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.643 -2.246 8.622 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.270 -1.119 8.518 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.317 -2.562 7.478 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.366 -4.482 9.562 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.020 -4.856 8.509 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.182 -4.994 10.276 1.00 0.00 H new ATOM 1278 N THR A 83 1.508 0.589 10.104 1.00 0.00 N ATOM 1279 CA THR A 83 0.989 1.575 11.011 1.00 0.00 C ATOM 1280 C THR A 83 -0.460 1.188 11.275 1.00 0.00 C ATOM 1281 O THR A 83 -1.229 0.955 10.340 1.00 0.00 O ATOM 1282 CB THR A 83 1.104 2.984 10.388 1.00 0.00 C ATOM 1283 OG1 THR A 83 1.961 3.053 9.256 1.00 0.00 O ATOM 1284 CG2 THR A 83 1.685 3.953 11.412 1.00 0.00 C ATOM 0 H THR A 83 1.539 0.913 9.137 1.00 0.00 H new ATOM 0 HA THR A 83 1.549 1.606 11.946 1.00 0.00 H new ATOM 0 HB THR A 83 0.090 3.238 10.078 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.511 2.656 8.481 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.765 4.946 10.969 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.032 3.996 12.284 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.674 3.611 11.716 1.00 0.00 H new ATOM 1292 N PHE A 84 -0.806 1.096 12.553 1.00 0.00 N ATOM 1293 CA PHE A 84 -2.176 0.941 13.023 1.00 0.00 C ATOM 1294 C PHE A 84 -2.574 1.949 14.106 1.00 0.00 C ATOM 1295 O PHE A 84 -3.773 2.062 14.383 1.00 0.00 O ATOM 1296 CB PHE A 84 -2.379 -0.497 13.531 1.00 0.00 C ATOM 1297 CG PHE A 84 -3.043 -1.436 12.546 1.00 0.00 C ATOM 1298 CD1 PHE A 84 -4.256 -1.082 11.920 1.00 0.00 C ATOM 1299 CD2 PHE A 84 -2.480 -2.701 12.299 1.00 0.00 C ATOM 1300 CE1 PHE A 84 -4.886 -1.975 11.035 1.00 0.00 C ATOM 1301 CE2 PHE A 84 -3.123 -3.607 11.438 1.00 0.00 C ATOM 1302 CZ PHE A 84 -4.322 -3.243 10.800 1.00 0.00 C ATOM 0 H PHE A 84 -0.124 1.128 13.310 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.828 1.143 12.174 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -1.408 -0.910 13.806 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -2.980 -0.464 14.440 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -4.704 -0.120 12.121 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -1.550 -2.977 12.773 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.800 -1.689 10.537 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.696 -4.584 11.266 1.00 0.00 H new ATOM 0 HZ PHE A 84 -4.810 -3.936 10.130 1.00 0.00 H new ATOM 1312 N ASP A 85 -1.629 2.663 14.728 1.00 0.00 N ATOM 1313 CA ASP A 85 -1.945 3.680 15.736 1.00 0.00 C ATOM 1314 C ASP A 85 -2.734 4.835 15.130 1.00 0.00 C ATOM 1315 O ASP A 85 -3.818 5.122 15.649 1.00 0.00 O ATOM 1316 CB ASP A 85 -0.695 4.287 16.398 1.00 0.00 C ATOM 1317 CG ASP A 85 -0.714 4.155 17.910 1.00 0.00 C ATOM 1318 OD1 ASP A 85 -1.528 4.822 18.585 1.00 0.00 O ATOM 1319 OD2 ASP A 85 0.115 3.389 18.446 1.00 0.00 O ATOM 0 H ASP A 85 -0.631 2.553 14.548 1.00 0.00 H new ATOM 0 HA ASP A 85 -2.531 3.153 16.489 1.00 0.00 H new ATOM 0 HB2 ASP A 85 0.195 3.795 