USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 767 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 76 ASN : amide:sc= -7.2! C(o=-13!,f=-13!) USER MOD Set 1.2: A 77 ASN : amide:sc= -5.93! C(o=-13!,f=-14!) USER MOD Set 2.1: A 14 THR OG1 : rot 177:sc= -0.987 USER MOD Set 2.2: A 63 ASN : amide:sc= -9.1! C(o=-10!,f=-17!) USER MOD Set 3.1: A 42 GLN : amide:sc= -0.636 K(o=-1.1,f=-2.6!) USER MOD Set 3.2: A 44 ASN : amide:sc= -0.456 K(o=-1.1,f=-2.6) USER MOD Set 4.1: A 20 ASN : amide:sc= -0.569 X(o=-0.57,f=-0.12) USER MOD Set 4.2: A 85 GLN : amide:sc= 0 X(o=-0.57,f=-1!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.02 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot -83:sc= 0.302 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -10.8! C(o=-11!,f=-19!) USER MOD Single : A 17 TYR OH : rot 150:sc= -1.27 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 0:sc= 0.673 USER MOD Single : A 26 THR OG1 : rot 180:sc= -1.14 USER MOD Single : A 29 GLN : amide:sc= -0.0936 K(o=-0.094,f=-6.5!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= -2.25! USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ -114:sc= -6.99! (180deg=-12.2!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.437 USER MOD Single : A 62 TYR OH : rot 96:sc= -1.54! USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.0236 X(o=-0.024,f=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HE2:sc= -3.41! C(o=-3.4!,f=-6.1!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.566 1.550 5.974 1.00 0.00 N ATOM 2 CA MET A 1 -11.797 1.553 7.446 1.00 0.00 C ATOM 3 C MET A 1 -13.292 1.709 7.724 1.00 0.00 C ATOM 4 O MET A 1 -13.895 0.901 8.402 1.00 0.00 O ATOM 5 CB MET A 1 -11.034 2.719 8.076 1.00 0.00 C ATOM 6 CG MET A 1 -10.520 2.305 9.456 1.00 0.00 C ATOM 7 SD MET A 1 -11.370 3.266 10.734 1.00 0.00 S ATOM 8 CE MET A 1 -10.314 4.734 10.656 1.00 0.00 C ATOM 0 H1 MET A 1 -10.549 1.444 5.782 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.084 0.758 5.543 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.903 2.446 5.568 1.00 0.00 H new ATOM 0 HA MET A 1 -11.445 0.615 7.875 1.00 0.00 H new ATOM 0 HB2 MET A 1 -10.200 3.009 7.437 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.685 3.589 8.164 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.690 1.240 9.614 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.444 2.469 9.519 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.664 5.473 11.377 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.287 4.456 10.891 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.354 5.158 9.653 1.00 0.00 H new ATOM 20 N SER A 2 -13.896 2.741 7.202 1.00 0.00 N ATOM 21 CA SER A 2 -15.353 2.948 7.432 1.00 0.00 C ATOM 22 C SER A 2 -16.129 2.521 6.184 1.00 0.00 C ATOM 23 O SER A 2 -15.713 1.644 5.455 1.00 0.00 O ATOM 24 CB SER A 2 -15.620 4.428 7.716 1.00 0.00 C ATOM 25 OG SER A 2 -15.376 5.183 6.537 1.00 0.00 O ATOM 0 H SER A 2 -13.443 3.450 6.626 1.00 0.00 H new ATOM 0 HA SER A 2 -15.676 2.351 8.285 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.650 4.567 8.044 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.978 4.777 8.525 1.00 0.00 H new ATOM 0 HG SER A 2 -15.548 6.131 6.714 