USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 734 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 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLN N :NH3+ -114:sc= 0.105 (180deg=-0.0227) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl -170:sc=-0.00949 (180deg=-0.156) USER MOD Single : A 8 CYS SG : rot 180:sc= -1.86! USER MOD Single : A 9 MET CE :methyl 150:sc= -0.142 (180deg=-0.597) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 179:sc= 1.2 (180deg=1.07) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 154:sc= 0.613 USER MOD Single : A 25 TYR OH : rot 0:sc= 0 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 162:sc= 0.371 (180deg=-0.0312) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.00659) USER MOD Single : A 43 LYS NZ :NH3+ 172:sc= 0.0897 (180deg=-0.00483) USER MOD Single : A 44 SER OG : rot 69:sc= 0.354 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -136:sc= 0.0882 (180deg=-0.108) USER MOD Single : A 74 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00604) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ -124:sc= -0.204 (180deg=-0.797) USER MOD Single : A 79 THR OG1 : rot -48:sc= 0.436 USER MOD Single : A 84 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0133) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 17.078 5.439 -11.412 1.00 0.00 N ATOM 2 CA GLN A 1 17.322 4.469 -10.312 1.00 0.00 C ATOM 3 C GLN A 1 16.025 4.207 -9.527 1.00 0.00 C ATOM 4 O GLN A 1 14.979 4.800 -9.822 1.00 0.00 O ATOM 5 CB GLN A 1 18.454 4.991 -9.383 1.00 0.00 C ATOM 6 CG GLN A 1 18.120 6.287 -8.622 1.00 0.00 C ATOM 7 CD GLN A 1 19.283 6.818 -7.781 1.00 0.00 C ATOM 8 OE1 GLN A 1 19.455 6.442 -6.621 1.00 0.00 O ATOM 9 NE2 GLN A 1 20.091 7.694 -8.362 1.00 0.00 N ATOM 0 H1 GLN A 1 17.206 4.964 -12.328 1.00 0.00 H new ATOM 0 H2 GLN A 1 16.106 5.804 -11.344 1.00 0.00 H new ATOM 0 H3 GLN A 1 17.750 6.229 -11.334 1.00 0.00 H new ATOM 0 HA GLN A 1 17.646 3.520 -10.739 1.00 0.00 H new ATOM 0 HB2 GLN A 1 18.697 4.214 -8.659 1.00 0.00 H new ATOM 0 HB3 GLN A 1 19.348 5.159 -9.983 1.00 0.00 H new ATOM 0 HG2 GLN A 1 17.821 7.052 -9.338 1.00 0.00 H new ATOM 0 HG3 GLN A 1 17.264 6.107 -7.971 1.00 0.00 H new ATOM 0 HE21 GLN A 1 19.920 7.985 -9.325 1.00 0.00 H new ATOM 0 HE22 GLN A 1 20.883 8.077 -7.846 1.00 0.00 H new ATOM 20 N GLY A 2 16.107 3.322 -8.520 1.00 0.00 N ATOM 21 CA GLY A 2 14.949 2.946 -7.716 1.00 0.00 C ATOM 22 C GLY A 2 15.341 2.194 -6.455 1.00 0.00 C ATOM 23 O GLY A 2 16.362 2.515 -5.836 1.00 0.00 O ATOM 0 H GLY A 2 16.972 2.855 -8.248 1.00 0.00 H new ATOM 0 HA2 GLY A 2 14.392 3.843 -7.443 1.00 0.00 H new ATOM 0 HA3 GLY A 2 14.281 2.326 -8.313 1.00 0.00 H new ATOM 27 N HIS A 3 14.526 1.194 -6.066 1.00 0.00 N ATOM 28 CA HIS A 3 14.717 0.434 -4.812 1.00 0.00 C ATOM 29 C HIS A 3 15.022 -1.045 -5.107 1.00 0.00 C ATOM 30 O HIS A 3 14.125 -1.895 -5.088 1.00 0.00 O ATOM 31 CB HIS A 3 13.457 0.555 -3.908 1.00 0.00 C ATOM 32 CG HIS A 3 13.127 1.966 -3.486 1.00 0.00 C ATOM 33 ND1 HIS A 3 13.574 2.521 -2.305 1.00 0.00 N ATOM 34 CD2 HIS A 3 12.380 2.924 -4.083 1.00 0.00 C ATOM 35 CE1 HIS A 3 13.127 3.755 -2.208 1.00 0.00 C ATOM 36 NE2 HIS A 3 12.399 4.024 -3.267 1.00 0.00 N ATOM 0 H HIS A 3 13.718 0.890 -6.610 1.00 0.00 H new ATOM 0 HA HIS A 3 15.570 0.859 -4.284 1.00 0.00 H new ATOM 0 HB2 HIS A 3 12.602 0.138 -4.440 1.00 0.00 H new ATOM 0 HB3 HIS A 3 13.605 -0.053 -3.016 1.00 0.00 H new ATOM 0 HD2 HIS A 3 11.864 2.837 -5.028 1.00 0.00 H new ATOM 0 HE1 HIS A 3 13.326 4.434 -1.392 1.00 0.00 H new ATOM 0 HE2 HIS A 3 11.925 4.908 -3.452 1.00 0.00 H new ATOM 45 N MET A 4 16.289 -1.339 -5.419 1.00 0.00 N ATOM 46 CA MET A 4 16.774 -2.723 -5.563 1.00 0.00 C ATOM 47 C MET A 4 17.237 -3.214 -4.183 1.00 0.00 C ATOM 48 O MET A 4 18.339 -2.885 -3.743 1.00 0.00 O ATOM 49 CB MET A 4 17.926 -2.803 -6.610 1.00 0.00 C ATOM 50 CG MET A 4 17.510 -2.386 -8.029 1.00 0.00 C ATOM 51 SD MET A 4 16.122 -3.361 -8.670 1.00 0.00 S ATOM 52 CE MET A 4 16.809 -5.019 -8.732 1.00 0.00 C ATOM 0 H MET A 4 17.006 -0.631 -5.579 1.00 0.00 H new ATOM 0 HA MET A 4 15.972 -3.364 -5.929 1.00 0.00 H new ATOM 0 HB2 MET A 4 18.747 -2.166 -6.281 1.00 0.00 H new ATOM 0 HB3 MET A 4 18.307 -3.824 -6.639 1.00 0.00 H new ATOM 0 HG2 MET A 4 17.237 -1.331 -8.027 1.00 0.00 H new ATOM 0 HG3 MET A 4 18.363 -2.493 -8.699 1.00 0.00 H new ATOM 0 HE1 MET A 4 16.126 -5.676 -9.270 1.00 0.00 H new ATOM 0 HE2 MET A 4 17.770 -4.996 -9.246 1.00 0.00 H new ATOM 0 HE3 MET A 4 16.949 -5.393 -7.718 1.00 0.00 H new ATOM 62 N ASP A 5 16.364 -3.953 -3.477 1.00 0.00 N ATOM 63 CA ASP A 5 16.621 -4.389 -2.093 1.00 0.00 C ATOM 64 C ASP A 5 17.468 -5.676 -2.057 1.00 0.00 C ATOM 65 O ASP A 5 16.940 -6.790 -2.017 1.00 0.00 O ATOM 66 CB ASP A 5 15.284 -4.573 -1.330 1.00 0.00 C ATOM 67 CG ASP A 5 14.454 -3.278 -1.253 1.00 0.00 C ATOM 68 OD1 ASP A 5 13.687 -2.998 -2.202 1.00 0.00 O ATOM 69 OD2 ASP A 5 14.564 -2.533 -0.251 1.00 0.00 O ATOM 0 H ASP A 5 15.465 -4.264 -3.847 1.00 0.00 H new ATOM 0 HA ASP A 5 17.197 -3.611 -1.592 1.00 0.00 H new ATOM 0 HB2 ASP A 5 14.695 -5.347 -1.821 1.00 0.00 H new ATOM 0 HB3 ASP A 5 15.494 -4.925 -0.320 1.00 0.00 H new ATOM 74 N LEU A 6 18.796 -5.486 -2.143 1.00 0.00 N ATOM 75 CA LEU A 6 19.811 -6.529 -1.853 1.00 0.00 C ATOM 76 C LEU A 6 20.433 -6.240 -0.461 1.00 0.00 C ATOM 77 O LEU A 6 21.443 -6.840 -0.069 1.00 0.00 O ATOM 78 CB LEU A 6 20.916 -6.503 -2.949 1.00 0.00 C ATOM 79 CG LEU A 6 20.417 -6.537 -4.429 1.00 0.00 C ATOM 80 CD1 LEU A 6 21.598 -6.478 -5.423 1.00 0.00 C ATOM 81 CD2 LEU A 6 19.518 -7.760 -4.696 1.00 0.00 C ATOM 0 H LEU A 6 19.206 -4.594 -2.419 1.00 0.00 H new ATOM 0 HA LEU A 6 19.346 -7.515 -1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 6 21.516 -5.604 -2.810 1.00 0.00 H new ATOM 0 HB3 LEU A 6 21.577 -7.355 -2.790 1.00 0.00 H new ATOM 0 HG LEU A 6 19.809 -5.646 -4.588 1.00 0.00 H new ATOM 0 HD11 LEU A 6 21.216 -6.504 -6.444 1.00 0.00 H new ATOM 0 HD12 LEU A 6 22.158 -5.556 -5.268 1.00 0.00 H new ATOM 0 HD13 LEU A 6 22.254 -7.333 -5.260 1.00 0.00 H new ATOM 0 HD21 LEU A 6 19.190 -7.750 -5.735 1.00 0.00 H new ATOM 0 HD22 LEU A 6 20.079 -8.674 -4.501 1.00 0.00 H new ATOM 0 HD23 LEU A 6 18.648 -7.722 -4.040 1.00 0.00 H new ATOM 93 N ILE A 7 19.784 -5.302 0.260 1.00 0.00 N ATOM 94 CA ILE A 7 20.256 -4.725 1.524 1.00 0.00 C ATOM 95 C ILE A 7 20.121 -5.733 2.691 1.00 0.00 C ATOM 96 O ILE A 7 20.927 -5.715 3.618 1.00 0.00 O ATOM 97 CB ILE A 7 19.458 -3.384 1.828 1.00 0.00 C ATOM 98 CG1 ILE A 7 20.043 -2.616 3.058 1.00 0.00 C ATOM 99 CG2 ILE A 7 17.942 -3.641 1.992 1.00 0.00 C ATOM 100 CD1 ILE A 7 21.449 -2.083 2.843 1.00 0.00 C ATOM 0 H ILE A 7 18.887 -4.916 -0.037 1.00 0.00 H new ATOM 0 HA ILE A 7 21.316 -4.491 1.427 1.00 0.00 H new ATOM 0 HB ILE A 7 19.587 -2.741 0.958 1.00 0.00 H new ATOM 0 HG12 ILE A 7 19.383 -1.783 3.300 1.00 0.00 H new ATOM 0 HG13 ILE A 7 20.046 -3.282 3.921 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.434 -2.699 2.199 1.00 0.00 H new ATOM 0 HG22 ILE A 7 17.545 -4.074 1.074 1.00 0.00 H new ATOM 0 HG23 ILE A 7 17.777 -4.331 2.819 1.00 0.00 H new ATOM 0 HD11 ILE A 7 21.783 -1.564 3.741 1.00 0.00 H new ATOM 0 HD12 ILE A 7 22.124 -2.912 2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 7 21.451 -1.390 2.002 1.00 0.00 H new ATOM 112 N CYS A 8 19.114 -6.630 2.610 1.00 0.00 N ATOM 113 CA CYS A 8 18.835 -7.633 3.652 1.00 0.00 C ATOM 114 C CYS A 8 18.558 -9.002 2.998 1.00 0.00 C ATOM 115 O CYS A 8 17.428 -9.280 2.598 1.00 0.00 O ATOM 116 CB CYS A 8 17.626 -7.178 4.514 1.00 0.00 C ATOM 117 SG CYS A 8 17.705 -5.467 5.076 1.00 0.00 S ATOM 0 H CYS A 8 18.473 -6.676 1.818 1.00 0.00 H new ATOM 0 HA CYS A 8 19.704 -7.730 4.303 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.712 -7.315 3.935 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.552 -7.829 5.385 1.00 0.00 H new ATOM 0 HG CYS A 8 16.649 -5.193 5.783 1.00 0.00 H new ATOM 123 N MET A 9 19.613 -9.827 2.851 1.00 0.00 N ATOM 124 CA MET A 9 19.545 -11.190 2.255 1.00 0.00 C ATOM 125 C MET A 9 20.612 -12.083 2.915 1.00 0.00 C ATOM 126 O MET A 9 21.591 -11.576 3.460 1.00 0.00 O ATOM 127 CB MET A 9 19.775 -11.160 0.703 1.00 0.00 C ATOM 128 CG MET A 9 18.633 -10.554 -0.127 1.00 0.00 C ATOM 129 SD MET A 9 18.882 -10.759 -1.905 1.00 0.00 S ATOM 130 CE MET A 9 17.347 -10.116 -2.573 1.00 0.00 C ATOM 0 H MET A 9 20.555 -9.568 3.145 1.00 0.00 H new ATOM 0 HA MET A 9 18.547 -11.590 2.436 1.00 0.00 H new ATOM 0 HB2 MET A 9 20.686 -10.597 0.500 1.00 0.00 H new ATOM 0 HB3 MET A 9 19.948 -12.180 0.360 1.00 0.00 H new ATOM 0 HG2 MET A 9 17.692 -11.022 0.161 1.00 0.00 H new ATOM 0 HG3 MET A 9 18.545 -9.492 0.104 1.00 0.00 H new ATOM 0 HE1 MET A 9 17.530 -9.687 -3.558 1.00 0.00 H new ATOM 0 HE2 MET A 9 16.621 -10.924 -2.658 1.00 0.00 H new ATOM 0 HE3 MET A 9 16.956 -9.345 -1.909 1.00 0.00 H new ATOM 140 N TYR A 10 20.419 -13.411 2.863 1.00 0.00 N ATOM 141 CA TYR A 10 21.402 -14.386 3.379 1.00 0.00 C ATOM 142 C TYR A 10 22.548 -14.559 2.367 1.00 0.00 C ATOM 143 O TYR A 10 22.344 -15.101 1.280 1.00 0.00 O ATOM 144 CB TYR A 10 20.727 -15.753 3.658 1.00 0.00 C ATOM 145 CG TYR A 10 19.649 -15.712 4.746 1.00 0.00 C ATOM 146 CD1 TYR A 10 19.996 -15.560 6.088 1.00 0.00 C ATOM 147 CD2 TYR A 10 18.293 -15.804 4.431 1.00 0.00 C ATOM 148 CE1 TYR A 10 19.034 -15.524 7.071 1.00 0.00 C ATOM 149 CE2 TYR A 10 17.331 -15.766 5.415 1.00 0.00 C ATOM 150 CZ TYR A 10 17.707 -15.615 6.732 1.00 0.00 C ATOM 151 OH TYR A 10 16.750 -15.562 7.717 1.00 0.00 O ATOM 0 H TYR A 10 19.583 -13.840 2.465 1.00 0.00 H new ATOM 0 HA TYR A 10 21.806 -14.006 4.317 1.00 0.00 H new ATOM 0 HB2 TYR A 10 20.281 -16.120 2.734 1.00 0.00 H new ATOM 0 HB3 TYR A 10 21.494 -16.471 3.949 1.00 0.00 H new ATOM 0 HD1 TYR A 10 21.037 -15.469 6.360 1.00 0.00 H new ATOM 0 HD2 TYR A 10 17.993 -15.907 3.399 1.00 0.00 H new ATOM 0 HE1 TYR A 10 19.322 -15.424 8.107 1.00 0.00 H new ATOM 0 HE2 TYR A 10 16.286 -15.854 5.156 1.00 0.00 H new ATOM 0 HH TYR A 10 15.860 -15.639 7.313 1.00 0.00 H new ATOM 161 N VAL A 11 23.743 -14.082 2.725 1.00 0.00 N ATOM 162 CA VAL A 11 24.933 -14.180 1.871 1.00 0.00 C ATOM 163 C VAL A 11 25.596 -15.562 2.053 1.00 0.00 C ATOM 164 O VAL A 11 25.783 -16.020 3.178 1.00 0.00 O ATOM 165 CB VAL A 11 25.940 -13.019 2.184 1.00 0.00 C ATOM 166 CG1 VAL A 11 27.192 -13.074 1.275 1.00 0.00 C ATOM 167 CG2 VAL A 11 25.228 -11.649 2.067 1.00 0.00 C ATOM 0 H VAL A 11 23.914 -13.616 3.616 1.00 0.00 H new ATOM 0 HA VAL A 11 24.631 -14.078 0.829 1.00 0.00 H new ATOM 0 HB VAL A 11 26.288 -13.149 3.209 1.00 0.00 H new ATOM 0 HG11 VAL A 11 27.861 -12.251 