16.005 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -0.622 5.341 16.130 1.00 0.00 H new ATOM 1325 N PRO A 86 -2.231 5.513 14.074 1.00 0.00 N ATOM 1326 CA PRO A 86 -2.884 6.705 13.592 1.00 0.00 C ATOM 1327 C PRO A 86 -4.121 6.315 12.778 1.00 0.00 C ATOM 1328 O PRO A 86 -4.120 5.290 12.083 1.00 0.00 O ATOM 1329 CB PRO A 86 -1.845 7.463 12.765 1.00 0.00 C ATOM 1330 CG PRO A 86 -0.895 6.378 12.277 1.00 0.00 C ATOM 1331 CD PRO A 86 -0.962 5.323 13.379 1.00 0.00 C ATOM 0 HA PRO A 86 -3.239 7.345 14.399 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -2.308 7.992 11.932 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -1.324 8.208 13.366 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.208 5.973 11.315 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.118 6.760 12.148 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -0.900 4.320 12.957 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.125 5.431 14.068 1.00 0.00 H new ATOM 1339 N PRO A 87 -5.181 7.129 12.825 1.00 0.00 N ATOM 1340 CA PRO A 87 -6.327 6.948 11.961 1.00 0.00 C ATOM 1341 C PRO A 87 -5.918 7.250 10.519 1.00 0.00 C ATOM 1342 O PRO A 87 -5.248 8.257 10.274 1.00 0.00 O ATOM 1343 CB PRO A 87 -7.397 7.895 12.491 1.00 0.00 C ATOM 1344 CG PRO A 87 -6.619 8.977 13.236 1.00 0.00 C ATOM 1345 CD PRO A 87 -5.324 8.295 13.676 1.00 0.00 C ATOM 0 HA PRO A 87 -6.713 5.929 11.959 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -7.988 8.319 11.679 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -8.091 7.378 13.154 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.416 9.833 12.592 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -7.181 9.349 14.093 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -4.472 8.966 13.566 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -5.371 8.009 14.727 1.00 0.00 H new ATOM 1353 N TRP A 88 -6.295 6.373 9.587 1.00 0.00 N ATOM 1354 CA TRP A 88 -6.065 6.537 8.159 1.00 0.00 C ATOM 1355 C TRP A 88 -7.040 7.613 7.644 1.00 0.00 C ATOM 1356 O TRP A 88 -6.683 8.791 7.691 1.00 0.00 O ATOM 1357 CB TRP A 88 -6.118 5.144 7.502 1.00 0.00 C ATOM 1358 CG TRP A 88 -6.587 5.049 6.088 1.00 0.00 C ATOM 1359 CD1 TRP A 88 -5.946 5.464 4.971 1.00 0.00 C ATOM 1360 CD2 TRP A 88 -7.875 4.541 5.649 1.00 0.00 C ATOM 1361 NE1 TRP A 88 -6.790 5.316 3.885 1.00 0.00 N ATOM 1362 CE2 TRP A 88 -7.977 4.719 4.244 1.00 0.00 C ATOM 1363 CE3 TRP A 88 -8.986 3.995 6.324 1.00 0.00 C ATOM 1364 CZ2 TRP A 88 -9.124 4.344 3.533 1.00 0.00 C ATOM 1365 CZ3 TRP A 88 -10.142 3.624 5.621 1.00 0.00 C ATOM 1366 CH2 TRP A 88 -10.203 3.792 4.227 1.00 0.00 C ATOM 0 H TRP A 88 -6.782 5.506 9.816 1.00 0.00 H new ATOM 0 HA TRP A 88 -5.078 6.917 7.895 1.00 0.00 H new ATOM 0 HB2 TRP A 88 -5.117 4.715 7.551 1.00 0.00 H new ATOM 0 HB3 TRP A 88 -6.766 4.513 8.111 1.00 0.00 H new ATOM 0 HD1 TRP A 88 -4.938 5.849 4.933 1.00 0.00 H new ATOM 0 HE1 TRP A 88 -6.561 5.612 2.936 1.00 0.00 H new ATOM 0 HE3 TRP A 88 -8.947 3.861 7.395 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 -9.173 4.480 2.