1.00 0.00 H new ATOM 31 N TYR A 3 -17.250 3.137 5.930 1.00 0.00 N ATOM 32 CA TYR A 3 -18.047 2.766 4.725 1.00 0.00 C ATOM 33 C TYR A 3 -17.614 3.638 3.546 1.00 0.00 C ATOM 34 O TYR A 3 -18.352 3.827 2.599 1.00 0.00 O ATOM 35 CB TYR A 3 -19.535 2.991 5.004 1.00 0.00 C ATOM 36 CG TYR A 3 -20.163 1.705 5.486 1.00 0.00 C ATOM 37 CD1 TYR A 3 -20.570 0.734 4.562 1.00 0.00 C ATOM 38 CD2 TYR A 3 -20.341 1.484 6.856 1.00 0.00 C ATOM 39 CE1 TYR A 3 -21.155 -0.456 5.010 1.00 0.00 C ATOM 40 CE2 TYR A 3 -20.927 0.295 7.304 1.00 0.00 C ATOM 41 CZ TYR A 3 -21.334 -0.676 6.381 1.00 0.00 C ATOM 42 OH TYR A 3 -21.912 -1.849 6.822 1.00 0.00 O ATOM 0 H TYR A 3 -17.649 3.880 6.503 1.00 0.00 H new ATOM 0 HA TYR A 3 -17.879 1.716 4.487 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -19.660 3.772 5.754 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -20.036 3.335 4.099 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -20.432 0.904 3.504 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -20.026 2.232 7.568 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -21.468 -1.205 4.298 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -21.065 0.126 8.362 1.00 0.00 H new ATOM 0 HH TYR A 3 -21.961 -1.842 7.801 1.00 0.00 H new ATOM 52 N ALA A 4 -16.425 4.173 3.594 1.00 0.00 N ATOM 53 CA ALA A 4 -15.952 5.036 2.474 1.00 0.00 C ATOM 54 C ALA A 4 -14.524 4.642 2.085 1.00 0.00 C ATOM 55 O ALA A 4 -13.663 4.471 2.927 1.00 0.00 O ATOM 56 CB ALA A 4 -15.974 6.500 2.915 1.00 0.00 C ATOM 0 H ALA A 4 -15.761 4.050 4.359 1.00 0.00 H new ATOM 0 HA ALA A 4 -16.609 4.903 1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -15.628 7.132 2.097 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -16.991 6.783 3.187 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -15.318 6.631 3.776 1.00 0.00 H new ATOM 62 N ARG A 5 -14.266 4.497 0.813 1.00 0.00 N ATOM 63 CA ARG A 5 -12.895 4.119 0.364 1.00 0.00 C ATOM 64 C ARG A 5 -12.625 4.740 -1.009 1.00 0.00 C ATOM 65 O ARG A 5 -13.493 5.365 -1.586 1.00 0.00 O ATOM 66 CB ARG A 5 -12.792 2.595 0.268 1.00 0.00 C ATOM 67 CG ARG A 5 -14.019 2.041 -0.459 1.00 0.00 C ATOM 68 CD ARG A 5 -14.805 1.130 0.486 1.00 0.00 C ATOM 69 NE ARG A 5 -14.073 -0.157 0.661 1.00 0.00 N ATOM 70 CZ ARG A 5 -13.433 -0.400 1.771 1.00 0.00 C ATOM 71 NH1 ARG A 5 -12.209 0.026 1.926 1.00 0.00 N ATOM 72 NH2 ARG A 5 -14.015 -1.071 2.727 1.00 0.00 N ATOM 0 H ARG A 5 -14.947 4.624 0.064 1.00 0.00 H new ATOM 0 HA ARG A 5 -12.160 4.485 1.081 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -11.884 2.315 -0.266 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -12.722 2.162 1.266 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -14.652 2.860 -0.802 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -13.710 1.485 -1.344 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -14.939 1.618 1.451 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -15.800 0.942 0.083 1.00 0.00 H new ATOM 0 HE ARG A 5 -14.073 -0.849 -0.089 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -11.753 0.549 1.179 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -11.709 -0.164 2.794 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -14.971 -1.406 