1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 11 27.709 -14.022 1.425 1.00 0.00 H new ATOM 0 HG13 VAL A 11 26.888 -12.988 0.232 1.00 0.00 H new ATOM 0 HG21 VAL A 11 25.937 -10.851 2.286 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.843 -11.524 1.055 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.402 -11.606 2.777 1.00 0.00 H new ATOM 177 N PHE A 12 25.892 -16.229 0.929 1.00 0.00 N ATOM 178 CA PHE A 12 26.533 -17.548 0.887 1.00 0.00 C ATOM 179 C PHE A 12 27.894 -17.448 0.190 1.00 0.00 C ATOM 180 O PHE A 12 27.981 -16.962 -0.937 1.00 0.00 O ATOM 181 CB PHE A 12 25.621 -18.581 0.150 1.00 0.00 C ATOM 182 CG PHE A 12 24.391 -18.994 0.958 1.00 0.00 C ATOM 183 CD1 PHE A 12 23.261 -18.187 1.007 1.00 0.00 C ATOM 184 CD2 PHE A 12 24.382 -20.181 1.693 1.00 0.00 C ATOM 185 CE1 PHE A 12 22.166 -18.548 1.762 1.00 0.00 C ATOM 186 CE2 PHE A 12 23.282 -20.541 2.442 1.00 0.00 C ATOM 187 CZ PHE A 12 22.176 -19.724 2.481 1.00 0.00 C ATOM 0 H PHE A 12 25.687 -15.856 0.002 1.00 0.00 H new ATOM 0 HA PHE A 12 26.684 -17.893 1.910 1.00 0.00 H new ATOM 0 HB2 PHE A 12 25.296 -18.155 -0.799 1.00 0.00 H new ATOM 0 HB3 PHE A 12 26.207 -19.470 -0.084 1.00 0.00 H new ATOM 0 HD1 PHE A 12 23.240 -17.264 0.446 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.248 -20.826 1.675 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.297 -17.907 1.790 1.00 0.00 H new ATOM 0 HE2 PHE A 12 23.289 -21.466 2.999 1.00 0.00 H new ATOM 0 HZ PHE A 12 21.317 -20.003 3.074 1.00 0.00 H new ATOM 197 N LYS A 13 28.954 -17.899 0.881 1.00 0.00 N ATOM 198 CA LYS A 13 30.305 -18.000 0.317 1.00 0.00 C ATOM 199 C LYS A 13 30.373 -19.280 -0.533 1.00 0.00 C ATOM 200 O LYS A 13 30.606 -20.372 -0.008 1.00 0.00 O ATOM 201 CB LYS A 13 31.363 -18.014 1.458 1.00 0.00 C ATOM 202 CG LYS A 13 32.831 -17.918 0.988 1.00 0.00 C ATOM 203 CD LYS A 13 33.165 -16.555 0.331 1.00 0.00 C ATOM 204 CE LYS A 13 34.650 -16.421 -0.039 1.00 0.00 C ATOM 205 NZ LYS A 13 35.078 -17.453 -1.009 1.00 0.00 N ATOM 0 H LYS A 13 28.894 -18.205 1.852 1.00 0.00 H new ATOM 0 HA LYS A 13 30.524 -17.138 -0.313 1.00 0.00 H new ATOM 0 HB2 LYS A 13 31.158 -17.183 2.133 1.00 0.00 H new ATOM 0 HB3 LYS A 13 31.241 -18.931 2.035 1.00 0.00 H new ATOM 0 HG2 LYS A 13 33.491 -18.076 1.841 1.00 0.00 H new ATOM 0 HG3 LYS A 13 33.032 -18.718 0.276 1.00 0.00 H new ATOM 0 HD2 LYS A 13 32.559 -16.431 -0.566 1.00 0.00 H new ATOM 0 HD3 LYS A 13 32.891 -15.751 1.014 1.00 0.00 H new ATOM 0 HE2 LYS A 13 34.830 -15.432 -0.460 1.00 0.00 H new ATOM 0 HE3 LYS A 13 35.256 -16.499 0.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 36.082 -17.314 -1.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 34.947 -18.397 -0.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 34.507 -17.374 -1.874 1.00 0.00 H new ATOM 219 N GLY A 14 30.094 -19.134 -1.838 1.00 0.00 N ATOM 220 CA GLY A 14 29.972 -20.273 -2.741 1.00 0.00 C ATOM 221 C GLY A 14 28.699 -21.060 -2.446 1.00 0.00 C ATOM 222 O GLY A 14 27.619 -20.673 -2.900 1.00 0.00 O ATOM 0 H GLY A 14 29.949 -18.229 -2.287 1.00 0.00 H new ATOM 0 HA2 GLY A 14 29.959 -19.925 -3.774 1.00 0.00 H new ATOM 0 HA3 GLY A 14 30.840 -20.923 -2.634 1.00 0.00 H new ATOM 226 N GLU A 15 28.821 -22.138 -1.643 1.00 0.00 N ATOM 227 CA GLU A 15 27.680 -23.004 -1.257 1.00 0.00 C ATOM 228 C GLU A 15 27.384 -22.913 0.260 1.00 0.00 C ATOM 229 O GLU A 15 26.263 -23.215 0.696 1.00 0.00 O ATOM 230 CB GLU A 15 27.968 -24.477 -1.673 1.00 0.00 C ATOM 231 CG GLU A 15 29.213 -25.106 -1.009 1.00 0.00 C ATOM 232 CD GLU A 15 29.481 -26.552 -1.456 1.00 0.00 C ATOM 233 OE1 GLU A 15 28.834 -27.471 -0.923 1.00 0.00 O ATOM 234 OE2 GLU A 15 30.326 -26.777 -2.355 1.00 0.00 O ATOM 0 H GLU A 15 29.711 -22.435 -1.243 1.00 0.00 H new ATOM 0 HA GLU A 15 26.793 -22.651 -1.783 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.097 -25.085 -1.429 1.00 0.00 H new ATOM 0 HB3 GLU A 15 28.092 -24.517 -2.755 1.00 0.00 H new ATOM 0 HG2 GLU A 15 30.086 -24.495 -1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 15 29.087 -25.086 0.073 1.00 0.00 H new ATOM 241 N GLU A 16 28.389 -22.490 1.060 1.00 0.00 N ATOM 242 CA GLU A 16 28.269 -22.426 2.542 1.00 0.00 C ATOM 243 C GLU A 16 27.688 -21.068 2.975 1.00 0.00 C ATOM 244 O GLU A 16 27.824 -20.080 2.251 1.00 0.00 O ATOM 245 CB GLU A 16 29.656 -22.649 3.218 1.00 0.00 C ATOM 246 CG GLU A 16 30.664 -21.500 3.010 1.00 0.00 C ATOM 247 CD GLU A 16 32.049 -21.783 3.595 1.00 0.00 C ATOM 248 OE1 GLU A 16 32.835 -22.494 2.947 1.00 0.00 O ATOM 249 OE2 GLU A 16 32.368 -21.293 4.696 1.00 0.00 O ATOM 0 H GLU A 16 29.296 -22.186 0.707 1.00 0.00 H new ATOM 0 HA GLU A 16 27.593 -23.219 2.862 1.00 0.00 H new ATOM 0 HB2 GLU A 16 29.505 -22.793 4.288 1.00 0.00 H new ATOM 0 HB3 GLU A 16 30.090 -23.570 2.830 1.00 0.00 H new ATOM 0 HG2 GLU A 16 30.763 -21.305 1.942 1.00 0.00 H new ATOM 0 HG3 GLU A 16 30.266 -20.593 3.464 1.00 0.00 H new ATOM 256 N SER A 17 27.062 -21.025 4.162 1.00 0.00 N ATOM 257 CA SER A 17 26.498 -19.787 4.729 1.00 0.00 C ATOM 258 C SER A 17 27.628 -18.847 5.175 1.00 0.00 C ATOM 259 O SER A 17 28.368 -19.161 6.115 1.00 0.00 O ATOM 260 CB SER A 17 25.570 -20.113 5.920 1.00 0.00 C ATOM 261 OG SER A 17 24.980 -18.940 6.461 1.00 0.00 O ATOM 0 H SER A 17 26.932 -21.845 4.755 1.00 0.00 H new ATOM 0 HA SER A 17 25.909 -19.288 3.959 1.00 0.00 H new ATOM 0 HB2 SER A 17 24.787 -20.798 5.595 1.00 0.00 H new ATOM 0 HB3 SER A 17 26.139 -20.625 6.696 1.00 0.00 H new ATOM 0 HG SER A 17 24.398 -19.183 7.211 1.00 0.00 H new ATOM 267 N PHE A 18 27.772 -17.708 4.485 1.00 0.00 N ATOM 268 CA PHE A 18 28.770 -16.690 4.834 1.00 0.00 C ATOM 269 C PHE A 18 28.242 -15.824 5.992 1.00 0.00 C ATOM 270 O PHE A 18 28.910 -15.666 7.018 1.00 0.00 O ATOM 271 CB PHE A 18 29.105 -15.824 3.598 1.00 0.00 C ATOM 272 CG PHE A 18 30.230 -14.820 3.824 1.00 0.00 C ATOM 273 CD1 PHE A 18 31.518 -15.254 4.126 1.00 0.00 C ATOM 274 CD2 PHE A 18 30.001 -13.450 3.745 1.00 0.00 C ATOM 275 CE1 PHE A 18 32.533 -14.352 4.345 1.00 0.00 C ATOM 276 CE2 PHE A 18 31.018 -12.551 3.966 1.00 0.00 C ATOM 277 CZ PHE A 18 32.283 -13.003 4.263 1.00 0.00 C ATOM 0 H PHE A 18 27.203 -17.468 3.673 1.00 0.00 H new ATOM 0 HA PHE A 18 29.689 -17.179 5.159 1.00 0.00 H new ATOM 0 HB2 PHE A 18 29.380 -16.480 2.772 1.00 0.00 H new ATOM 0 HB3 PHE A 18 28.208 -15.285 3.292 1.00 0.00 H new ATOM 0 HD1 PHE A 18 31.723 -16.313 4.189 1.00 0.00 H new ATOM 0 HD2 PHE A 18 29.012 -13.088 3.507 1.00 0.00 H new ATOM 0 HE1 PHE A 18 33.526 -14.704 4.581 1.00 0.00 H new ATOM 0 HE2 PHE A 18 30.824 -11.490 3.906 1.00 0.00 H new ATOM 0 HZ PHE A 18 33.082 -12.296 4.432 1.00 0.00 H new ATOM 287 N GLY A 19 27.026 -15.287 5.807 1.00 0.00 N ATOM 288 CA GLY A 19 26.381 -14.439 6.802 1.00 0.00 C ATOM 289 C GLY A 19 25.075 -13.852 6.285 1.00 0.00 C ATOM 290 O GLY A 19 24.313 -14.532 5.589 1.00 0.00 O ATOM 0 H GLY A 19 26.470 -15.432 4.964 1.00 0.00 H new ATOM 0 HA2 GLY A 19 26.186 -15.020 7.703 1.00 0.00 H new ATOM 0 HA3 GLY A 19 27.056 -13.631 7.083 1.00 0.00 H new ATOM 294 N GLU A 20 24.835 -12.582 6.611 1.00 0.00 N ATOM 295 CA GLU A 20 23.643 -11.831 6.185 1.00 0.00 C ATOM 296 C GLU A 20 24.066 -10.401 5.802 1.00 0.00 C ATOM 297 O GLU A 20 24.827 -9.774 6.532 1.00 0.00 O ATOM 298 CB GLU A 20 22.589 -11.798 7.337 1.00 0.00 C ATOM 299 CG GLU A 20 23.096 -11.177 8.666 1.00 0.00 C ATOM 300 CD GLU A 20 22.003 -10.966 9.727 1.00 0.00 C ATOM 301 OE1 GLU A 20 21.068 -10.170 9.476 1.00 0.00 O ATOM 302 OE2 GLU A 20 22.073 -11.583 10.818 1.00 0.00 O ATOM 0 H GLU A 20 25.471 -12.032 7.188 1.00 0.00 H new ATOM 0 HA GLU A 20 23.189 -12.318 5.322 1.00 0.00 H new ATOM 0 HB2 GLU A 20 21.719 -11.236 6.998 1.00 0.00 H new ATOM 0 HB3 GLU A 20 22.254 -12.816 7.533 1.00 0.00 H new ATOM 0 HG2 GLU A 20 23.870 -11.822 9.082 1.00 0.00 H new ATOM 0 HG3 GLU A 20 23.564 -10.217 8.449 1.00 0.00 H new ATOM 309 N SER A 21 23.616 -9.900 4.649 1.00 0.00 N ATOM 310 CA SER A 21 23.838 -8.500 4.271 1.00 0.00 C ATOM 311 C SER A 21 22.986 -7.601 5.187 1.00 0.00 C ATOM 312 O SER A 21 21.771 -7.810 5.305 1.00 0.00 O ATOM 313 CB SER A 21 23.501 -8.272 2.781 1.00 0.00 C ATOM 314 OG SER A 21 22.171 -8.623 2.488 1.00 0.00 O ATOM 0 H SER A 21 23.095 -10.442 3.960 1.00 0.00 H new ATOM 0 HA SER A 21 24.890 -8.246 4.399 1.00 0.00 H new ATOM 0 HB2 SER A 21 23.665 -7.225 2.527 1.00 0.00 H new ATOM 0 HB3 SER A 21 24.177 -8.860 2.161 1.00 0.00 H new ATOM 0 HG SER A 21 21.863 -8.115 1.708 1.00 0.00 H new ATOM 320 N ILE A 22 23.641 -6.654 5.868 1.00 0.00 N ATOM 321 CA ILE A 22 22.991 -5.741 6.833 1.00 0.00 C ATOM 322 C ILE A 22 22.954 -4.318 6.239 1.00 0.00 C ATOM 323 O ILE A 22 21.957 -3.599 6.384 1.00 0.00 O ATOM 324 CB ILE A 22 23.740 -5.803 8.243 1.00 0.00 C ATOM 325 CG1 ILE A 22 22.993 -5.011 9.396 1.00 0.00 C ATOM 326 CG2 ILE A 22 25.226 -5.375 8.124 1.00 0.00 C ATOM 327 CD1 ILE A 22 23.282 -3.513 9.496 1.00 0.00 C ATOM 0 H ILE A 22 24.643 -6.493 5.769 1.00 0.00 H new ATOM 0 HA ILE A 22 21.962 -6.051 7.014 1.00 0.00 H new ATOM 0 HB ILE A 22 23.716 -6.851 8.542 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.920 -5.142 9.259 1.00 0.00 H new ATOM 0 HG13 ILE A 22 23.252 -5.472 10.349 1.00 0.00 H new ATOM 0 HG21 ILE A 22 25.700 -5.431 9.104 1.00 0.00 H new ATOM 0 HG22 ILE A 22 25.742 -6.041 7.433 1.00 0.00 H new ATOM 0 HG23 ILE A 22 25.281 -4.352 7.752 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.712 -3.087 10.322 1.00 0.00 H new ATOM 0 HD12 ILE A 22 24.347 -3.359 9.672 1.00 0.00 H new ATOM 0 HD13 ILE A 22 22.994 -3.024 8.566 1.00 0.00 H new ATOM 339 N ASP A 23 24.035 -3.941 5.523 1.00 0.00 N ATOM 340 CA ASP A 23 24.232 -2.557 5.053 1.00 0.00 C ATOM 341 C ASP A 23 25.046 -2.546 3.742 1.00 0.00 C ATOM 342 O ASP A 23 25.583 -3.575 3.330 1.00 0.00 O ATOM 343 CB ASP A 23 24.935 -1.744 6.177 1.00 0.00 C ATOM 344 CG ASP A 23 24.986 -0.229 5.922 1.00 0.00 C ATOM 345 OD1 ASP A 23 23.960 0.449 6.156 1.00 0.00 O ATOM 346 OD2 ASP A 23 26.029 0.286 5.482 1.00 0.00 O ATOM 0 H ASP A 23 24.785 -4.579 5.258 1.00 0.00 H new ATOM 0 HA ASP A 23 23.270 -2.093 4.835 1.00 0.00 H new ATOM 0 HB2 ASP A 23 24.417 -1.925 7.119 1.00 0.00 H new ATOM 0 HB3 ASP A 23 25.953 -2.115 6.296 1.00 0.00 H new ATOM 351 N VAL A 24 25.088 -1.385 3.069 1.00 0.00 N ATOM 352 CA VAL A 24 25.932 -1.155 1.877 1.00 0.00 C ATOM 353 C VAL A 24 26.771 0.125 2.106 1.00 0.00 C ATOM 354 O VAL A 24 26.272 1.119 2.651 1.00 0.00 O ATOM 355 CB VAL A 24 25.071 -1.062 0.552 1.00 0.00 C ATOM 356 CG1 VAL A 24 24.055 0.107 0.608 1.00 0.00 C ATOM 357 CG2 VAL A 24 25.978 -0.968 -0.708 1.00 0.00 C ATOM 0 H VAL A 24 24.534 -0.571 3.336 1.00 0.00 H new ATOM 0 HA VAL A 24 26.599 -2.006 