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 -10.986 3.209 6.152 1.00 0.00 H new ATOM 0 HH2 TRP A 88 -11.090 3.492 3.689 1.00 0.00 H new ATOM 1377 N THR A 89 -8.234 7.218 7.177 1.00 0.00 N ATOM 1378 CA THR A 89 -9.523 7.911 7.090 1.00 0.00 C ATOM 1379 C THR A 89 -10.367 7.213 6.000 1.00 0.00 C ATOM 1380 O THR A 89 -9.877 7.055 4.884 1.00 0.00 O ATOM 1381 CB THR A 89 -9.365 9.430 6.882 1.00 0.00 C ATOM 1382 OG1 THR A 89 -9.172 10.086 8.127 1.00 0.00 O ATOM 1383 CG2 THR A 89 -10.568 10.101 6.255 1.00 0.00 C ATOM 0 H THR A 89 -8.326 6.274 6.801 1.00 0.00 H new ATOM 0 HA THR A 89 -10.053 7.837 8.040 1.00 0.00 H new ATOM 0 HB THR A 89 -8.510 9.520 6.212 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.273 9.889 8.465 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.373 11.168 6.144 1.00 0.00 H new ATOM 0 HG22 THR A 89 -10.759 9.663 5.275 1.00 0.00 H new ATOM 0 HG23 THR A 89 -11.439 9.956 6.893 1.00 0.00 H new ATOM 1391 N PRO A 90 -11.642 6.853 6.233 1.00 0.00 N ATOM 1392 CA PRO A 90 -12.462 6.176 5.230 1.00 0.00 C ATOM 1393 C PRO A 90 -12.847 7.046 4.036 1.00 0.00 C ATOM 1394 O PRO A 90 -13.203 6.486 2.997 1.00 0.00 O ATOM 1395 CB PRO A 90 -13.672 5.653 5.989 1.00 0.00 C ATOM 1396 CG PRO A 90 -13.851 6.688 7.097 1.00 0.00 C ATOM 1397 CD PRO A 90 -12.415 7.073 7.445 1.00 0.00 C ATOM 0 HA PRO A 90 -11.895 5.373 4.760 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.553 5.588 5.350 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -13.496 4.656 6.392 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -14.428 7.548 6.756 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -14.377 6.272 7.956 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -12.355 8.114 7.764 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -12.035 6.466 8.267 1.00 0.00 H new ATOM 1405 N GLU A 91 -12.679 8.373 4.113 1.00 0.00 N ATOM 1406 CA GLU A 91 -12.907 9.245 2.967 1.00 0.00 C ATOM 1407 C GLU A 91 -12.084 8.831 1.765 1.00 0.00 C ATOM 1408 O GLU A 91 -12.471 9.137 0.639 1.00 0.00 O ATOM 1409 CB GLU A 91 -12.502 10.709 3.227 1.00 0.00 C ATOM 1410 CG GLU A 91 -13.547 11.484 3.986 1.00 0.00 C ATOM 1411 CD GLU A 91 -13.515 11.256 5.493 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -12.854 12.078 6.171 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -14.108 10.264 5.962 1.00 0.00 O ATOM 0 H GLU A 91 -12.386 8.860 4.960 1.00 0.00 H new ATOM 0 HA GLU A 91 -13.979 9.158 2.788 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -11.567 10.727 3.786 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -12.313 11.202 2.274 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -13.412 12.547 3.787 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -14.532 11.211 3.608 1.00 0.00 H new ATOM 1421 N ARG A 92 -10.895 8.264 1.997 1.00 0.00 N ATOM 1422 CA ARG A 92 -9.848 8.427 1.003 1.00 0.00 C ATOM 1423 C ARG A 92 -10.088 7.605 -0.265 1.00 0.00 C ATOM 1424 O ARG A 92 -9.417 7.808 -1.281 1.00 0.00 O ATOM 1425 CB ARG A 92 -8.493 8.044 1.581 1.00 0.00 C ATOM 1426 CG ARG A 92 -8.099 8.936 2.751 1.00 0.00 C ATOM 1427 CD ARG A 92 -6.583 8.975 