2.606 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -13.514 -1.261 3.595 1.00 0.00 H new ATOM 86 N PRO A 6 -11.424 4.552 -1.490 1.00 0.00 N ATOM 87 CA PRO A 6 -11.089 5.127 -2.816 1.00 0.00 C ATOM 88 C PRO A 6 -10.900 4.019 -3.864 1.00 0.00 C ATOM 89 O PRO A 6 -10.794 2.854 -3.538 1.00 0.00 O ATOM 90 CB PRO A 6 -9.784 5.888 -2.579 1.00 0.00 C ATOM 91 CG PRO A 6 -9.141 5.266 -1.326 1.00 0.00 C ATOM 92 CD PRO A 6 -10.262 4.545 -0.564 1.00 0.00 C ATOM 0 HA PRO A 6 -11.880 5.770 -3.202 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -9.121 5.800 -3.440 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -9.975 6.951 -2.431 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -8.351 4.568 -1.603 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -8.683 6.035 -0.704 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -9.971 3.527 -0.304 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -10.498 5.057 0.369 1.00 0.00 H new ATOM 100 N GLY A 7 -10.860 4.378 -5.125 1.00 0.00 N ATOM 101 CA GLY A 7 -10.682 3.350 -6.197 1.00 0.00 C ATOM 102 C GLY A 7 -9.897 3.952 -7.371 1.00 0.00 C ATOM 103 O GLY A 7 -9.181 4.921 -7.215 1.00 0.00 O ATOM 0 H GLY A 7 -10.943 5.339 -5.457 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.152 2.485 -5.799 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.655 2.998 -6.541 1.00 0.00 H new ATOM 107 N GLY A 8 -10.025 3.388 -8.548 1.00 0.00 N ATOM 108 CA GLY A 8 -9.282 3.938 -9.724 1.00 0.00 C ATOM 109 C GLY A 8 -9.640 3.154 -10.994 1.00 0.00 C ATOM 110 O GLY A 8 -10.795 2.898 -11.269 1.00 0.00 O ATOM 0 H GLY A 8 -10.609 2.575 -8.744 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -9.527 4.992 -9.858 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -8.209 3.881 -9.544 1.00 0.00 H new ATOM 114 N GLU A 9 -8.657 2.781 -11.780 1.00 0.00 N ATOM 115 CA GLU A 9 -8.945 2.025 -13.040 1.00 0.00 C ATOM 116 C GLU A 9 -7.749 1.141 -13.415 1.00 0.00 C ATOM 117 O GLU A 9 -6.828 0.964 -12.646 1.00 0.00 O ATOM 118 CB GLU A 9 -9.203 3.021 -14.175 1.00 0.00 C ATOM 119 CG GLU A 9 -10.596 2.780 -14.760 1.00 0.00 C ATOM 120 CD GLU A 9 -10.503 2.683 -16.284 1.00 0.00 C ATOM 121 OE1 GLU A 9 -10.465 3.722 -16.923 1.00 0.00 O ATOM 122 OE2 GLU A 9 -10.473 1.572 -16.786 1.00 0.00 O ATOM 0 H GLU A 9 -7.670 2.967 -11.603 1.00 0.00 H new ATOM 0 HA GLU A 9 -9.820 1.395 -12.883 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.126 4.042 -13.801 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.446 2.908 -14.951 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -11.019 1.862 -14.352 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -11.266 3.592 -14.477 1.00 0.00 H new ATOM 129 N SER A 10 -7.759 0.590 -14.603 1.00 0.00 N ATOM 130 CA SER A 10 -6.627 -0.280 -15.050 1.00 0.00 C ATOM 131 C SER A 10 -6.771 -1.682 -14.448 1.00 0.00 C ATOM 132 O SER A 10 -7.771 -2.003 -13.837 1.00 0.00 O ATOM 133 CB SER A 10 -5.300 0.336 -14.603 1.00 0.00 C ATOM 134 OG SER A 10 -4.916 -0.228 -13.356 1.00 0.00 O ATOM 0 H SER A 10 -8.507 0.706 -15.287 1.00 0.00 H new ATOM 0 HA SER A 10 -6.646 -0.357 -16.137 1.00 0.00 H new ATOM 0 HB2 SER A 10 -4.530 0.151 -15.351 1.00 0.00 H new ATOM 0 HB3 SER A 10 -5.401 1.417 -14.510 