1.741 1.00 0.00 H new ATOM 0 HB VAL A 24 24.496 -1.985 0.475 1.00 0.00 H new ATOM 0 HG11 VAL A 24 23.484 0.137 -0.320 1.00 0.00 H new ATOM 0 HG12 VAL A 24 23.376 -0.041 1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 24 24.590 1.048 0.735 1.00 0.00 H new ATOM 0 HG21 VAL A 24 25.355 -0.906 -1.601 1.00 0.00 H new ATOM 0 HG22 VAL A 24 26.605 -0.079 -0.640 1.00 0.00 H new ATOM 0 HG23 VAL A 24 26.610 -1.854 -0.768 1.00 0.00 H new ATOM 367 N TYR A 25 28.045 0.077 1.701 1.00 0.00 N ATOM 368 CA TYR A 25 29.052 1.100 2.021 1.00 0.00 C ATOM 369 C TYR A 25 30.073 1.197 0.866 1.00 0.00 C ATOM 370 O TYR A 25 30.975 0.365 0.752 1.00 0.00 O ATOM 371 CB TYR A 25 29.713 0.728 3.385 1.00 0.00 C ATOM 372 CG TYR A 25 31.058 1.410 3.700 1.00 0.00 C ATOM 373 CD1 TYR A 25 31.145 2.788 3.879 1.00 0.00 C ATOM 374 CD2 TYR A 25 32.240 0.661 3.805 1.00 0.00 C ATOM 375 CE1 TYR A 25 32.355 3.393 4.134 1.00 0.00 C ATOM 376 CE2 TYR A 25 33.450 1.268 4.069 1.00 0.00 C ATOM 377 CZ TYR A 25 33.500 2.632 4.230 1.00 0.00 C ATOM 378 OH TYR A 25 34.707 3.242 4.468 1.00 0.00 O ATOM 0 H TYR A 25 28.413 -0.685 1.132 1.00 0.00 H new ATOM 0 HA TYR A 25 28.599 2.086 2.124 1.00 0.00 H new ATOM 0 HB2 TYR A 25 29.011 0.971 4.183 1.00 0.00 H new ATOM 0 HB3 TYR A 25 29.863 -0.351 3.410 1.00 0.00 H new ATOM 0 HD1 TYR A 25 30.251 3.391 3.817 1.00 0.00 H new ATOM 0 HD2 TYR A 25 32.202 -0.411 3.677 1.00 0.00 H new ATOM 0 HE1 TYR A 25 32.407 4.464 4.259 1.00 0.00 H new ATOM 0 HE2 TYR A 25 34.350 0.677 4.149 1.00 0.00 H new ATOM 0 HH TYR A 25 34.575 4.210 4.541 1.00 0.00 H new ATOM 388 N GLY A 26 29.895 2.213 0.010 1.00 0.00 N ATOM 389 CA GLY A 26 30.771 2.441 -1.140 1.00 0.00 C ATOM 390 C GLY A 26 30.555 1.400 -2.228 1.00 0.00 C ATOM 391 O GLY A 26 29.513 1.404 -2.886 1.00 0.00 O ATOM 0 H GLY A 26 29.142 2.895 0.098 1.00 0.00 H new ATOM 0 HA2 GLY A 26 30.586 3.435 -1.546 1.00 0.00 H new ATOM 0 HA3 GLY A 26 31.811 2.417 -0.815 1.00 0.00 H new ATOM 395 N ASP A 27 31.539 0.501 -2.407 1.00 0.00 N ATOM 396 CA ASP A 27 31.411 -0.674 -3.299 1.00 0.00 C ATOM 397 C ASP A 27 31.210 -1.944 -2.448 1.00 0.00 C ATOM 398 O ASP A 27 30.971 -3.018 -2.963 1.00 0.00 O ATOM 399 CB ASP A 27 32.687 -0.808 -4.186 1.00 0.00 C ATOM 400 CG ASP A 27 32.545 -1.865 -5.311 1.00 0.00 C ATOM 401 OD1 ASP A 27 31.937 -1.550 -6.352 1.00 0.00 O ATOM 402 OD2 ASP A 27 33.033 -3.013 -5.159 1.00 0.00 O ATOM 0 H ASP A 27 32.444 0.565 -1.941 1.00 0.00 H new ATOM 0 HA ASP A 27 30.548 -0.545 -3.952 1.00 0.00 H new ATOM 0 HB2 ASP A 27 32.913 0.160 -4.633 1.00 0.00 H new ATOM 0 HB3 ASP A 27 33.534 -1.073 -3.553 1.00 0.00 H new ATOM 407 N TYR A 28 31.298 -1.805 -1.128 1.00 0.00 N ATOM 408 CA TYR A 28 31.315 -2.938 -0.199 1.00 0.00 C ATOM 409 C TYR A 28 29.937 -3.155 0.430 1.00 0.00 C ATOM 410 O TYR A 28 29.454 -2.323 1.202 1.00 0.00 O ATOM 411 CB TYR A 28 32.382 -2.703 0.886 1.00 0.00 C ATOM 412 CG TYR A 28 33.768 -2.395 0.301 1.00 0.00 C ATOM 413 CD1 TYR A 28 34.594 -3.424 -0.164 1.00 0.00 C ATOM 414 CD2 TYR A 28 34.244 -1.087 0.221 1.00 0.00 C ATOM 415 CE1 TYR A 28 35.837 -3.152 -0.694 1.00 0.00 C ATOM 416 CE2 TYR A 28 35.486 -0.812 -0.306 1.00 0.00 C ATOM 417 CZ TYR A 28 36.283 -1.846 -0.754 1.00 0.00 C ATOM 418 OH TYR A 28 37.533 -1.572 -1.266 1.00 0.00 O ATOM 0 H TYR A 28 31.360 -0.897 -0.667 1.00 0.00 H new ATOM 0 HA TYR A 28 31.568 -3.841 -0.754 1.00 0.00 H new ATOM 0 HB2 TYR A 28 32.070 -1.876 1.523 1.00 0.00 H new ATOM 0 HB3 TYR A 28 32.449 -3.587 1.521 1.00 0.00 H new ATOM 0 HD1 TYR A 28 34.253 -4.447 -0.107 1.00 0.00 H new ATOM 0 HD2 TYR A 28 33.628 -0.275 0.579 1.00 0.00 H new ATOM 0 HE1 TYR A 28 36.459 -3.955 -1.060 1.00 0.00 H new ATOM 0 HE2 TYR A 28 35.835 0.208 -0.369 1.00 0.00 H new ATOM 0 HH TYR A 28 37.693 -0.606 -1.238 1.00 0.00 H new ATOM 428 N LEU A 29 29.325 -4.292 0.092 1.00 0.00 N ATOM 429 CA LEU A 29 28.128 -4.796 0.755 1.00 0.00 C ATOM 430 C LEU A 29 28.552 -5.346 2.132 1.00 0.00 C ATOM 431 O LEU A 29 29.235 -6.380 2.216 1.00 0.00 O ATOM 432 CB LEU A 29 27.473 -5.919 -0.110 1.00 0.00 C ATOM 433 CG LEU A 29 26.191 -6.583 0.486 1.00 0.00 C ATOM 434 CD1 LEU A 29 25.048 -5.554 0.668 1.00 0.00 C ATOM 435 CD2 LEU A 29 25.736 -7.781 -0.381 1.00 0.00 C ATOM 0 H LEU A 29 29.655 -4.895 -0.662 1.00 0.00 H new ATOM 0 HA LEU A 29 27.392 -4.002 0.881 1.00 0.00 H new ATOM 0 HB2 LEU A 29 27.221 -5.500 -1.084 1.00 0.00 H new ATOM 0 HB3 LEU A 29 28.216 -6.698 -0.281 1.00 0.00 H new ATOM 0 HG LEU A 29 26.445 -6.962 1.476 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.173 -6.052 1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 29 25.373 -4.765 1.346 1.00 0.00 H new ATOM 0 HD13 LEU A 29 24.792 -5.119 -0.298 1.00 0.00 H new ATOM 0 HD21 LEU A 29 24.842 -8.227 0.055 1.00 0.00 H new ATOM 0 HD22 LEU A 29 25.514 -7.436 -1.391 1.00 0.00 H new ATOM 0 HD23 LEU A 29 26.531 -8.526 -0.418 1.00 0.00 H new ATOM 447 N ILE A 30 28.202 -4.593 3.191 1.00 0.00 N ATOM 448 CA ILE A 30 28.525 -4.947 4.583 1.00 0.00 C ATOM 449 C ILE A 30 27.722 -6.188 4.986 1.00 0.00 C ATOM 450 O ILE A 30 26.495 -6.114 5.164 1.00 0.00 O ATOM 451 CB ILE A 30 28.204 -3.773 5.599 1.00 0.00 C ATOM 452 CG1 ILE A 30 28.831 -2.421 5.140 1.00 0.00 C ATOM 453 CG2 ILE A 30 28.659 -4.129 7.044 1.00 0.00 C ATOM 454 CD1 ILE A 30 30.346 -2.409 5.101 1.00 0.00 C ATOM 0 H ILE A 30 27.685 -3.718 3.103 1.00 0.00 H new ATOM 0 HA ILE A 30 29.597 -5.141 4.630 1.00 0.00 H new ATOM 0 HB ILE A 30 27.121 -3.650 5.607 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.453 -2.179 4.147 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.492 -1.632 5.811 1.00 0.00 H new ATOM 0 HG21 ILE A 30 28.424 -3.302 7.714 1.00 0.00 H new ATOM 0 HG22 ILE A 30 28.139 -5.026 7.379 1.00 0.00 H new ATOM 0 HG23 ILE A 30 29.734 -4.308 7.053 1.00 0.00 H new ATOM 0 HD11 ILE A 30 30.694 -1.430 4.771 1.00 0.00 H new ATOM 0 HD12 ILE A 30 30.737 -2.616 6.097 1.00 0.00 H new ATOM 0 HD13 ILE A 30 30.698 -3.172 4.407 1.00 0.00 H new ATOM 466 N VAL A 31 28.412 -7.331 5.081 1.00 0.00 N ATOM 467 CA VAL A 31 27.811 -8.592 5.504 1.00 0.00 C ATOM 468 C VAL A 31 28.147 -8.848 6.981 1.00 0.00 C ATOM 469 O VAL A 31 29.313 -8.977 7.358 1.00 0.00 O ATOM 470 CB VAL A 31 28.293 -9.797 4.616 1.00 0.00 C ATOM 471 CG1 VAL A 31 27.598 -11.116 5.021 1.00 0.00 C ATOM 472 CG2 VAL A 31 28.096 -9.492 3.113 1.00 0.00 C ATOM 0 H VAL A 31 29.406 -7.403 4.865 1.00 0.00 H new ATOM 0 HA VAL A 31 26.731 -8.513 5.381 1.00 0.00 H new ATOM 0 HB VAL A 31 29.361 -9.930 4.791 1.00 0.00 H new ATOM 0 HG11 VAL A 31 27.956 -11.926 4.386 1.00 0.00 H new ATOM 0 HG12 VAL A 31 27.827 -11.343 6.062 1.00 0.00 H new ATOM 0 HG13 VAL A 31 26.520 -11.011 4.901 1.00 0.00 H new ATOM 0 HG21 VAL A 31 28.437 -10.342 2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 31 27.040 -9.312 2.914 1.00 0.00 H new ATOM 0 HG23 VAL A 31 28.672 -8.607 2.843 1.00 0.00 H new ATOM 482 N LYS A 32 27.101 -8.903 7.801 1.00 0.00 N ATOM 483 CA LYS A 32 27.176 -9.274 9.210 1.00 0.00 C ATOM 484 C LYS A 32 27.430 -10.794 9.266 1.00 0.00 C ATOM 485 O LYS A 32 26.570 -11.588 8.884 1.00 0.00 O ATOM 486 CB LYS A 32 25.830 -8.857 9.888 1.00 0.00 C ATOM 487 CG LYS A 32 25.723 -8.973 11.436 1.00 0.00 C ATOM 488 CD LYS A 32 25.737 -10.428 11.982 1.00 0.00 C ATOM 489 CE LYS A 32 24.974 -10.583 13.310 1.00 0.00 C ATOM 490 NZ LYS A 32 23.524 -10.282 13.160 1.00 0.00 N ATOM 0 H LYS A 32 26.153 -8.685 7.495 1.00 0.00 H new ATOM 0 HA LYS A 32 27.982 -8.773 9.745 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.627 -7.821 9.616 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.035 -9.463 9.452 1.00 0.00 H new ATOM 0 HG2 LYS A 32 26.550 -8.423 11.886 1.00 0.00 H new ATOM 0 HG3 LYS A 32 24.803 -8.487 11.760 1.00 0.00 H new ATOM 0 HD2 LYS A 32 25.298 -11.093 11.238 1.00 0.00 H new ATOM 0 HD3 LYS A 32 26.770 -10.746 12.124 1.00 0.00 H new ATOM 0 HE2 LYS A 32 25.096 -11.600 13.681 1.00 0.00 H new ATOM 0 HE3 LYS A 32 25.407 -9.917 14.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.002 -10.680 13.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 23.384 -9.252 13.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 23.172 -10.703 12.277 1.00 0.00 H new ATOM 504 N VAL A 33 28.634 -11.177 9.709 1.00 0.00 N ATOM 505 CA VAL A 33 29.066 -12.584 9.797 1.00 0.00 C ATOM 506 C VAL A 33 29.203 -13.017 11.277 1.00 0.00 C ATOM 507 O VAL A 33 30.272 -12.912 11.897 1.00 0.00 O ATOM 508 CB VAL A 33 30.397 -12.820 8.965 1.00 0.00 C ATOM 509 CG1 VAL A 33 30.129 -12.668 7.449 1.00 0.00 C ATOM 510 CG2 VAL A 33 31.531 -11.859 9.387 1.00 0.00 C ATOM 0 H VAL A 33 29.345 -10.515 10.020 1.00 0.00 H new ATOM 0 HA VAL A 33 28.301 -13.218 9.348 1.00 0.00 H new ATOM 0 HB VAL A 33 30.723 -13.838 9.179 1.00 0.00 H new ATOM 0 HG11 VAL A 33 31.054 -12.834 6.897 1.00 0.00 H new ATOM 0 HG12 VAL A 33 29.384 -13.400 7.136 1.00 0.00 H new ATOM 0 HG13 VAL A 33 29.759 -11.663 7.244 1.00 0.00 H new ATOM 0 HG21 VAL A 33 32.420 -12.060 8.789 1.00 0.00 H new ATOM 0 HG22 VAL A 33 31.213 -10.829 9.229 1.00 0.00 H new ATOM 0 HG23 VAL A 33 31.762 -12.009 10.442 1.00 0.00 H new ATOM 520 N GLY A 34 28.069 -13.445 11.851 1.00 0.00 N ATOM 521 CA GLY A 34 28.019 -13.958 13.221 1.00 0.00 C ATOM 522 C GLY A 34 28.277 -12.885 14.278 1.00 0.00 C ATOM 523 O GLY A 34 27.348 -12.216 14.728 1.00 0.00 O ATOM 0 H GLY A 34 27.166 -13.444 11.377 1.00 0.00 H new ATOM 0 HA2 GLY A 34 27.041 -14.405 13.399 1.00 0.00 H new ATOM 0 HA3 GLY A 34 28.758 -14.752 13.331 1.00 0.00 H new ATOM 527 N THR A 35 29.555 -12.720 14.663 1.00 0.00 N ATOM 528 CA THR A 35 29.984 -11.759 15.700 1.00 0.00 C ATOM 529 C THR A 35 30.677 -10.530 15.076 1.00 0.00 C ATOM 530 O THR A 35 30.922 -9.531 15.770 1.00 0.00 O ATOM 531 CB THR A 35 30.955 -12.453 16.717 1.00 0.00 C ATOM 532 OG1 THR A 35 32.122 -12.945 16.029 1.00 0.00 O ATOM 533 CG2 THR A 35 30.269 -13.626 17.449 1.00 0.00 C ATOM 0 H THR A 35 30.326 -13.253 14.261 1.00 0.00 H new ATOM 0 HA THR A 35 29.091 -11.419 16.225 1.00 0.00 H new ATOM 0 HB THR A 35 31.243 -11.706 17.456 1.00 0.00 H new ATOM 0 HG1 THR A 35 32.724 -13.375 16.672 1.00 0.00 H new ATOM 0 HG21 THR A 35 30.973 -14.082 18.145 1.00 0.00 H new ATOM 0 HG22 THR A 35 29.404 -13.256 17.999 1.00 0.00 H new ATOM 0 HG23 THR A 35 29.945 -14.370 16.721 1.00 0.00 H new ATOM 541 N GLU A 36 30.980 -10.605 13.757 1.00 0.00 N ATOM 542 CA GLU A 36 31.762 -9.575 13.039 1.00 0.00 C ATOM 543 C GLU A 36 30.997 -9.036 11.818 1.00 0.00 C ATOM 544 O GLU A 36 29.825 -9.365 11.600 1.00 0.00 O ATOM 545 CB GLU A 36 33.144 -10.160 12.617 1.00 0.00 C ATOM 546 CG GLU A 36 33.962 -10.747 13.781 1.00 0.00 C ATOM 547 CD GLU A 36 35.412 -11.050 13.401 1.00 0.00 C ATOM 548 OE1 GLU A 36 35.670 -12.114 12.796 1.00 0.00 O ATOM 549 OE2 GLU A 36 36.296 -10.211 13.682 1.00 0.00 O ATOM 0 H GLU A 36 30.688 -11.382 13.164 1.00 0.00 H new ATOM 0 HA GLU A 36 31.925 -8.735 13.714 1.00 0.00 H new ATOM 0 HB2 GLU A 36 32.984 -10.939 11.871 1.00 0.00 H new ATOM 0 HB3 GLU A 36 33.728 -9.374 12.137 1.00 0.00 H new ATOM 0 HG2 GLU A 36 33.950 -10.046 14.616 1.00 0.00 H new ATOM 0 HG3 GLU A 36 33.484 -11.663 14.127 1.00 0.00 H new ATOM 556 N PHE A 37 31.674 -8.140 11.067 1.00 0.00 N ATOM 557 CA PHE A 37 31.189 -7.561 9.799 1.00 0.00 C ATOM 558 C PHE A 37 32.298 -7.667 8.733 1.00 0.00 C ATOM 559 O PHE A 37 33.335 -6.997 8.831 1.00 0.00 O ATOM 560 CB PHE A 37 30.772 -6.069 9.988 1.00 0.00 C ATOM 561 CG PHE A 37 29.605 -5.862 10.956 1.00 0.00 C ATOM 562 CD1 PHE A 37 29.819 -5.771 12.332 1.00 0.00 C ATOM 563 CD2 PHE A 37 28.293 -5.771 10.491 1.00 0.00 C ATOM 564 CE1 PHE A 37 28.768 -5.600 13.204 1.00 0.00 C ATOM 565 CE2 PHE A 37 27.242 -5.600 11.369 1.00 0.00 C ATOM 566 CZ PHE A 37 27.479 -5.513 12.721 1.00 0.00 C ATOM 0 H PHE A 37 32.595 -7.792 11.334 1.00 0.00 H new ATOM 0 HA PHE A 37 30.310 -8.118 9.474 1.00 0.00 H new ATOM 0 HB2 PHE A 37 31.633 -5.506 10.348 1.00 0.00 H new ATOM 0 HB3 PHE A 37 30.502 -5.653 9.017 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.825 -5.836 12.719 1.00 0.00 H new ATOM 0 HD2 PHE A 37 28.097 -5.835 9.431 1.00 0.00 H new ATOM 0 HE1 PHE A 37 28.953 -5.534 14.266 1.00 0.00 H new ATOM 0 HE2 PHE A 37 26.231 -5.534 10.994 1.00 0.00 H new ATOM 0 HZ PHE A 37 26.655 -5.376 13.405 1.00 0.00 H new ATOM 576 N LEU A 38 32.076 -8.537 7.735 1.00 0.00 N ATOM 577 CA LEU A 38 32.956 -8.713 6.565 1.00 0.00 C ATOM 578 C LEU A 38 32.319 -8.010 5.355 1.00 0.00 C ATOM 579 O LEU A 38 31.297 -8.462 4.827 1.00 0.00 O ATOM 580 CB LEU A 38 33.191 -10.239 6.300 1.00 0.00 C ATOM 581 CG LEU A 38 34.548 -10.830 6.799 1.00 0.00 C ATOM 582 CD1 LEU A 38 35.715 -10.290 5.960 1.00 0.00 C ATOM 583 CD2 LEU A 38 34.781 -10.567 8.305 1.00 0.00 C ATOM 0 H LEU A 38 31.262 -9.152 7.717 1.00 0.00 H new ATOM 0 HA LEU A 38 33.931 -8.263 6.749 1.00 0.00 H new ATOM 0 HB2 LEU A 38 32.382 -10.796 6.772 1.00 0.00 H new ATOM 0 HB3 LEU A 38 33.116 -10.415 5.227 1.00 0.00 H new ATOM 0 HG LEU A 38 34.498 -11.911 6.669 1.00 0.00 H new ATOM 0 HD11 LEU A 38 36.651 -10.714 6.324 1.00 0.00 H new ATOM 0 HD12 LEU A 38 35.572 -10.569 4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 38 35.752 -9.204 6.044 1.00 0.00 H new ATOM 0 HD21 LEU A 38 35.737 -10.996 8.606 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.792 -9.493 8.489 1.00 0.00 H new ATOM 0 HD23 LEU A 38 33.979 -11.026 8.883 1.00 0.00 H new ATOM 595 N ALA A 39 32.937 -6.898 4.944 1.00 0.00 N ATOM 596 CA ALA A 39 32.421 -6.030 3.880 1.00 0.00 C ATOM 597 C ALA A 39 32.890 -6.507 2.494 1.00 0.00 C ATOM 598 O ALA A 39 33.983 -6.143 2.040 1.00 0.00 O ATOM 599 CB ALA A 39 32.879 -4.591 4.152 1.00 0.00 C ATOM 0 H ALA A 39 33.817 -6.572 5.344 1.00 0.00 H new ATOM 0 HA ALA A 39 31.332 -6.071 3.878 1.00 0.00 H new ATOM 0 HB1 ALA A 39 32.502 -3.935 3.368 1.00 0.00 H new ATOM 0 HB2 ALA A 39 32.493 -4.262 5.117 1.00 0.00 H new ATOM 0 HB3 ALA A 39 33.968 -4.552 4.165 1.00 0.00 H new ATOM 605 N VAL A 40 32.060 -7.326 1.827 1.00 0.00 N ATOM 606 CA VAL A 40 32.402 -7.907 0.514 1.00 0.00 C ATOM 607 C VAL A 40 32.077 -6.891 -0.608 1.00 0.00 C ATOM 608 O VAL A 40 30.994 -6.313 -0.602 1.00 0.00 O ATOM 609 CB VAL A 40 31.663 -9.289 0.269 1.00 0.00 C ATOM 610 CG1 VAL A 40 31.967 -10.261 1.423 1.00 0.00 C ATOM 611 CG2 VAL A 40 30.132 -9.133 0.075 1.00 0.00 C ATOM 0 H VAL A 40 31.142 -7.603 2.176 1.00 0.00 H new ATOM 0 HA VAL A 40 33.471 -8.118 0.502 1.00 0.00 H new ATOM 0 HB VAL A 40 32.051 -9.697 -0.665 1.00 0.00 H new ATOM 0 HG11 VAL A 40 31.455 -11.207 1.246 1.00 0.00 H new ATOM 0 HG12 VAL A 40 33.042 -10.435 1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 40 31.620 -9.831 2.362 1.00 0.00 H new ATOM 0 HG21 VAL A 40 29.684 -10.113 -0.088 1.00 0.00 H new ATOM 0 HG22 VAL A 40 29.697 -8.679 0.965 1.00 0.00 H new ATOM 0 HG23 VAL A 40 29.938 -8.497 -0.789 1.00 0.00 H new ATOM 621 N PRO A 41 33.009 -6.631 -1.577 1.00 0.00 N ATOM 622 CA PRO A 41 32.739 -5.715 -2.714 1.00 0.00 C ATOM 623 C PRO A 41 31.638 -6.255 -3.645 1.00 0.00 C ATOM 624 O PRO A 41 31.378 -7.455 -3.663 1.00 0.00 O ATOM 625 CB PRO A 41 34.106 -5.624 -3.432 1.00 0.00 C ATOM 626 CG PRO A 41 34.792 -6.899 -3.073 1.00 0.00 C ATOM 627 CD PRO A 41 34.388 -7.180 -1.641 1.00 0.00 C ATOM 0 HA PRO A 41 32.364 -4.744 -2.390 1.00 0.00 H new ATOM 0 HB2 PRO A 41 33.984 -5.527 -4.511 1.00 0.00 H new ATOM 0 HB3 PRO A 41 34.675 -4.757 -3.097 1.00 0.00 H new ATOM 0 HG2 PRO A 41 34.486 -7.710 -3.734 1.00 0.00 H new ATOM 0 HG3 PRO A 41 35.874 -6.803 -3.165 1.00 0.00 H new ATOM 0 HD2 PRO A 41 34.410 -8.246 -1.416 1.00 0.00 H new ATOM 0 HD3 PRO A 41 35.052 -6.690 -0.929 1.00 0.00 H new ATOM 635 N LYS A 42 31.024 -5.363 -4.440 1.00 0.00 N ATOM 636 CA LYS A 42 29.903 -5.705 -5.350 1.00 0.00 C ATOM 637 C LYS A 42 30.367 -6.643 -6.492 1.00 0.00 C ATOM 638 O LYS A 42 29.561 -7.368 -7.086 1.00 0.00 O ATOM 639 CB LYS A 42 29.247 -4.409 -5.917 1.00 0.00 C ATOM 640 CG LYS A 42 28.569 -3.497 -4.851 1.00 0.00 C ATOM 641 CD LYS A 42 27.276 -4.099 -4.242 1.00 0.00 C ATOM 642 CE LYS A 42 26.101 -4.093 -5.236 1.00 0.00 C ATOM 643 NZ LYS A 42 24.883 -4.749 -4.693 1.00 0.00 N ATOM 0 H LYS A 42 31.288 -4.378 -4.474 1.00 0.00 H new ATOM 0 HA LYS A 42 29.152 -6.245 -4.773 1.00 0.00 H new ATOM 0 HB2 LYS A 42 30.011 -3.830 -6.437 1.00 0.00 H new ATOM 0 HB3 LYS A 42 28.501 -4.692 -6.660 1.00 0.00 H new ATOM 0 HG2 LYS A 42 29.280 -3.302 -4.049 1.00 0.00 H new ATOM 0 HG3 LYS A 42 28.331 -2.536 -5.307 1.00 0.00 H new ATOM 0 HD2 LYS A 42 27.471 -5.122 -3.921 1.00 0.00 H new ATOM 0 HD3 LYS A 42 26.999 -3.533 -3.353 1.00 0.00 H new ATOM 0 HE2 LYS A 42 25.864 -3.064 -5.505 1.00 0.00 H new ATOM 0 HE3 LYS A 42 26.404 -4.600 -6.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 24.205 -4.914 -5.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 25.142 -5.658 -4.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 24.448 -4.134 -3.975 1.00 0.00 H new ATOM 657 N LYS A 43 31.679 -6.615 -6.767 1.00 0.00 N ATOM 658 CA LYS A 43 32.335 -7.499 -7.750 1.00 0.00 C ATOM 659 C LYS A 43 32.518 -8.939 -7.207 1.00 0.00 C ATOM 660 O LYS A 43 32.716 -9.874 -7.989 1.00 0.00 O ATOM 661 CB LYS A 43 33.697 -6.887 -8.162 1.00 0.00 C ATOM 662 CG LYS A 43 34.702 -6.688 -7.001 1.00 0.00 C ATOM 663 CD LYS A 43 36.000 -5.958 -7.439 1.00 0.00 C ATOM 664 CE LYS A 43 35.753 -4.512 -7.915 1.00 0.00 C ATOM 665 NZ LYS A 43 35.150 -3.669 -6.854 1.00 0.00 N ATOM 0 H LYS A 43 32.325 -5.972 -6.309 1.00 0.00 H new ATOM 0 HA LYS A 43 31.690 -7.575 -8.625 1.00 0.00 H new ATOM 0 HB2 LYS A 43 34.155 -7.530 -8.913 1.00 0.00 H new ATOM 0 HB3 LYS A 43 33.516 -5.922 -8.636 1.00 0.00 H new ATOM 0 HG2 LYS A 43 34.222 -6.117 -6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 43 34.962 -7.660 -6.583 1.00 0.00 H new ATOM 0 HD2 LYS A 43 36.701 -5.944 -6.604 1.00 0.00 H new ATOM 0 HD3 LYS A 43 36.473 -6.522 -8.243 1.00 0.00 H new ATOM 0 HE2 LYS A 43 36.697 -4.070 -8.235 1.00 0.00 H new ATOM 0 HE3 LYS A 43 35.096 -4.525 -8.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 35.126 -2.678 -7.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 34.181 -3.994 -6.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 35.719 -3.743 -5.987 1.00 0.00 H new ATOM 679 N SER A 44 32.449 -9.100 -5.869 1.00 0.00 N ATOM 680 CA SER A 44 32.544 -10.423 -5.218 1.00 0.00 C ATOM 681 C SER A 44 31.264 -11.250 -5.470 1.00 0.00 C ATOM 682 O SER A 44 31.327 -12.479 -5.538 1.00 0.00 O ATOM 683 CB SER A 44 32.798 -10.272 -3.698 1.00 0.00 C ATOM 684 OG SER A 44 32.985 -11.529 -3.059 1.00 0.00 O ATOM 0 H SER A 44 32.327 -8.326 -5.216 1.00 0.00 H new ATOM 0 HA SER A 44 33.389 -10.954 -5.656 1.00 0.00 H new ATOM 0 HB2 SER A 44 33.679 -9.650 -3.538 1.00 0.00 H new ATOM 0 HB3 SER A 44 31.955 -9.755 -3.240 1.00 0.00 H new ATOM 0 HG SER A 44 33.835 -11.920 -3.349 1.00 0.00 H new ATOM 690 N ILE A 45 30.120 -10.557 -5.640 1.00 0.00 N ATOM 691 CA ILE A 45 28.809 -11.203 -5.828 1.00 0.00 C ATOM 692 C ILE A 45 28.751 -11.881 -7.213 1.00 0.00 C ATOM 693 O ILE A 45 28.890 -11.225 -8.246 1.00 0.00 O ATOM 694 CB ILE A 45 27.600 -10.193 -5.655 1.00 0.00 C ATOM 695 CG1 ILE A 45 27.451 -9.680 -4.177 1.00 0.00 C ATOM 696 CG2 ILE A 45 26.264 -10.831 -6.122 1.00 0.00 C ATOM 697 CD1 ILE A 45 28.544 -8.777 -3.651 1.00 0.00 C ATOM 0 H ILE A 45 30.081 -9.538 -5.651 1.00 0.00 H new ATOM 0 HA ILE A 45 28.703 -11.956 -5.047 1.00 0.00 H new ATOM 0 HB ILE A 45 27.829 -9.334 -6.286 1.00 0.00 H new ATOM 0 HG12 ILE A 45 26.503 -9.147 -4.097 1.00 0.00 H new ATOM 0 HG13 ILE A 45 27.384 -10.549 -3.522 1.00 0.00 H new ATOM 0 HG21 ILE A 45 25.453 -10.114 -5.991 1.00 0.00 H new ATOM 0 HG22 ILE A 45 26.340 -11.105 -7.174 1.00 0.00 H new ATOM 0 HG23 ILE A 45 26.060 -11.722 -5.529 1.00 0.00 H new ATOM 0 HD11 ILE A 45 28.320 -8.496 -2.622 1.00 0.00 H new ATOM 0 HD12 ILE A 45 29.498 -9.303 -3.684 1.00 0.00 H new ATOM 0 HD13 ILE A 45 28.603 -7.880 -4.268 1.00 0.00 H new ATOM 709 N LYS A 46 28.574 -13.206 -7.196 1.00 0.00 N ATOM 710 CA LYS A 46 28.428 -14.036 -8.398 1.00 0.00 C ATOM 711 C LYS A 46 26.972 -14.070 -8.869 1.00 0.00 C ATOM 712 O LYS A 46 26.674 -13.758 -10.028 1.00 0.00 O ATOM 713 CB LYS A 46 28.910 -15.479 -8.097 1.00 0.00 C ATOM 714 CG LYS A 46 30.366 -15.631 -7.586 1.00 0.00 C ATOM 715 CD LYS A 46 31.475 -15.205 -8.603 1.00 0.00 C ATOM 716 CE LYS A 46 31.823 -13.702 -8.566 1.00 0.00 C ATOM 717 NZ LYS A 46 32.917 -13.366 -9.497 1.00 0.00 N ATOM 0 H LYS A 46 28.527 -13.743 -6.330 1.00 0.00 H new ATOM 0 HA LYS A 46 29.036 -13.601 -9.191 1.00 0.00 H new ATOM 0 HB2 LYS A 46 28.241 -15.914 -7.354 1.00 0.00 H new ATOM 0 HB3 LYS A 46 28.804 -16.070 -9.007 1.00 0.00 H new ATOM 0 HG2 LYS A 46 30.480 -15.038 -6.679 1.00 0.00 H new ATOM 0 HG3 LYS A 46 30.530 -16.672 -7.309 1.00 0.00 H new ATOM 0 HD2 LYS A 46 32.378 -15.781 -8.401 1.00 0.00 H new ATOM 0 HD3 LYS A 46 31.149 -15.466 -9.610 1.00 0.00 H new ATOM 0 HE2 LYS A 46 30.938 -13.118 -8.820 1.00 0.00 H new ATOM 0 HE3 LYS A 46 32.110 -13.421 -7.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 33.120 -12.347 -9.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 33.769 -13.903 -9.