2.845 1.00 0.00 C ATOM 1428 NE ARG A 92 -6.153 10.037 3.755 1.00 0.00 N ATOM 1429 CZ ARG A 92 -5.020 10.056 4.455 1.00 0.00 C ATOM 1430 NH1 ARG A 92 -4.176 9.028 4.411 1.00 0.00 N ATOM 1431 NH2 ARG A 92 -4.741 11.127 5.185 1.00 0.00 N ATOM 0 H ARG A 92 -10.648 7.717 2.822 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.863 9.482 0.728 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.520 7.005 1.910 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.734 8.112 0.802 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -8.495 9.942 2.609 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.525 8.553 3.678 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -6.210 8.013 3.197 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -6.156 9.140 1.856 1.00 0.00 H new ATOM 0 HE ARG A 92 -6.778 10.836 3.863 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -4.394 8.214 3.837 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -3.311 9.054 4.952 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -5.388 11.915 5.203 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -3.879 11.163 5.729 1.00 0.00 H new ATOM 1445 N MET A 93 -11.017 6.661 -0.184 1.00 0.00 N ATOM 1446 CA MET A 93 -11.549 5.868 -1.276 1.00 0.00 C ATOM 1447 C MET A 93 -12.175 6.743 -2.371 1.00 0.00 C ATOM 1448 O MET A 93 -12.282 7.964 -2.235 1.00 0.00 O ATOM 1449 CB MET A 93 -12.572 4.878 -0.697 1.00 0.00 C ATOM 1450 CG MET A 93 -11.916 3.895 0.279 1.00 0.00 C ATOM 1451 SD MET A 93 -12.967 2.502 0.778 1.00 0.00 S ATOM 1452 CE MET A 93 -14.238 3.348 1.757 1.00 0.00 C ATOM 0 H MET A 93 -11.445 6.415 0.709 1.00 0.00 H new ATOM 0 HA MET A 93 -10.735 5.324 -1.755 1.00 0.00 H new ATOM 0 HB2 MET A 93 -13.362 5.428 -0.185 1.00 0.00 H new ATOM 0 HB3 MET A 93 -13.044 4.325 -1.509 1.00 0.00 H new ATOM 0 HG2 MET A 93 -11.009 3.501 -0.179 1.00 0.00 H new ATOM 0 HG3 MET A 93 -11.612 4.440 1.172 1.00 0.00 H new ATOM 0 HE1 MET A 93 -14.956 2.618 2.131 1.00 0.00 H new ATOM 0 HE2 MET A 93 -13.769 3.859 2.598 1.00 0.00 H new ATOM 0 HE3 MET A 93 -14.754 4.077 1.132 1.00 0.00 H new ATOM 1462 N SER A 94 -12.600 6.133 -3.476 1.00 0.00 N ATOM 1463 CA SER A 94 -13.339 6.830 -4.513 1.00 0.00 C ATOM 1464 C SER A 94 -14.637 7.411 -3.937 1.00 0.00 C ATOM 1465 O SER A 94 -15.252 6.816 -3.047 1.00 0.00 O ATOM 1466 CB SER A 94 -13.616 5.884 -5.686 1.00 0.00 C ATOM 1467 OG SER A 94 -14.015 4.606 -5.224 1.00 0.00 O ATOM 0 H SER A 94 -12.440 5.145 -3.672 1.00 0.00 H new ATOM 0 HA SER A 94 -12.741 7.661 -4.888 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.396 6.305 -6.321 1.00 0.00 H new ATOM 0 HB3 SER A 94 -12.721 5.789 -6.301 1.00 0.00 H new ATOM 0 HG SER A 94 -14.188 4.020 -5.991 1.00 0.00 H new ATOM 1473 N PRO A 95 -15.123 8.540 -4.473 1.00 0.00 N ATOM 1474 CA PRO A 95 -16.321 9.186 -3.956 1.00 0.00 C ATOM 1475 C PRO A 95 -17.589 8.359 -4.218 1.00 0.00 C ATOM 1476 O PRO A 95 -18.562 8.462 -3.477 1.00 0.00 O ATOM 1477 CB PRO A 95 -16.334 10.550 -4.641 1.00 0.00 C ATOM 1478 CG PRO A 95 -15.613 10.316 -5.967 1.00 0.00 C ATOM 1479 CD PRO A 95 -14.540 9.312 -5.561 1.00 0.00 C ATOM 0 HA PRO A 95 -16.309 9.284 -2.871 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -17.352 10.905 -4.800 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -15.824 11.302 -4.039 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -16.280 9.916 -6.731 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -15.184 11.234 -6.368 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -14.268 8.668 -6.397 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -13.630 9.818 -5.239 1.00 0.00 H new ATOM 1487 N GLU A 96 -17.571 7.480 -5.218 1.00 0.00 N ATOM 1488 CA GLU A 96 -18.654 6.547 -5.475 1.00 0.00 C ATOM 1489 C GLU A 96 -18.734 5.523 -4.332 1.00 0.00 C ATOM 1490 O GLU A 96 -19.833 5.159 -3.901 1.00 0.00 O ATOM 1491 CB GLU A 96 -18.368 5.884 -6.828 1.00 0.00 C ATOM 1492 CG GLU A 96 -19.421 4.852 -7.246 1.00 0.00 C ATOM 1493 CD GLU A 96 -18.916 4.009 -8.409 1.00 0.00 C ATOM 1494 OE1 GLU A 96 -19.480 4.094 -9.522 1.00 0.00 O ATOM 1495 OE2 GLU A 96 -17.978 3.212 -8.173 1.00 0.00 O ATOM 0 H GLU A 96 -16.795 7.399 -5.875 1.00 0.00 H new ATOM 0 HA GLU A 96 -19.621 7.048 -5.517 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -18.305 6.656 -7.595 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -17.393 5.398 -6.785 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -19.661 4.207 -6.401 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -20.342 5.360 -7.532 1.00 0.00 H new ATOM 1503 N LEU A 97 -17.583 5.062 -3.817 1.00 0.00 N ATOM 1504 CA LEU A 97 -17.568 4.166 -2.667 1.00 0.00 C ATOM 1505 C LEU A 97 -18.037 4.880 -1.407 1.00 0.00 C ATOM 1506 O LEU A 97 -18.594 4.214 -0.537 1.00 0.00 O ATOM 1507 CB LEU A 97 -16.178 3.561 -2.394 1.00 0.00 C ATOM 1508 CG LEU A 97 -15.762 2.382 -3.290 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -14.443 1.814 -2.758 1.00 0.00 C ATOM 1510 CD2 LEU A 97 -16.818 1.270 -3.331 1.00 0.00 C ATOM 0 H LEU A 97 -16.660 5.297 -4.181 1.00 0.00 H new ATOM 0 HA LEU A 97 -18.252 3.356 -2.920 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -15.434 4.351 -2.500 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -16.146 3.230 -1.356 1.00 0.00 H new ATOM 0 HG LEU A 97 -15.652 2.753 -4.309 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -14.130 0.976 -3.381 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -13.677 2.589 -2.782 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -14.581 1.472 -1.732 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -16.472 0.464 -3.978 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -16.979 0.884 -2.324 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -17.754 1.671 -3.720 1.00 0.00 H new ATOM 1522 N ARG A 98 -17.851 6.199 -1.290 1.00 0.00 N ATOM 1523 CA ARG A 98 -18.327 6.920 -0.111 1.00 0.00 C ATOM 1524 C ARG A 98 -19.838 6.806 0.021 1.00 0.00 C ATOM 1525 O ARG A 98 -20.307 6.570 1.129 1.00 0.00 O ATOM 1526 CB ARG A 98 -17.866 8.383 -0.088 1.00 0.00 C ATOM 1527 CG ARG A 98 -16.350 8.491 0.127 1.00 0.00 C ATOM 1528 CD ARG A 98 -15.889 9.952 0.146 1.00 0.00 C ATOM 1529 NE ARG A 98 -16.332 10.642 1.364 1.00 0.00 N ATOM 1530 CZ ARG A 98 -16.295 11.945 1.638 1.00 0.00 C ATOM 1531 NH1 ARG A 98 -15.992 12.832 0.697 1.00 0.00 N ATOM 1532 NH2 ARG A 98 -16.555 12.344 2.870 1.00 0.00 N ATOM 0 H ARG A 98 -17.382 6.779 -1.986 1.00 0.00 H new ATOM 0 HA ARG A 98 -17.874 6.444 0.759 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -18.137 8.866 -1.027 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -18.386 8.917 0.707 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -16.080 8.011 1.067 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -15.830 7.954 -0.666 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -14.802 9.992 0.079 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -16.281 10.470 -0.729 1.00 0.00 H new ATOM 0 HE ARG A 98 -16.719 10.046 2.096 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -15.784 12.519 -0.251 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -15.968 13.826 0.922 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -16.779 11.659 3.591 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -16.532 13.337 3.100 1.00 0.00 H new ATOM 1546 N GLU A 99 -20.585 6.876 -1.080 1.00 0.00 N ATOM 1547 CA GLU A 99 -22.035 6.689 -1.030 1.00 0.00 C ATOM 1548 C GLU A 99 -22.381 5.223 -0.742 1.00 0.00 C ATOM 1549 O GLU A 99 -23.285 4.947 0.049 1.00 0.00 O ATOM 1550 CB GLU A 99 -22.687 7.141 -2.346 1.00 0.00 C ATOM 1551 CG GLU A 99 -22.334 8.563 -2.801 1.00 0.00 C ATOM 1552 CD GLU A 99 -22.885 9.686 -1.922 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -23.306 10.710 -2.515 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -22.773 9.640 -0.683 1.00 0.00 O ATOM 0 H GLU A 99 -20.214 7.060 -2.012 1.00 0.00 H new ATOM 0 HA GLU A 99 -22.428 7.304 -0.220 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -22.399 6.444 -3.133 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -23.769 7.070 -2.239 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -21.249 8.655 -2.841 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -22.704 8.704 -3.817 1.00 0.00 H new ATOM 1562 N LYS A 100 -21.655 4.274 -1.359 1.00 0.00 N ATOM 1563 CA LYS A 100 -21.884 2.844 -1.136 1.00 0.00 C ATOM 1564 C LYS A 100 -21.759 2.533 0.357 1.00 0.00 C ATOM 1565 O LYS A 100 -22.688 1.977 0.943 1.00 0.00 O ATOM 1566 CB LYS A 100 -20.932 1.965 -1.977 1.00 0.00 C ATOM 1567 CG LYS A 100 -21.330 0.476 -1.887 1.00 0.00 C ATOM 1568 CD LYS A 100 -20.184 -0.524 -2.100 1.00 0.00 C ATOM 1569 CE LYS A 100 -19.759 -0.687 -3.564 1.00 0.00 C ATOM 1570 NZ LYS A 100 -18.996 -1.942 -3.777 1.00 0.00 N ATOM 0 H LYS A 100 -20.903 4.477 -2.017 1.00 0.00 H new ATOM 0 HA LYS A 100 -22.894 2.603 -1.466 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -20.956 2.289 -3.017 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -19.908 2.093 -1.626 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -21.772 0.294 -0.907 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -22.105 0.279 -2.628 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -19.322 -0.202 -1.516 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -20.487 -1.496 -1.711 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -20.643 -0.686 -4.202 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -19.149 0.165 -3.