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 32.634 -13.610 -10.468 1.00 0.00 H new ATOM 731 N SER A 47 26.075 -14.453 -7.948 1.00 0.00 N ATOM 732 CA SER A 47 24.660 -14.702 -8.253 1.00 0.00 C ATOM 733 C SER A 47 23.751 -14.039 -7.205 1.00 0.00 C ATOM 734 O SER A 47 24.112 -13.936 -6.028 1.00 0.00 O ATOM 735 CB SER A 47 24.398 -16.227 -8.298 1.00 0.00 C ATOM 736 OG SER A 47 25.221 -16.873 -9.253 1.00 0.00 O ATOM 0 H SER A 47 26.313 -14.599 -6.967 1.00 0.00 H new ATOM 0 HA SER A 47 24.430 -14.267 -9.226 1.00 0.00 H new ATOM 0 HB2 SER A 47 24.579 -16.656 -7.313 1.00 0.00 H new ATOM 0 HB3 SER A 47 23.350 -16.409 -8.538 1.00 0.00 H new ATOM 0 HG SER A 47 25.030 -17.834 -9.253 1.00 0.00 H new ATOM 742 N VAL A 48 22.573 -13.588 -7.659 1.00 0.00 N ATOM 743 CA VAL A 48 21.509 -13.045 -6.796 1.00 0.00 C ATOM 744 C VAL A 48 20.278 -13.970 -6.862 1.00 0.00 C ATOM 745 O VAL A 48 19.795 -14.314 -7.947 1.00 0.00 O ATOM 746 CB VAL A 48 21.118 -11.564 -7.197 1.00 0.00 C ATOM 747 CG1 VAL A 48 20.704 -11.445 -8.692 1.00 0.00 C ATOM 748 CG2 VAL A 48 20.013 -11.008 -6.259 1.00 0.00 C ATOM 0 H VAL A 48 22.327 -13.589 -8.649 1.00 0.00 H new ATOM 0 HA VAL A 48 21.884 -13.006 -5.773 1.00 0.00 H new ATOM 0 HB VAL A 48 22.011 -10.952 -7.071 1.00 0.00 H new ATOM 0 HG11 VAL A 48 20.445 -10.410 -8.917 1.00 0.00 H new ATOM 0 HG12 VAL A 48 21.534 -11.757 -9.325 1.00 0.00 H new ATOM 0 HG13 VAL A 48 19.842 -12.084 -8.883 1.00 0.00 H new ATOM 0 HG21 VAL A 48 19.763 -9.989 -6.556 1.00 0.00 H new ATOM 0 HG22 VAL A 48 19.125 -11.636 -6.331 1.00 0.00 H new ATOM 0 HG23 VAL A 48 20.375 -11.008 -5.231 1.00 0.00 H new ATOM 758 N GLU A 49 19.807 -14.405 -5.690 1.00 0.00 N ATOM 759 CA GLU A 49 18.621 -15.269 -5.548 1.00 0.00 C ATOM 760 C GLU A 49 17.584 -14.562 -4.654 1.00 0.00 C ATOM 761 O GLU A 49 17.866 -13.499 -4.070 1.00 0.00 O ATOM 762 CB GLU A 49 19.020 -16.640 -4.926 1.00 0.00 C ATOM 763 CG GLU A 49 20.146 -17.413 -5.652 1.00 0.00 C ATOM 764 CD GLU A 49 19.812 -17.791 -7.109 1.00 0.00 C ATOM 765 OE1 GLU A 49 18.878 -18.601 -7.319 1.00 0.00 O ATOM 766 OE2 GLU A 49 20.497 -17.315 -8.045 1.00 0.00 O ATOM 0 H GLU A 49 20.241 -14.166 -4.798 1.00 0.00 H new ATOM 0 HA GLU A 49 18.189 -15.452 -6.532 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.329 -16.472 -3.894 1.00 0.00 H new ATOM 0 HB3 GLU A 49 18.134 -17.274 -4.894 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.052 -16.807 -5.644 1.00 0.00 H new ATOM 0 HG3 GLU A 49 20.366 -18.323 -5.093 1.00 0.00 H new ATOM 773 N ASP A 50 16.390 -15.164 -4.546 1.00 0.00 N ATOM 774 CA ASP A 50 15.308 -14.649 -3.690 1.00 0.00 C ATOM 775 C ASP A 50 15.674 -14.829 -2.196 1.00 0.00 C ATOM 776 O ASP A 50 15.561 -15.919 -1.624 1.00 0.00 O ATOM 777 CB ASP A 50 13.945 -15.312 -4.055 1.00 0.00 C ATOM 778 CG ASP A 50 13.928 -16.850 -3.957 1.00 0.00 C ATOM 779 OD1 ASP A 50 14.595 -17.514 -4.782 1.00 0.00 O ATOM 780 OD2 ASP A 50 13.264 -17.396 -3.049 1.00 0.00 O ATOM 0 H ASP A 50 16.147 -16.018 -5.047 1.00 0.00 H new ATOM 0 HA ASP A 50 15.192 -13.580 -3.869 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.174 -14.911 -3.397 1.00 0.00 H new ATOM 0 HB3 ASP A 50 13.677 -15.024 -5.072 1.00 0.00 H new ATOM 785 N GLY A 51 16.193 -13.745 -1.592 1.00 0.00 N ATOM 786 CA GLY A 51 16.605 -13.754 -0.190 1.00 0.00 C ATOM 787 C GLY A 51 17.980 -14.376 0.030 1.00 0.00 C ATOM 788 O GLY A 51 18.316 -14.746 1.161 1.00 0.00 O ATOM 0 H GLY A 51 16.335 -12.851 -2.062 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.612 -12.731 0.186 1.00 0.00 H new ATOM 0 HA3 GLY A 51 15.867 -14.303 0.395 1.00 0.00 H new ATOM 792 N ARG A 52 18.781 -14.481 -1.053 1.00 0.00 N ATOM 793 CA ARG A 52 20.150 -15.037 -1.008 1.00 0.00 C ATOM 794 C ARG A 52 21.088 -14.232 -1.919 1.00 0.00 C ATOM 795 O ARG A 52 20.659 -13.689 -2.935 1.00 0.00 O ATOM 796 CB ARG A 52 20.179 -16.530 -1.436 1.00 0.00 C ATOM 797 CG ARG A 52 19.491 -17.524 -0.474 1.00 0.00 C ATOM 798 CD ARG A 52 19.602 -18.977 -0.971 1.00 0.00 C ATOM 799 NE ARG A 52 19.233 -19.961 0.070 1.00 0.00 N ATOM 800 CZ ARG A 52 19.860 -21.134 0.270 1.00 0.00 C ATOM 801 NH1 ARG A 52 20.848 -21.527 -0.530 1.00 0.00 N ATOM 802 NH2 ARG A 52 19.503 -21.911 1.275 1.00 0.00 N ATOM 0 H ARG A 52 18.495 -14.182 -1.985 1.00 0.00 H new ATOM 0 HA ARG A 52 20.491 -14.967 0.025 1.00 0.00 H new ATOM 0 HB2 ARG A 52 19.707 -16.616 -2.415 1.00 0.00 H new ATOM 0 HB3 ARG A 52 21.219 -16.833 -1.557 1.00 0.00 H new ATOM 0 HG2 ARG A 52 19.943 -17.443 0.515 1.00 0.00 H new ATOM 0 HG3 ARG A 52 18.440 -17.257 -0.367 1.00 0.00 H new ATOM 0 HD2 ARG A 52 18.956 -19.111 -1.839 1.00 0.00 H new ATOM 0 HD3 ARG A 52 20.623 -19.168 -1.301 1.00 0.00 H new ATOM 0 HE ARG A 52 18.447 -19.734 0.679 1.00 0.00 H new ATOM 0 HH11 ARG A 52 21.140 -20.936 -1.308 1.00 0.00 H new ATOM 0 HH12 ARG A 52 21.314 -22.419 -0.365 1.00 0.00 H new ATOM 0 HH21 ARG A 52 18.751 -21.622 1.901 1.00 0.00 H new ATOM 0 HH22 ARG A 52 19.979 -22.800 1.426 1.00 0.00 H new ATOM 816 N ILE A 53 22.381 -14.177 -1.538 1.00 0.00 N ATOM 817 CA ILE A 53 23.453 -13.516 -2.310 1.00 0.00 C ATOM 818 C ILE A 53 24.685 -14.447 -2.350 1.00 0.00 C ATOM 819 O ILE A 53 25.389 -14.577 -1.354 1.00 0.00 O ATOM 820 CB ILE A 53 23.866 -12.122 -1.669 1.00 0.00 C ATOM 821 CG1 ILE A 53 22.693 -11.085 -1.673 1.00 0.00 C ATOM 822 CG2 ILE A 53 25.109 -11.523 -2.363 1.00 0.00 C ATOM 823 CD1 ILE A 53 22.243 -10.623 -3.057 1.00 0.00 C ATOM 0 H ILE A 53 22.715 -14.598 -0.671 1.00 0.00 H new ATOM 0 HA ILE A 53 23.082 -13.323 -3.317 1.00 0.00 H new ATOM 0 HB ILE A 53 24.115 -12.332 -0.629 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.839 -11.524 -1.158 1.00 0.00 H new ATOM 0 HG13 ILE A 53 22.999 -10.212 -1.097 1.00 0.00 H new ATOM 0 HG21 ILE A 53 25.362 -10.570 -1.898 1.00 0.00 H new ATOM 0 HG22 ILE A 53 25.949 -12.210 -2.262 1.00 0.00 H new ATOM 0 HG23 ILE A 53 24.895 -11.365 -3.420 1.00 0.00 H new ATOM 0 HD11 ILE A 53 21.428 -9.907 -2.954 1.00 0.00 H new ATOM 0 HD12 ILE A 53 23.079 -10.150 -3.572 1.00 0.00 H new ATOM 0 HD13 ILE A 53 21.901 -11.482 -3.634 1.00 0.00 H new ATOM 835 N VAL A 54 24.929 -15.108 -3.490 1.00 0.00 N ATOM 836 CA VAL A 54 26.116 -15.968 -3.676 1.00 0.00 C ATOM 837 C VAL A 54 27.325 -15.094 -4.050 1.00 0.00 C ATOM 838 O VAL A 54 27.258 -14.339 -5.012 1.00 0.00 O ATOM 839 CB VAL A 54 25.871 -17.063 -4.781 1.00 0.00 C ATOM 840 CG1 VAL A 54 27.112 -17.974 -4.968 1.00 0.00 C ATOM 841 CG2 VAL A 54 24.607 -17.902 -4.460 1.00 0.00 C ATOM 0 H VAL A 54 24.318 -15.066 -4.305 1.00 0.00 H new ATOM 0 HA VAL A 54 26.314 -16.489 -2.739 1.00 0.00 H new ATOM 0 HB VAL A 54 25.703 -16.544 -5.725 1.00 0.00 H new ATOM 0 HG11 VAL A 54 26.905 -18.717 -5.738 1.00 0.00 H new ATOM 0 HG12 VAL A 54 27.966 -17.368 -5.269 1.00 0.00 H new ATOM 0 HG13 VAL A 54 27.338 -18.479 -4.029 1.00 0.00 H new ATOM 0 HG21 VAL A 54 24.460 -18.651 -5.238 1.00 0.00 H new ATOM 0 HG22 VAL A 54 24.734 -18.398 -3.498 1.00 0.00 H new ATOM 0 HG23 VAL A 54 23.737 -17.247 -4.418 1.00 0.00 H new ATOM 851 N ILE A 55 28.397 -15.172 -3.244 1.00 0.00 N ATOM 852 CA ILE A 55 29.687 -14.504 -3.514 1.00 0.00 C ATOM 853 C ILE A 55 30.766 -15.569 -3.806 1.00 0.00 C ATOM 854 O ILE A 55 30.664 -16.710 -3.340 1.00 0.00 O ATOM 855 CB ILE A 55 30.137 -13.575 -2.318 1.00 0.00 C ATOM 856 CG1 ILE A 55 30.322 -14.394 -1.001 1.00 0.00 C ATOM 857 CG2 ILE A 55 29.131 -12.412 -2.106 1.00 0.00 C ATOM 858 CD1 ILE A 55 30.851 -13.602 0.182 1.00 0.00 C ATOM 0 H ILE A 55 28.395 -15.707 -2.375 1.00 0.00 H new ATOM 0 HA ILE A 55 29.559 -13.861 -4.385 1.00 0.00 H new ATOM 0 HB ILE A 55 31.103 -13.144 -2.582 1.00 0.00 H new ATOM 0 HG12 ILE A 55 29.362 -14.831 -0.726 1.00 0.00 H new ATOM 0 HG13 ILE A 55 31.004 -15.221 -1.199 1.00 0.00 H new ATOM 0 HG21 ILE A 55 29.465 -11.788 -1.277 1.00 0.00 H new ATOM 0 HG22 ILE A 55 29.074 -11.810 -3.013 1.00 0.00 H new ATOM 0 HG23 ILE A 55 28.146 -12.820 -1.879 1.00 0.00 H new ATOM 0 HD11 ILE A 55 30.944 -14.259 1.047 1.00 0.00 H new ATOM 0 HD12 ILE A 55 31.828 -13.187 -0.066 1.00 0.00 H new ATOM 0 HD13 ILE A 55 30.161 -12.791 0.415 1.00 0.00 H new ATOM 870 N GLY A 56 31.803 -15.185 -4.570 1.00 0.00 N ATOM 871 CA GLY A 56 32.824 -16.128 -5.046 1.00 0.00 C ATOM 872 C GLY A 56 34.120 -16.013 -4.280 1.00 0.00 C ATOM 873 O GLY A 56 34.526 -16.958 -3.609 1.00 0.00 O ATOM 0 H GLY A 56 31.955 -14.222 -4.871 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.443 -17.146 -4.958 1.00 0.00 H new ATOM 0 HA3 GLY A 56 33.014 -15.949 -6.104 1.00 0.00 H new ATOM 877 N GLU A 57 34.777 -14.850 -4.395 1.00 0.00 N ATOM 878 CA GLU A 57 36.020 -14.551 -3.660 1.00 0.00 C ATOM 879 C GLU A 57 36.211 -13.033 -3.546 1.00 0.00 C ATOM 880 O GLU A 57 35.631 -12.255 -4.319 1.00 0.00 O ATOM 881 CB GLU A 57 37.260 -15.204 -4.333 1.00 0.00 C ATOM 882 CG GLU A 57 37.515 -14.747 -5.779 1.00 0.00 C ATOM 883 CD GLU A 57 38.738 -15.419 -6.420 1.00 0.00 C ATOM 884 OE1 GLU A 57 38.653 -16.620 -6.748 1.00 0.00 O ATOM 885 OE2 GLU A 57 39.789 -14.760 -6.592 1.00 0.00 O ATOM 0 H GLU A 57 34.464 -14.089 -4.999 1.00 0.00 H new ATOM 0 HA GLU A 57 35.928 -14.978 -2.661 1.00 0.00 H new ATOM 0 HB2 GLU A 57 38.143 -14.981 -3.734 1.00 0.00 H new ATOM 0 HB3 GLU A 57 37.134 -16.287 -4.324 1.00 0.00 H new ATOM 0 HG2 GLU A 57 36.633 -14.962 -6.382 1.00 0.00 H new ATOM 0 HG3 GLU A 57 37.654 -13.666 -5.792 1.00 0.00 H new ATOM 892 N PHE A 58 37.038 -12.639 -2.569 1.00 0.00 N ATOM 893 CA PHE A 58 37.333 -11.233 -2.241 1.00 0.00 C ATOM 894 C PHE A 58 38.563 -11.175 -1.316 1.00 0.00 C ATOM 895 O PHE A 58 39.061 -12.218 -0.865 1.00 0.00 O ATOM 896 CB PHE A 58 36.096 -10.555 -1.568 1.00 0.00 C ATOM 897 CG PHE A 58 35.676 -11.169 -0.224 1.00 0.00 C ATOM 898 CD1 PHE A 58 34.999 -12.387 -0.167 1.00 0.00 C ATOM 899 CD2 PHE A 58 35.971 -10.531 0.976 1.00 0.00 C ATOM 900 CE1 PHE A 58 34.644 -12.943 1.045 1.00 0.00 C ATOM 901 CE2 PHE A 58 35.611 -11.086 2.183 1.00 0.00 C ATOM 902 CZ PHE A 58 34.950 -12.289 2.218 1.00 0.00 C ATOM 0 H PHE A 58 37.532 -13.301 -1.970 1.00 0.00 H new ATOM 0 HA PHE A 58 37.552 -10.686 -3.158 1.00 0.00 H new ATOM 0 HB2 PHE A 58 36.317 -9.499 -1.415 1.00 0.00 H new ATOM 0 HB3 PHE A 58 35.252 -10.608 -2.255 1.00 0.00 H new ATOM 0 HD1 PHE A 58 34.749 -12.902 -1.083 1.00 0.00 H new ATOM 0 HD2 PHE A 58 36.491 -9.585 0.961 1.00 0.00 H new ATOM 0 HE1 PHE A 58 34.126 -13.890 1.074 1.00 0.00 H new ATOM 0 HE2 PHE A 58 35.849 -10.574 3.104 1.00 0.00 H new ATOM 0 HZ PHE A 58 34.670 -12.723 3.166 1.00 0.00 H new ATOM 912 N ASP A 59 39.046 -9.952 -1.043 1.00 0.00 N ATOM 913 CA ASP A 59 40.147 -9.714 -0.099 1.00 0.00 C ATOM 914 C ASP A 59 39.573 -9.756 1.321 1.00 0.00 C ATOM 915 O ASP A 59 38.955 -8.800 1.759 1.00 0.00 O ATOM 916 CB ASP A 59 40.843 -8.358 -0.387 1.00 0.00 C ATOM 917 CG ASP A 59 41.372 -8.236 -1.830 1.00 0.00 C ATOM 918 OD1 ASP A 59 42.219 -9.064 -2.232 1.00 0.00 O ATOM 919 OD2 ASP A 59 40.930 -7.324 -2.574 1.00 0.00 O ATOM 0 H ASP A 59 38.683 -9.101 -1.472 1.00 0.00 H new ATOM 0 HA ASP A 59 40.908 -10.486 -0.210 1.00 0.00 H new ATOM 0 HB2 ASP A 59 40.138 -7.549 -0.197 1.00 0.00 H new ATOM 0 HB3 ASP A 59 41.672 -8.229 0.308 1.00 0.00 H new ATOM 924 N GLU A 60 39.746 -10.904 1.992 1.00 0.00 N ATOM 925 CA GLU A 60 39.054 -11.243 3.255 1.00 0.00 C ATOM 926 C GLU A 60 39.501 -10.364 4.429 1.00 0.00 C ATOM 927 O GLU A 60 38.681 -9.680 5.051 1.00 0.00 O ATOM 928 CB GLU A 60 39.288 -12.741 3.578 1.00 0.00 C ATOM 929 CG GLU A 60 38.797 -13.710 2.479 1.00 0.00 C ATOM 930 CD GLU A 60 39.252 -15.159 2.716 1.00 0.00 C ATOM 931 OE1 GLU A 60 38.703 -15.825 3.623 1.00 0.00 O ATOM 932 OE2 GLU A 60 40.170 -15.636 2.008 1.00 0.00 O ATOM 0 H GLU A 60 40.379 -11.637 1.672 1.00 0.00 H new ATOM 0 HA GLU A 60 37.990 -11.051 3.114 1.00 0.00 H new ATOM 0 HB2 GLU A 60 40.353 -12.904 3.741 1.00 0.00 H new ATOM 0 HB3 GLU A 60 38.782 -12.983 4.513 1.00 0.00 H new ATOM 0 HG2 GLU A 60 37.708 -13.679 2.433 1.00 0.00 H new ATOM 0 HG3 GLU A 60 39.167 -13.372 1.511 1.00 0.00 H new ATOM 939 N GLU A 61 40.804 -10.377 4.711 1.00 0.00 N ATOM 940 CA GLU A 61 41.390 -9.643 5.846 1.00 0.00 C ATOM 941 C GLU A 61 41.295 -8.118 5.620 1.00 0.00 C ATOM 942 O GLU A 61 41.159 -7.343 6.580 1.00 0.00 O ATOM 943 CB GLU A 61 42.851 -10.106 6.035 1.00 0.00 C ATOM 944 CG GLU A 61 43.610 -9.475 7.217 1.00 0.00 C ATOM 945 CD GLU A 61 45.006 -10.084 7.424 1.00 0.00 C ATOM 946 OE1 GLU A 61 45.974 -9.631 6.772 1.00 0.00 O ATOM 947 OE2 GLU A 61 45.137 -11.032 8.225 1.00 0.00 O ATOM 0 H GLU A 61 41.489 -10.896 4.161 1.00 0.00 H new ATOM 0 HA GLU A 61 40.832 -9.860 6.757 1.00 0.00 H new ATOM 0 HB2 GLU A 61 42.855 -11.189 6.162 1.00 0.00 H new ATOM 0 HB3 GLU A 61 43.401 -9.891 5.119 1.00 0.00 H new ATOM 0 HG2 GLU A 61 43.708 -8.403 7.048 1.00 0.00 H new ATOM 0 HG3 GLU A 61 43.025 -9.602 8.128 1.00 0.00 H new ATOM 954 N GLU A 62 41.335 -7.709 4.333 1.00 0.00 N ATOM 955 CA GLU A 62 41.107 -6.312 3.936 1.00 0.00 C ATOM 956 C GLU A 62 39.629 -5.921 4.134 1.00 0.00 C ATOM 957 O GLU A 62 39.344 -4.829 4.610 1.00 0.00 O ATOM 958 CB GLU A 62 41.554 -6.047 2.483 1.00 0.00 C ATOM 959 CG GLU A 62 43.078 -6.179 2.254 1.00 0.00 C ATOM 960 CD GLU A 62 43.517 -5.715 0.851 1.00 0.00 C ATOM 961 OE1 GLU A 62 43.474 -4.493 0.592 1.00 0.00 O ATOM 962 OE2 GLU A 62 43.919 -6.554 0.017 1.00 0.00 O ATOM 0 H GLU A 62 41.525 -8.335 3.551 1.00 0.00 H new ATOM 0 HA GLU A 62 41.720 -5.686 4.584 1.00 0.00 H new ATOM 0 HB2 GLU A 62 41.037 -6.744 1.823 1.00 0.00 H new ATOM 0 HB3 GLU A 62 41.240 -5.043 2.196 1.00 0.00 H new ATOM 0 HG2 GLU A 62 43.605 -5.593 3.006 1.00 0.00 H new ATOM 0 HG3 GLU A 62 43.373 -7.219 2.396 1.00 0.00 H new ATOM 969 N ALA A 63 38.704 -6.840 3.813 1.00 0.00 N ATOM 970 CA ALA A 63 37.248 -6.616 3.986 1.00 0.00 C ATOM 971 C ALA A 63 36.881 -6.545 5.480 1.00 0.00 C ATOM 972 O ALA A 63 35.869 -5.947 5.850 1.00 0.00 O ATOM 973 CB ALA A 63 36.440 -7.718 3.290 1.00 0.00 C ATOM 0 H ALA A 63 38.936 -7.756 3.428 1.00 0.00 H new ATOM 0 HA ALA A 63 36.997 -5.662 3.523 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.375 -7.532 3.431 1.00 0.00 H new ATOM 0 HB2 ALA A 63 36.670 -7.720 2.225 1.00 0.00 H new ATOM 0 HB3 ALA A 63 36.699 -8.686 3.719 1.00 0.00 H new ATOM 979 N ARG A 64 37.710 -7.191 6.318 1.00 0.00 N ATOM 980 CA ARG A 64 37.553 -7.193 7.777 1.00 0.00 C ATOM 981 C ARG A 64 37.985 -5.825 8.353 1.00 0.00 C ATOM 982 O ARG A 64 37.276 -5.253 9.189 1.00 0.00 O ATOM 983 CB ARG A 64 38.367 -8.389 8.378 1.00 0.00 C ATOM 984 CG ARG A 64 37.999 -8.821 9.830 1.00 0.00 C ATOM 985 CD ARG A 64 38.523 -7.870 10.917 1.00 0.00 C ATOM 986 NE ARG A 64 38.159 -8.318 12.276 1.00 0.00 N ATOM 987 CZ ARG A 64 38.550 -7.728 13.412 1.00 0.00 C ATOM 988 NH1 ARG A 64 39.265 -6.612 13.394 1.00 0.00 N ATOM 989 NH2 ARG A 64 38.173 -8.228 14.573 1.00 0.00 N ATOM 0 H ARG A 64 38.514 -7.730 5.996 1.00 0.00 H new ATOM 0 HA ARG A 64 36.508 -7.335 8.052 1.00 0.00 H new ATOM 0 HB2 ARG A 64 38.240 -9.251 7.723 1.00 0.00 H new ATOM 0 HB3 ARG A 64 39.425 -8.126 8.358 1.00 0.00 H new ATOM 0 HG2 ARG A 64 36.914 -8.889 9.914 1.00 0.00 H new ATOM 0 HG3 ARG A 64 38.397 -9.819 10.013 1.00 0.00 H new ATOM 0 HD2 ARG A 64 39.608 -7.796 10.840 1.00 0.00 H new ATOM 0 HD3 ARG A 64 38.122 -6.871 10.747 1.00 0.00 H new ATOM 0 HE ARG A 64 37.563 -9.142 12.355 1.00 0.00 H new ATOM 0 HH11 ARG A 64 39.526 -6.188 12.504 1.00 0.00 H new ATOM 0 HH12 ARG A 64 39.554 -6.177 14.270 1.00 0.00 H new ATOM 0 HH21 ARG A 64 37.586 -9.061 14.603 1.00 0.00 H new ATOM 0 HH22 ARG A 64 38.469 -7.781 15.441 1.00 0.00 H new ATOM 1003 N GLU A 65 39.144 -5.308 7.892 1.00 0.00 N ATOM 1004 CA GLU A 65 39.706 -4.034 8.403 1.00 0.00 C ATOM 1005 C GLU A 65 38.904 -2.815 7.906 1.00 0.00 C ATOM 1006 O GLU A 65 38.761 -1.822 8.630 1.00 0.00 O ATOM 1007 CB GLU A 65 41.212 -3.877 8.061 1.00 0.00 C ATOM 1008 CG GLU A 65 41.545 -3.833 6.561 1.00 0.00 C ATOM 1009 CD GLU A 65 43.049 -3.739 6.260 1.00 0.00 C ATOM 1010 OE1 GLU A 65 43.585 -2.608 6.237 1.00 0.00 O ATOM 1011 OE2 GLU A 65 43.697 -4.790 6.065 1.00 0.00 O ATOM 0 H GLU A 65 39.710 -5.751 7.168 1.00 0.00 H new ATOM 0 HA GLU A 65 39.619 -4.074 9.489 1.00 0.00 H new ATOM 0 HB2 GLU A 65 41.579 -2.961 8.525 1.00 0.00 H new ATOM 0 HB3 GLU A 65 41.758 -4.705 8.513 1.00 0.00 H new ATOM 0 HG2 GLU A 65 41.144 -4.727 6.083 1.00 0.00 H new ATOM 0 HG3 GLU A 65 41.040 -2.978 6.112 1.00 0.00 H new ATOM 1018 N LEU A 66 38.409 -2.867 6.655 1.00 0.00 N ATOM 1019 CA LEU A 66 37.523 -1.814 6.123 1.00 0.00 C ATOM 1020 C LEU A 66 36.061 -2.066 6.556 1.00 0.00 C ATOM 1021 O LEU A 66 35.206 -1.183 6.434 1.00 0.00 O ATOM 1022 CB LEU A 66 37.732 -1.615 4.589 1.00 0.00 C ATOM 1023 CG LEU A 66 37.289 -2.760 3.614 1.00 0.00 C ATOM 1024 CD1 LEU A 66 35.786 -2.729 3.306 1.00 0.00 C ATOM 1025 CD2 LEU A 66 38.118 -2.738 2.307 1.00 0.00 C ATOM 0 H LEU A 66 38.606 -3.622 5.997 1.00 0.00 H new ATOM 0 HA LEU A 66 37.794 -0.854 6.561 1.00 0.00 H new ATOM 0 HB2 LEU A 66 37.201 -0.709 4.298 1.00 0.00 H new ATOM 0 HB3 LEU A 66 38.793 -1.430 4.421 1.00 0.00 H new ATOM 0 HG LEU A 66 37.487 -3.698 4.133 1.00 0.00 H new ATOM 0 HD11 LEU A 66 35.537 -3.544 2.627 1.00 0.00 H new ATOM 0 HD12 LEU A 66 35.222 -2.843 4.232 1.00 0.00 H new ATOM 0 HD13 LEU A 66 35.530 -1.777 2.840 1.00 0.00 H new ATOM 0 HD21 LEU A 66 37.787 -3.544 1.652 1.00 0.00 H new ATOM 0 HD22 LEU A 66 37.979 -1.781 1.804 1.00 0.00 H new ATOM 0 HD23 LEU A 66 39.173 -2.873 2.543 1.00 0.00 H new ATOM 1037 N GLY A 67 35.800 -3.285 7.062 1.00 0.00 N ATOM 1038 CA GLY A 67 34.544 -3.601 7.738 1.00 0.00 C ATOM 1039 C GLY A 67 34.438 -2.901 9.091 1.00 0.00 C ATOM 1040 O GLY A 67 33.414 -2.289 9.403 1.00 0.00 O ATOM 0 H GLY A 67 36.452 -4.068 7.011 1.00 0.00 H new ATOM 0 HA2 GLY A 67 33.706 -3.303 7.107 1.00 0.00 H new ATOM 0 HA3 GLY A 67 34.468 -4.679 7.879 1.00 0.00 H new ATOM 1044 N ARG A 68 35.531 -2.966 9.888 1.00 0.00 N ATOM 1045 CA ARG A 68 35.614 -2.262 11.185 1.00 0.00 C ATOM 1046 C ARG A 68 35.760 -0.737 10.945 1.00 0.00 C ATOM 1047 O ARG A 68 35.413 0.068 11.813 1.00 0.00 O ATOM 1048 CB ARG A 68 36.775 -2.806 12.071 1.00 0.00 C ATOM 1049 CG ARG A 68 38.187 -2.366 11.625 1.00 0.00 C ATOM 1050 CD ARG A 68 39.314 -2.806 12.574 1.00 0.00 C ATOM 1051 NE ARG A 68 40.587 -2.168 12.195 1.00 0.00 N ATOM 1052 CZ ARG A 68 41.763 -2.327 12.810 1.00 0.00 C ATOM 1053 NH1 ARG A 68 41.895 -3.138 13.853 1.00 0.00 N ATOM 1054 NH2 ARG A 68 42.805 -1.637 12.389 1.00 0.00 N ATOM 0 H ARG A 68 36.367 -3.500 9.653 1.00 0.00 H new ATOM 0 HA ARG A 68 34.690 -2.449 11.732 1.00 0.00 H new ATOM 0 HB2 ARG A 68 36.614 -2.478 13.098 1.00 0.00 H new ATOM 0 HB3 ARG A 68 36.732 -3.895 12.074 1.00 0.00 H new ATOM 0 HG2 ARG A 68 38.385 -2.771 10.632 1.00 0.00 H new ATOM 0 HG3 ARG A 68 38.206 -1.280 11.536 1.00 0.00 H new ATOM 0 HD2 ARG A 68 39.058 -2.540 13.600 1.00 0.00 H new ATOM 0 HD3 ARG A 68 39.421 -3.890 12.543 1.00 0.00 H new ATOM 0 HE ARG A 68 40.569 -1.546 11.387 1.00 0.00 H new ATOM 0 HH11 ARG A 68 41.088 -3.656 14.201 1.00 0.00 H new ATOM 0 HH12 ARG A 68 42.803 -3.243 14.306 1.00 0.00 H new ATOM 0 HH21 ARG A 68 42.707 -0.993 11.604 1.00 0.00 H new ATOM 0 HH22 ARG A 68 43.709 -1.747 12.848 1.00 0.00 H new ATOM 1068 N LYS A 69 36.277 -0.355 9.751 1.00 0.00 N ATOM 1069 CA LYS A 69 36.291 1.046 9.291 1.00 0.00 C ATOM 1070 C LYS A 69 34.843 1.562 9.149 1.00 0.00 C ATOM 1071 O LYS A 69 34.547 2.691 9.521 1.00 0.00 O ATOM 1072 CB LYS A 69 37.061 1.174 7.956 1.00 0.00 C ATOM 1073 CG LYS A 69 36.985 2.551 7.269 1.00 0.00 C ATOM 1074 CD LYS A 69 37.609 2.554 5.846 1.00 0.00 C ATOM 1075 CE LYS A 69 39.140 2.418 5.848 1.00 0.00 C ATOM 1076 NZ LYS A 69 39.790 3.600 6.473 1.00 0.00 N ATOM 0 H LYS A 69 36.692 -1.009 9.087 1.00 0.00 H new ATOM 0 HA LYS A 69 36.808 1.658 10.030 1.00 0.00 H new ATOM 0 HB2 LYS A 69 38.109 0.937 8.138 1.00 0.00 H new ATOM 0 HB3 LYS A 69 36.680 0.422 7.265 1.00 0.00 H new ATOM 0 HG2 LYS A 69 35.942 2.861 7.203 1.00 0.00 H new ATOM 0 HG3 LYS A 69 37.498 3.288 7.887 1.00 0.00 H new ATOM 0 HD2 LYS A 69 37.180 1.735 5.268 1.00 0.00 H new ATOM 0 HD3 LYS A 69 37.335 3.480 5.340 1.00 0.00 H new ATOM 0 HE2 LYS A 69 39.426 1.516 6.389 1.00 0.00 H new ATOM 0 HE3 LYS A 69 39.498 2.303 4.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 40.603 3.895 5.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 39.106 4.381 6.