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -18.725 -2.018 -4.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -18.140 -1.932 -3.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -19.587 -2.756 -3.515 1.00 0.00 H new ATOM 1584 N PHE A 101 -20.607 2.849 0.942 1.00 0.00 N ATOM 1585 CA PHE A 101 -20.300 2.513 2.318 1.00 0.00 C ATOM 1586 C PHE A 101 -21.060 3.412 3.298 1.00 0.00 C ATOM 1587 O PHE A 101 -21.531 2.916 4.321 1.00 0.00 O ATOM 1588 CB PHE A 101 -18.783 2.573 2.549 1.00 0.00 C ATOM 1589 CG PHE A 101 -18.029 1.320 2.128 1.00 0.00 C ATOM 1590 CD1 PHE A 101 -17.741 1.064 0.771 1.00 0.00 C ATOM 1591 CD2 PHE A 101 -17.615 0.396 3.109 1.00 0.00 C ATOM 1592 CE1 PHE A 101 -17.052 -0.111 0.405 1.00 0.00 C ATOM 1593 CE2 PHE A 101 -16.931 -0.775 2.738 1.00 0.00 C ATOM 1594 CZ PHE A 101 -16.649 -1.032 1.386 1.00 0.00 C ATOM 0 H PHE A 101 -19.857 3.350 0.465 1.00 0.00 H new ATOM 0 HA PHE A 101 -20.633 1.493 2.507 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -18.379 3.425 2.003 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -18.597 2.755 3.607 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -18.048 1.768 0.012 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -17.824 0.589 4.151 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -16.833 -0.304 -0.635 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -16.621 -1.480 3.495 1.00 0.00 H new ATOM 0 HZ PHE A 101 -16.125 -1.933 1.102 1.00 0.00 H new ATOM 1604 N GLY A 102 -21.185 4.706 2.999 1.00 0.00 N ATOM 1605 CA GLY A 102 -21.752 5.713 3.880 1.00 0.00 C ATOM 1606 C GLY A 102 -20.629 6.341 4.690 1.00 0.00 C ATOM 1607 O GLY A 102 -20.534 6.080 5.890 1.00 0.00 O ATOM 0 H GLY A 102 -20.882 5.089 2.104 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.270 6.475 3.298 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -22.490 5.262 4.544 1.00 0.00 H new ATOM 1611 N VAL A 103 -19.753 7.106 4.028 1.00 0.00 N ATOM 1612 CA VAL A 103 -18.661 7.904 4.596 1.00 0.00 C ATOM 1613 C VAL A 103 -18.483 9.132 3.702 1.00 0.00 C ATOM 1614 O VAL A 103 -19.452 9.496 2.999 1.00 0.00 O ATOM 1615 CB VAL A 103 -17.363 7.069 4.779 1.00 0.00 C ATOM 1616 CG1 VAL A 103 -17.277 6.519 6.210 1.00 0.00 C ATOM 1617 CG2 VAL A 103 -17.190 5.946 3.744 1.00 0.00 C ATOM 0 H VAL A 103 -19.791 7.189 3.012 1.00 0.00 H new ATOM 0 HA VAL A 103 -18.906 8.233 5.606 1.00 0.00 H new ATOM 0 HB VAL A 103 -16.534 7.755 4.604 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.362 5.937 6.322 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -17.268 7.347 6.918 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -18.139 5.882 6.407 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -16.261 5.411 3.940 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -18.029 5.254 3.814 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -17.157 6.376 2.743 1.00 0.00 H new TER 1627 VAL A 103