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 40.116 3.352 7.429 1.00 0.00 H new ATOM 1090 N TRP A 70 33.936 0.703 8.650 1.00 0.00 N ATOM 1091 CA TRP A 70 32.498 1.014 8.610 1.00 0.00 C ATOM 1092 C TRP A 70 31.956 1.240 10.048 1.00 0.00 C ATOM 1093 O TRP A 70 31.134 2.134 10.270 1.00 0.00 O ATOM 1094 CB TRP A 70 31.716 -0.104 7.880 1.00 0.00 C ATOM 1095 CG TRP A 70 30.217 0.085 7.891 1.00 0.00 C ATOM 1096 CD1 TRP A 70 29.490 0.954 7.134 1.00 0.00 C ATOM 1097 CD2 TRP A 70 29.270 -0.608 8.718 1.00 0.00 C ATOM 1098 NE1 TRP A 70 28.164 0.836 7.435 1.00 0.00 N ATOM 1099 CE2 TRP A 70 28.005 -0.110 8.402 1.00 0.00 C ATOM 1100 CE3 TRP A 70 29.381 -1.602 9.692 1.00 0.00 C ATOM 1101 CZ2 TRP A 70 26.854 -0.565 9.023 1.00 0.00 C ATOM 1102 CZ3 TRP A 70 28.237 -2.058 10.310 1.00 0.00 C ATOM 1103 CH2 TRP A 70 26.984 -1.536 9.969 1.00 0.00 C ATOM 0 H TRP A 70 34.175 -0.212 8.269 1.00 0.00 H new ATOM 0 HA TRP A 70 32.354 1.936 8.047 1.00 0.00 H new ATOM 0 HB2 TRP A 70 32.057 -0.156 6.846 1.00 0.00 H new ATOM 0 HB3 TRP A 70 31.954 -1.061 8.343 1.00 0.00 H new ATOM 0 HD1 TRP A 70 29.902 1.635 6.404 1.00 0.00 H new ATOM 0 HE1 TRP A 70 27.411 1.372 7.004 1.00 0.00 H new ATOM 0 HE3 TRP A 70 30.347 -2.007 9.957 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 25.885 -0.163 8.766 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 28.308 -2.826 11.066 1.00 0.00 H new ATOM 0 HH2 TRP A 70 26.102 -1.911 10.466 1.00 0.00 H new ATOM 1114 N LEU A 71 32.451 0.433 11.026 1.00 0.00 N ATOM 1115 CA LEU A 71 32.071 0.580 12.456 1.00 0.00 C ATOM 1116 C LEU A 71 32.457 1.969 13.032 1.00 0.00 C ATOM 1117 O LEU A 71 31.691 2.546 13.815 1.00 0.00 O ATOM 1118 CB LEU A 71 32.657 -0.559 13.368 1.00 0.00 C ATOM 1119 CG LEU A 71 31.876 -1.915 13.423 1.00 0.00 C ATOM 1120 CD1 LEU A 71 31.845 -2.633 12.064 1.00 0.00 C ATOM 1121 CD2 LEU A 71 32.458 -2.845 14.517 1.00 0.00 C ATOM 0 H LEU A 71 33.112 -0.323 10.849 1.00 0.00 H new ATOM 0 HA LEU A 71 30.985 0.491 12.469 1.00 0.00 H new ATOM 0 HB2 LEU A 71 33.673 -0.769 13.033 1.00 0.00 H new ATOM 0 HB3 LEU A 71 32.731 -0.172 14.384 1.00 0.00 H new ATOM 0 HG LEU A 71 30.845 -1.672 13.680 1.00 0.00 H new ATOM 0 HD11 LEU A 71 31.291 -3.567 12.159 1.00 0.00 H new ATOM 0 HD12 LEU A 71 31.357 -1.995 11.327 1.00 0.00 H new ATOM 0 HD13 LEU A 71 32.864 -2.846 11.742 1.00 0.00 H new ATOM 0 HD21 LEU A 71 31.898 -3.780 14.535 1.00 0.00 H new ATOM 0 HD22 LEU A 71 33.505 -3.053 14.298 1.00 0.00 H new ATOM 0 HD23 LEU A 71 32.380 -2.357 15.489 1.00 0.00 H new ATOM 1133 N GLU A 72 33.631 2.506 12.671 1.00 0.00 N ATOM 1134 CA GLU A 72 34.066 3.829 13.187 1.00 0.00 C ATOM 1135 C GLU A 72 33.359 4.984 12.434 1.00 0.00 C ATOM 1136 O GLU A 72 33.118 6.047 13.019 1.00 0.00 O ATOM 1137 CB GLU A 72 35.616 3.969 13.137 1.00 0.00 C ATOM 1138 CG GLU A 72 36.228 3.939 11.728 1.00 0.00 C ATOM 1139 CD GLU A 72 37.765 3.952 11.696 1.00 0.00 C ATOM 1140 OE1 GLU A 72 38.380 2.877 11.869 1.00 0.00 O ATOM 1141 OE2 GLU A 72 38.360 5.035 11.490 1.00 0.00 O ATOM 0 H GLU A 72 34.292 2.060 12.035 1.00 0.00 H new ATOM 0 HA GLU A 72 33.768 3.896 14.233 1.00 0.00 H new ATOM 0 HB2 GLU A 72 35.896 4.906 13.618 1.00 0.00 H new ATOM 0 HB3 GLU A 72 36.057 3.164 13.725 1.00 0.00 H new ATOM 0 HG2 GLU A 72 35.875 3.046 11.212 1.00 0.00 H new ATOM 0 HG3 GLU A 72 35.859 4.798 11.168 1.00 0.00 H new ATOM 1148 N GLU A 73 32.995 4.754 11.149 1.00 0.00 N ATOM 1149 CA GLU A 73 32.331 5.781 10.302 1.00 0.00 C ATOM 1150 C GLU A 73 30.839 5.939 10.622 1.00 0.00 C ATOM 1151 O GLU A 73 30.294 7.041 10.497 1.00 0.00 O ATOM 1152 CB GLU A 73 32.546 5.486 8.806 1.00 0.00 C ATOM 1153 CG GLU A 73 34.029 5.543 8.390 1.00 0.00 C ATOM 1154 CD GLU A 73 34.303 5.536 6.883 1.00 0.00 C ATOM 1155 OE1 GLU A 73 33.375 5.756 6.078 1.00 0.00 O ATOM 1156 OE2 GLU A 73 35.471 5.354 6.491 1.00 0.00 O ATOM 0 H GLU A 73 33.150 3.865 10.674 1.00 0.00 H new ATOM 0 HA GLU A 73 32.804 6.734 10.539 1.00 0.00 H new ATOM 0 HB2 GLU A 73 32.147 4.498 8.575 1.00 0.00 H new ATOM 0 HB3 GLU A 73 31.980 6.205 8.214 1.00 0.00 H new ATOM 0 HG2 GLU A 73 34.471 6.444 8.816 1.00 0.00 H new ATOM 0 HG3 GLU A 73 34.544 4.693 8.837 1.00 0.00 H new ATOM 1163 N LYS A 74 30.178 4.848 11.054 1.00 0.00 N ATOM 1164 CA LYS A 74 28.790 4.929 11.574 1.00 0.00 C ATOM 1165 C LYS A 74 28.783 5.589 12.977 1.00 0.00 C ATOM 1166 O LYS A 74 27.713 5.818 13.553 1.00 0.00 O ATOM 1167 CB LYS A 74 28.078 3.521 11.556 1.00 0.00 C ATOM 1168 CG LYS A 74 28.666 2.404 12.470 1.00 0.00 C ATOM 1169 CD LYS A 74 28.285 2.539 13.973 1.00 0.00 C ATOM 1170 CE LYS A 74 28.850 1.413 14.845 1.00 0.00 C ATOM 1171 NZ LYS A 74 28.206 0.117 14.561 1.00 0.00 N ATOM 0 H LYS A 74 30.573 3.908 11.056 1.00 0.00 H new ATOM 0 HA LYS A 74 28.205 5.566 10.911 1.00 0.00 H new ATOM 0 HB2 LYS A 74 27.035 3.668 11.835 1.00 0.00 H new ATOM 0 HB3 LYS A 74 28.085 3.154 10.530 1.00 0.00 H new ATOM 0 HG2 LYS A 74 28.323 1.435 12.106 1.00 0.00 H new ATOM 0 HG3 LYS A 74 29.752 2.412 12.381 1.00 0.00 H new ATOM 0 HD2 LYS A 74 28.647 3.496 14.348 1.00 0.00 H new ATOM 0 HD3 LYS A 74 27.199 2.551 14.066 1.00 0.00 H new ATOM 0 HE2 LYS A 74 29.924 1.329 14.677 1.00 0.00 H new ATOM 0 HE3 LYS A 74 28.711 1.664 15.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 28.594 -0.610 15.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 27.180 0.198 14.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 28.389 -0.153 13.573 1.00 0.00 H new ATOM 1185 N SER A 75 30.014 5.824 13.512 1.00 0.00 N ATOM 1186 CA SER A 75 30.288 6.464 14.799 1.00 0.00 C ATOM 1187 C SER A 75 29.948 5.501 15.949 1.00 0.00 C ATOM 1188 O SER A 75 28.833 5.513 16.491 1.00 0.00 O ATOM 1189 CB SER A 75 29.587 7.844 14.938 1.00 0.00 C ATOM 1190 OG SER A 75 30.053 8.560 16.071 1.00 0.00 O ATOM 0 H SER A 75 30.869 5.555 13.025 1.00 0.00 H new ATOM 0 HA SER A 75 31.355 6.682 14.852 1.00 0.00 H new ATOM 0 HB2 SER A 75 29.763 8.433 14.038 1.00 0.00 H new ATOM 0 HB3 SER A 75 28.510 7.698 15.018 1.00 0.00 H new ATOM 0 HG SER A 75 29.591 9.423 16.125 1.00 0.00 H new ATOM 1196 N LYS A 76 30.902 4.599 16.238 1.00 0.00 N ATOM 1197 CA LYS A 76 30.845 3.712 17.413 1.00 0.00 C ATOM 1198 C LYS A 76 31.381 4.483 18.648 1.00 0.00 C ATOM 1199 O LYS A 76 32.123 5.471 18.482 1.00 0.00 O ATOM 1200 CB LYS A 76 31.698 2.420 17.174 1.00 0.00 C ATOM 1201 CG LYS A 76 33.230 2.649 17.153 1.00 0.00 C ATOM 1202 CD LYS A 76 34.047 1.346 17.009 1.00 0.00 C ATOM 1203 CE LYS A 76 35.552 1.576 17.252 1.00 0.00 C ATOM 1204 NZ LYS A 76 36.133 2.591 16.326 1.00 0.00 N ATOM 0 H LYS A 76 31.734 4.464 15.664 1.00 0.00 H new ATOM 0 HA LYS A 76 29.813 3.407 17.584 1.00 0.00 H new ATOM 0 HB2 LYS A 76 31.463 1.697 17.955 1.00 0.00 H new ATOM 0 HB3 LYS A 76 31.398 1.974 16.226 1.00 0.00 H new ATOM 0 HG2 LYS A 76 33.478 3.317 16.328 1.00 0.00 H new ATOM 0 HG3 LYS A 76 33.526 3.154 18.072 1.00 0.00 H new ATOM 0 HD2 LYS A 76 33.675 0.605 17.717 1.00 0.00 H new ATOM 0 HD3 LYS A 76 33.900 0.935 16.010 1.00 0.00 H new ATOM 0 HE2 LYS A 76 35.705 1.899 18.282 1.00 0.00 H new ATOM 0 HE3 LYS A 76 36.084 0.632 17.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 36.935 2.173 15.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 35.407 2.897 15.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 36.462 3.412 16.873 1.00 0.00 H new ATOM 1218 N PRO A 77 31.030 4.064 19.905 1.00 0.00 N ATOM 1219 CA PRO A 77 31.693 4.587 21.126 1.00 0.00 C ATOM 1220 C PRO A 77 33.187 4.185 21.172 1.00 0.00 C ATOM 1221 O PRO A 77 33.560 3.102 20.697 1.00 0.00 O ATOM 1222 CB PRO A 77 30.881 3.939 22.284 1.00 0.00 C ATOM 1223 CG PRO A 77 30.259 2.720 21.673 1.00 0.00 C ATOM 1224 CD PRO A 77 29.948 3.101 20.245 1.00 0.00 C ATOM 0 HA PRO A 77 31.697 5.676 21.177 1.00 0.00 H new ATOM 0 HB2 PRO A 77 31.526 3.677 23.122 1.00 0.00 H new ATOM 0 HB3 PRO A 77 30.122 4.622 22.667 1.00 0.00 H new ATOM 0 HG2 PRO A 77 30.940 1.870 21.713 1.00 0.00 H new ATOM 0 HG3 PRO A 77 29.355 2.430 22.208 1.00 0.00 H new ATOM 0 HD2 PRO A 77 29.960 2.233 19.585 1.00 0.00 H new ATOM 0 HD3 PRO A 77 28.962 3.556 20.156 1.00 0.00 H new ATOM 1232 N VAL A 78 34.035 5.068 21.730 1.00 0.00 N ATOM 1233 CA VAL A 78 35.492 4.817 21.845 1.00 0.00 C ATOM 1234 C VAL A 78 35.784 3.738 22.909 1.00 0.00 C ATOM 1235 O VAL A 78 36.866 3.147 22.905 1.00 0.00 O ATOM 1236 CB VAL A 78 36.298 6.138 22.159 1.00 0.00 C ATOM 1237 CG1 VAL A 78 36.094 7.206 21.054 1.00 0.00 C ATOM 1238 CG2 VAL A 78 35.945 6.708 23.555 1.00 0.00 C ATOM 0 H VAL A 78 33.739 5.967 22.111 1.00 0.00 H new ATOM 0 HA VAL A 78 35.830 4.450 20.876 1.00 0.00 H new ATOM 0 HB VAL A 78 37.355 5.870 22.171 1.00 0.00 H new ATOM 0 HG11 VAL A 78 36.663 8.101 21.304 1.00 0.00 H new ATOM 0 HG12 VAL A 78 36.439 6.811 20.098 1.00 0.00 H new ATOM 0 HG13 VAL A 78 35.036 7.457 20.982 1.00 0.00 H new ATOM 0 HG21 VAL A 78 36.520 7.616 23.733 1.00 0.00 H new ATOM 0 HG22 VAL A 78 34.880 6.939 23.595 1.00 0.00 H new ATOM 0 HG23 VAL A 78 36.185 5.970 24.321 1.00 0.00 H new ATOM 1248 N THR A 79 34.790 3.528 23.815 1.00 0.00 N ATOM 1249 CA THR A 79 34.754 2.476 24.866 1.00 0.00 C ATOM 1250 C THR A 79 36.037 2.403 25.732 1.00 0.00 C ATOM 1251 O THR A 79 36.294 1.391 26.398 1.00 0.00 O ATOM 1252 CB THR A 79 34.349 1.059 24.275 1.00 0.00 C ATOM 1253 OG1 THR A 79 33.996 0.162 25.343 1.00 0.00 O ATOM 1254 CG2 THR A 79 35.446 0.386 23.423 1.00 0.00 C ATOM 0 H THR A 79 33.955 4.114 23.832 1.00 0.00 H new ATOM 0 HA THR A 79 33.965 2.783 25.553 1.00 0.00 H new ATOM 0 HB THR A 79 33.504 1.255 23.615 1.00 0.00 H new ATOM 0 HG1 THR A 79 34.684 0.196 26.040 1.00 0.00 H new ATOM 0 HG21 THR A 79 35.085 -0.576 23.060 1.00 0.00 H new ATOM 0 HG22 THR A 79 35.691 1.025 22.575 1.00 0.00 H new ATOM 0 HG23 THR A 79 36.337 0.233 24.032 1.00 0.00 H new ATOM 1262 N LEU A 80 36.779 3.523 25.793 1.00 0.00 N ATOM 1263 CA LEU A 80 38.104 3.569 26.426 1.00 0.00 C ATOM 1264 C LEU A 80 38.465 5.048 26.688 1.00 0.00 C ATOM 1265 O LEU A 80 38.451 5.865 25.764 1.00 0.00 O ATOM 1266 CB LEU A 80 39.156 2.838 25.512 1.00 0.00 C ATOM 1267 CG LEU A 80 40.245 1.975 26.235 1.00 0.00 C ATOM 1268 CD1 LEU A 80 41.046 1.112 25.226 1.00 0.00 C ATOM 1269 CD2 LEU A 80 41.195 2.847 27.081 1.00 0.00 C ATOM 0 H LEU A 80 36.476 4.417 25.406 1.00 0.00 H new ATOM 0 HA LEU A 80 38.104 3.045 27.382 1.00 0.00 H new ATOM 0 HB2 LEU A 80 38.614 2.192 24.822 1.00 0.00 H new ATOM 0 HB3 LEU A 80 39.665 3.592 24.911 1.00 0.00 H new ATOM 0 HG LEU A 80 39.719 1.302 26.913 1.00 0.00 H new ATOM 0 HD11 LEU A 80 41.793 0.526 25.761 1.00 0.00 H new ATOM 0 HD12 LEU A 80 40.366 0.441 24.701 1.00 0.00 H new ATOM 0 HD13 LEU A 80 41.543 1.762 24.505 1.00 0.00 H new ATOM 0 HD21 LEU A 80 41.936 2.212 27.567 1.00 0.00 H new ATOM 0 HD22 LEU A 80 41.700 3.566 26.436 1.00 0.00 H new ATOM 0 HD23 LEU A 80 40.621 3.380 27.839 1.00 0.00 H new ATOM 1281 N GLU A 81 38.780 5.374 27.953 1.00 0.00 N ATOM 1282 CA GLU A 81 39.049 6.757 28.402 1.00 0.00 C ATOM 1283 C GLU A 81 40.399 7.279 27.868 1.00 0.00 C ATOM 1284 O GLU A 81 40.574 8.482 27.697 1.00 0.00 O ATOM 1285 CB GLU A 81 39.013 6.815 29.954 1.00 0.00 C ATOM 1286 CG GLU A 81 39.270 8.205 30.579 1.00 0.00 C ATOM 1287 CD GLU A 81 39.372 8.153 32.111 1.00 0.00 C ATOM 1288 OE1 GLU A 81 40.481 7.922 32.638 1.00 0.00 O ATOM 1289 OE2 GLU A 81 38.342 8.315 32.794 1.00 0.00 O ATOM 0 H GLU A 81 38.856 4.683 28.700 1.00 0.00 H new ATOM 0 HA GLU A 81 38.272 7.406 27.997 1.00 0.00 H new ATOM 0 HB2 GLU A 81 38.039 6.461 30.290 1.00 0.00 H new ATOM 0 HB3 GLU A 81 39.757 6.119 30.343 1.00 0.00 H new ATOM 0 HG2 GLU A 81 40.192 8.618 30.171 1.00 0.00 H new ATOM 0 HG3 GLU A 81 38.464 8.882 30.295 1.00 0.00 H new ATOM 1296 N GLU A 82 41.354 6.369 27.619 1.00 0.00 N ATOM 1297 CA GLU A 82 42.644 6.725 26.988 1.00 0.00 C ATOM 1298 C GLU A 82 42.438 7.038 25.483 1.00 0.00 C ATOM 1299 O GLU A 82 43.154 7.860 24.897 1.00 0.00 O ATOM 1300 CB GLU A 82 43.677 5.586 27.198 1.00 0.00 C ATOM 1301 CG GLU A 82 45.106 5.896 26.701 1.00 0.00 C ATOM 1302 CD GLU A 82 46.089 4.733 26.922 1.00 0.00 C ATOM 1303 OE1 GLU A 82 46.687 4.639 28.018 1.00 0.00 O ATOM 1304 OE2 GLU A 82 46.250 3.894 26.009 1.00 0.00 O ATOM 0 H GLU A 82 41.261 5.378 27.844 1.00 0.00 H new ATOM 0 HA GLU A 82 43.038 7.623 27.463 1.00 0.00 H new ATOM 0 HB2 GLU A 82 43.722 5.350 28.261 1.00 0.00 H new ATOM 0 HB3 GLU A 82 43.318 4.692 26.688 1.00 0.00 H new ATOM 0 HG2 GLU A 82 45.070 6.136 25.638 1.00 0.00 H new ATOM 0 HG3 GLU A 82 45.479 6.781 27.216 1.00 0.00 H new ATOM 1311 N LEU A 83 41.406 6.407 24.886 1.00 0.00 N ATOM 1312 CA LEU A 83 41.023 6.616 23.470 1.00 0.00 C ATOM 1313 C LEU A 83 40.225 7.949 23.314 1.00 0.00 C ATOM 1314 O LEU A 83 39.921 8.361 22.198 1.00 0.00 O ATOM 1315 CB LEU A 83 40.198 5.374 22.967 1.00 0.00 C ATOM 1316 CG LEU A 83 40.461 4.854 21.504 1.00 0.00 C ATOM 1317 CD1 LEU A 83 39.803 3.472 21.279 1.00 0.00 C ATOM 1318 CD2 LEU A 83 39.994 5.853 20.419 1.00 0.00 C ATOM 0 H LEU A 83 40.812 5.736 25.372 1.00 0.00 H new ATOM 0 HA LEU A 83 41.917 6.704 22.853 1.00 0.00 H new ATOM 0 HB2 LEU A 83 40.386 4.548 23.653 1.00 0.00 H new ATOM 0 HB3 LEU A 83 39.140 5.621 23.048 1.00 0.00 H new ATOM 0 HG LEU A 83 41.542 4.754 21.405 1.00 0.00 H new ATOM 0 HD11 LEU A 83 40.000 3.137 20.261 1.00 0.00 H new ATOM 0 HD12 LEU A 83 40.218 2.752 21.985 1.00 0.00 H new ATOM 0 HD13 LEU A 83 38.727 3.552 21.433 1.00 0.00 H new ATOM 0 HD21 LEU A 83 40.201 5.441 19.431 1.00 0.00 H new ATOM 0 HD22 LEU A 83 38.923 6.028 20.522 1.00 0.00 H new ATOM 0 HD23 LEU A 83 40.529 6.795 20.538 1.00 0.00 H new ATOM 1330 N LYS A 84 39.908 8.615 24.450 1.00 0.00 N ATOM 1331 CA LYS A 84 39.215 9.925 24.465 1.00 0.00 C ATOM 1332 C LYS A 84 40.044 10.998 23.728 1.00 0.00 C ATOM 1333 O LYS A 84 39.512 11.773 22.931 1.00 0.00 O ATOM 1334 CB LYS A 84 38.960 10.369 25.932 1.00 0.00 C ATOM 1335 CG LYS A 84 38.267 11.740 26.112 1.00 0.00 C ATOM 1336 CD LYS A 84 38.194 12.191 27.596 1.00 0.00 C ATOM 1337 CE LYS A 84 37.376 11.235 28.485 1.00 0.00 C ATOM 1338 NZ LYS A 84 35.949 11.164 28.068 1.00 0.00 N ATOM 0 H LYS A 84 40.125 8.259 25.381 1.00 0.00 H new ATOM 0 HA LYS A 84 38.262 9.815 23.948 1.00 0.00 H new ATOM 0 HB2 LYS A 84 38.351 9.609 26.421 1.00 0.00 H new ATOM 0 HB3 LYS A 84 39.916 10.396 26.455 1.00 0.00 H new ATOM 0 HG2 LYS A 84 38.806 12.492 25.535 1.00 0.00 H new ATOM 0 HG3 LYS A 84 37.258 11.688 25.704 1.00 0.00 H new ATOM 0 HD2 LYS A 84 39.205 12.270 27.994 1.00 0.00 H new ATOM 0 HD3 LYS A 84 37.754 13.187 27.644 1.00 0.00 H new ATOM 0 HE2 LYS A 84 37.815 10.238 28.444 1.00 0.00 H new ATOM 0 HE3 LYS A 84 37.434 11.566 29.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 35.426 10.550 28.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 35.535 12.118 28.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 35.888 10.775 27.106 1.00 0.00 H new ATOM 1352 N SER A 85 41.362 11.017 23.991 1.00 0.00 N ATOM 1353 CA SER A 85 42.296 11.982 23.373 1.00 0.00 C ATOM 1354 C SER A 85 42.922 11.414 22.078 1.00 0.00 C ATOM 1355 O SER A 85 43.902 11.966 21.566 1.00 0.00 O ATOM 1356 CB SER A 85 43.398 12.343 24.390 1.00 0.00 C ATOM 1357 OG SER A 85 44.166 11.201 24.738 1.00 0.00 O ATOM 0 H SER A 85 41.812 10.367 24.636 1.00 0.00 H new ATOM 0 HA SER A 85 41.740 12.879 23.099 1.00 0.00 H new ATOM 0 HB2 SER A 85 44.049 13.109 23.969 1.00 0.00 H new ATOM 0 HB3 SER A 85 42.945 12.768 25.286 1.00 0.00 H new ATOM 0 HG SER A 85 44.859 11.457 25.382 1.00 0.00 H new ATOM 1363 N TYR A 86 42.341 10.324 21.548 1.00 0.00 N ATOM 1364 CA TYR A 86 42.867 9.606 20.372 1.00 0.00 C ATOM 1365 C TYR A 86 41.762 9.431 19.310 1.00 0.00 C ATOM 1366 O TYR A 86 40.573 9.361 19.645 1.00 0.00 O ATOM 1367 CB TYR A 86 43.421 8.225 20.827 1.00 0.00 C ATOM 1368 CG TYR A 86 44.135 7.423 19.719 1.00 0.00 C ATOM 1369 CD1 TYR A 86 45.449 7.721 19.361 1.00 0.00 C ATOM 1370 CD2 TYR A 86 43.491 6.390 19.026 1.00 0.00 C ATOM 1371 CE1 TYR A 86 46.092 7.021 18.361 1.00 0.00 C ATOM 1372 CE2 TYR A 86 44.135 5.688 18.028 1.00 0.00 C ATOM 1373 CZ TYR A 86 45.434 6.011 17.699 1.00 0.00 C ATOM 1374 OH TYR A 86 46.081 5.318 16.704 1.00 0.00 O ATOM 0 H TYR A 86 41.487 9.913 21.926 1.00 0.00 H new ATOM 0 HA TYR A 86 43.673 10.184 19.921 1.00 0.00 H new ATOM 0 HB2 TYR A 86 44.118 8.381 21.651 1.00 0.00 H new ATOM 0 HB3 TYR A 86 42.596 7.628 21.216 1.00 0.00 H new ATOM 0 HD1 TYR A 86 45.973 8.513 19.875 1.00 0.00 H new ATOM 0 HD2 TYR A 86 42.471 6.138 19.278 1.00 0.00 H new ATOM 0 HE1 TYR A 86 47.111 7.266 18.098 1.00 0.00 H new ATOM 0 HE2 TYR A 86 43.625 4.891 17.508 1.00 0.00 H new ATOM 0 HH TYR A 86 45.480 4.637 16.336 1.00 0.00 H new ATOM 1384 N GLY A 87 42.177 9.358 18.034 1.00 0.00 N ATOM 1385 CA GLY A 87 41.259 9.120 16.922 1.00 0.00 C ATOM 1386 C GLY A 87 41.853 9.576 15.607 1.00 0.00 C ATOM 1387 O GLY A 87 41.664 10.725 15.208 1.00 0.00 O ATOM 0 H GLY A 87 43.152 9.462 17.752 1.00 0.00 H new ATOM 0 HA2 GLY A 87 41.021 8.058 16.866 1.00 0.00 H new ATOM 0 HA3 GLY A 87 40.322 9.648 17.102 1.00 0.00 H new ATOM 1391 N PHE A 88 42.604 8.686 14.946 1.00 0.00 N ATOM 1392 CA PHE A 88 43.260 8.982 13.658 1.00 0.00 C ATOM 1393 C PHE A 88 42.890 7.920 12.610 1.00 0.00 C ATOM 1394 O PHE A 88 42.369 6.845 12.945 1.00 0.00 O ATOM 1395 CB PHE A 88 44.801 9.042 13.827 1.00 0.00 C ATOM 1396 CG PHE A 88 45.290 10.131 14.783 1.00 0.00 C ATOM 1397 CD1 PHE A 88 45.528 11.430 14.332 1.00 0.00 C ATOM 1398 CD2 PHE A 88 45.520 9.854 16.130 1.00 0.00 C ATOM 1399 CE1 PHE A 88 45.971 12.413 15.199 1.00 0.00 C ATOM 1400 CE2 PHE A 88 45.961 10.837 16.993 1.00 0.00 C ATOM 1401 CZ PHE A 88 46.193 12.115 16.527 1.00 0.00 C ATOM 0 H PHE A 88 42.776 7.740 15.286 1.00 0.00 H new ATOM 0 HA PHE A 88 42.909 9.955 13.315 1.00 0.00 H new ATOM 0 HB2 PHE A 88 45.153 8.075 14.187 1.00 0.00 H new ATOM 0 HB3 PHE A 88 45.255 9.203 12.849 1.00 0.00 H new ATOM 0 HD1 PHE A 88 45.364 11.671 13.292 1.00 0.00 H new ATOM 0 HD2 PHE A 88 45.351 8.855 16.504 1.00 0.00 H new ATOM 0 HE1 PHE A 88 46.143 13.415 14.835 1.00 0.00 H new ATOM 0 HE2 PHE A 88 46.125 10.605 18.035 1.00 0.00 H new ATOM 0 HZ PHE A 88 46.548 12.881 17.201 1.00 0.00 H new ATOM 1411 N GLY A 89 43.182 8.242 11.342 1.00 0.00 N ATOM 1412 CA GLY A 89 42.905 7.364 10.207 1.00 0.00 C ATOM 1413 C GLY A 89 42.526 8.176 8.979 1.00 0.00 C ATOM 1414 O GLY A 89 42.828 9.371 8.905 1.00 0.00 O ATOM 0 H GLY A 89 43.619 9.125 11.078 1.00 0.00 H new ATOM 0 HA2 GLY A 89 43.782 6.755 9.990 1.00 0.00 H new ATOM 0 HA3 GLY A 89 42.096 6.679 10.460 1.00 0.00 H new ATOM 1418 N GLU A 90 41.848 7.531 8.018 1.00 0.00 N ATOM 1419 CA GLU A 90 41.319 8.194 6.806 1.00 0.00 C ATOM 1420 C GLU A 90 39.875 8.627 7.083 1.00 0.00 C ATOM 1421 O GLU A 90 39.110 7.844 7.640 1.00 0.00 O ATOM 1422 CB GLU A 90 41.364 7.210 5.609 1.00 0.00 C ATOM 1423 CG GLU A 90 42.752 6.608 5.339 1.00 0.00 C ATOM 1424 CD GLU A 90 42.722 5.557 4.225 1.00 0.00 C ATOM 1425 OE1 GLU A 90 42.255 4.432 4.489 1.00 0.00 O ATOM 1426 OE2 GLU A 90 43.154 5.846 3.092 1.00 0.00 O ATOM 0 H GLU A 90 41.648 6.531 8.055 1.00 0.00 H new ATOM 0 HA GLU A 90 41.924 9.066 6.558 1.00 0.00 H new ATOM 0 HB2 GLU A 90 40.659 6.400 5.793 1.00 0.00 H new ATOM 0 HB3 GLU A 90 41.026 7.730 4.713 1.00 0.00 H new ATOM 0 HG2 GLU A 90 43.444 7.404 5.066 1.00 0.00 H new ATOM 0 HG3 GLU A 90 43.133 6.154 6.254 1.00 0.00 H new ATOM 1433 N GLU A 91 39.507 9.865 6.716 1.00 0.00 N ATOM 1434 CA GLU A 91 38.151 10.394 6.972 1.00 0.00 C ATOM 1435 C GLU A 91 37.174 9.972 5.858 1.00 0.00 C ATOM 1436 O GLU A 91 37.275 10.456 4.718 1.00 0.00 O ATOM 1437 CB GLU A 91 38.170 11.943 7.128 1.00 0.00 C ATOM 1438 CG GLU A 91 36.782 12.592 7.369 1.00 0.00 C ATOM 1439 CD GLU A 91 36.068 12.096 8.650 1.00 0.00 C ATOM 1440 OE1 GLU A 91 36.259 12.703 9.724 1.00 0.00 O ATOM 1441 OE2 GLU A 91 35.301 11.103 8.583 1.00 0.00 O ATOM 0 H GLU A 91 40.127 10.521 6.241 1.00 0.00 H new ATOM 0 HA GLU A 91 37.802 9.966 7.912 1.00 0.00 H new ATOM 0 HB2 GLU A 91 38.825 12.202 7.960 1.00 0.00 H new ATOM 0 HB3 GLU A 91 38.608 12.379 6.230 1.00 0.00 H new ATOM 0 HG2 GLU A 91 36.904 13.674 7.429 1.00 0.00 H new ATOM 0 HG3 GLU A 91 36.144 12.390 6.509 1.00 0.00 H new ATOM 1448 N GLY A 92 36.277 9.025 6.200 1.00 0.00 N ATOM 1449 CA GLY A 92 35.127 8.668 5.368 1.00 0.00 C ATOM 1450 C GLY A 92 35.477 8.033 4.030 1.00 0.00 C ATOM 1451 O GLY A 92 36.607 7.618 3.803 1.00 0.00 O ATOM 0 H GLY A 92 36.337 8.489 7.066 1.00 0.00 H new ATOM 0 HA2 GLY A 92 34.493 7.979 5.926 1.00 0.00 H new ATOM 0 HA3 GLY A 92 34.537 9.566 5.184 1.00 0.00 H new ATOM 1455 N GLU A 93 34.475 7.944 3.160 1.00 0.00 N ATOM 1456 CA GLU A 93 34.638 7.544 1.740 1.00 0.00 C ATOM 1457 C GLU A 93 34.408 8.768 0.815 1.00 0.00 C ATOM 1458 O GLU A 93 34.571 8.674 -0.407 1.00 0.00 O ATOM 1459 CB GLU A 93 33.683 6.344 1.396 1.00 0.00 C ATOM 1460 CG GLU A 93 32.308 6.333 2.125 1.00 0.00 C ATOM 1461 CD GLU A 93 31.390 7.523 1.798 1.00 0.00 C ATOM 1462 OE1 GLU A 93 31.465 8.564 2.493 1.00 0.00 O ATOM 1463 OE2 GLU A 93 30.617 7.437 0.830 1.00 0.00 O ATOM 0 H GLU A 93 33.508 8.148 3.412 1.00 0.00 H new ATOM 0 HA GLU A 93 35.658 7.197 1.573 1.00 0.00 H new ATOM 0 HB2 GLU A 93 33.502 6.347 0.321 1.00 0.00 H new ATOM 0 HB3 GLU A 93 34.202 5.414 1.629 1.00 0.00 H new ATOM 0 HG2 GLU A 93 31.786 5.410 1.871 1.00 0.00 H new ATOM 0 HG3 GLU A 93 32.484 6.314 3.201 1.00 0.00 H new ATOM 1470 N GLY A 94 34.002 9.905 1.432 1.00 0.00 N ATOM 1471 CA GLY A 94 33.910 11.204 0.754 1.00 0.00 C ATOM 1472 C GLY A 94 32.719 11.340 -0.190 1.00 0.00 C ATOM 1473 O GLY A 94 32.723 12.243 -1.045 1.00 0.00 O ATOM 0 H GLY A 94 33.731 9.938 2.415 1.00 0.00 H new ATOM 0 HA2 GLY A 94 33.853 11.990 1.507 1.00 0.00 H new ATOM 0 HA3 GLY A 94 34.827 11.371 0.189 1.00 0.00 H new ATOM 1477 N SER A 95 31.710 10.451 -0.018 1.00 0.00 N ATOM 1478 CA SER A 95 30.511 10.366 -0.870 1.00 0.00 C ATOM 1479 C SER A 95 30.921 9.987 -2.325 1.00 0.00 C ATOM 1480 O SER A 95 31.123 10.897 -3.164 1.00 0.00 O ATOM 1481 CB SER A 95 29.662 11.676 -0.790 1.00 0.00 C ATOM 1482 OG SER A 95 28.447 11.571 -1.524 1.00 0.00 O ATOM 1483 OXT SER A 95 31.068 8.777 -2.611 1.00 0.00 O ATOM 0 H SER A 95 31.713 9.762 0.734 1.00 0.00 H new ATOM 0 HA SER A 95 29.862 9.572 -0.500 1.00 0.00 H new ATOM 0 HB2 SER A 95 29.437 11.899 0.253 1.00 0.00 H new ATOM 0 HB3 SER A 95 30.247 12.511 -1.175 1.00 0.00 H new ATOM 0 HG SER A 95 27.945 12.409 -1.447 1.00 0.00 H new TER 1489 SER A 95