1.00 0.00 H new ATOM 0 HG SER A 10 -5.372 0.245 -12.629 1.00 0.00 H new ATOM 140 N ILE A 11 -5.780 -2.522 -14.619 1.00 0.00 N ATOM 141 CA ILE A 11 -5.867 -3.902 -14.057 1.00 0.00 C ATOM 142 C ILE A 11 -6.228 -3.812 -12.578 1.00 0.00 C ATOM 143 O ILE A 11 -5.374 -3.737 -11.729 1.00 0.00 O ATOM 144 CB ILE A 11 -4.519 -4.636 -14.237 1.00 0.00 C ATOM 145 CG1 ILE A 11 -4.715 -6.149 -13.987 1.00 0.00 C ATOM 146 CG2 ILE A 11 -3.441 -4.061 -13.298 1.00 0.00 C ATOM 147 CD1 ILE A 11 -4.516 -6.516 -12.505 1.00 0.00 C ATOM 0 H ILE A 11 -4.918 -2.311 -15.122 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.636 -4.466 -14.585 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.174 -4.486 -15.260 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -5.716 -6.442 -14.302 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -4.010 -6.712 -14.598 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.504 -4.598 -13.448 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.293 -3.004 -13.518 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -3.762 -4.174 -12.263 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.663 -7.588 -12.373 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -3.506 -6.247 -12.196 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.238 -5.973 -11.896 1.00 0.00 H new ATOM 159 N LYS A 12 -7.490 -3.817 -12.250 1.00 0.00 N ATOM 160 CA LYS A 12 -7.849 -3.738 -10.812 1.00 0.00 C ATOM 161 C LYS A 12 -7.316 -2.402 -10.252 1.00 0.00 C ATOM 162 O LYS A 12 -6.258 -1.947 -10.638 1.00 0.00 O ATOM 163 CB LYS A 12 -7.190 -4.946 -10.126 1.00 0.00 C ATOM 164 CG LYS A 12 -8.211 -6.073 -9.980 1.00 0.00 C ATOM 165 CD LYS A 12 -7.646 -7.359 -10.590 1.00 0.00 C ATOM 166 CE LYS A 12 -8.798 -8.237 -11.076 1.00 0.00 C ATOM 167 NZ LYS A 12 -8.527 -8.680 -12.473 1.00 0.00 N ATOM 0 H LYS A 12 -8.272 -3.871 -12.902 1.00 0.00 H new ATOM 0 HA LYS A 12 -8.925 -3.766 -10.643 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -6.337 -5.288 -10.711 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.809 -4.657 -9.146 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -8.446 -6.230 -8.927 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -9.142 -5.801 -10.477 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -6.981 -7.120 -11.420 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -7.052 -7.895 -9.850 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -8.910 -9.103 -10.423 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -9.735 -7.682 -11.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -9.310 -9.278 -12.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -8.440 -7.848 -13.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -7.641 -9.224 -12.499 1.00 0.00 H new ATOM 181 N ASP A 13 -8.028 -1.743 -9.363 1.00 0.00 N ATOM 182 CA ASP A 13 -7.505 -0.440 -8.849 1.00 0.00 C ATOM 183 C ASP A 13 -8.083 -0.086 -7.472 1.00 0.00 C ATOM 184 O ASP A 13 -9.154 0.469 -7.336 1.00 0.00 O ATOM 185 CB ASP A 13 -7.822 0.682 -9.834 1.00 0.00 C ATOM 186 CG ASP A 13 -6.622 1.632 -9.893 1.00 0.00 C ATOM 187 OD1 ASP A 13 -5.716 1.365 -10.664 1.00 0.00 O ATOM 188 OD2 ASP A 13 -6.623 2.602 -9.155 1.00 0.00 O ATOM 0 H ASP A 13 -8.925 -2.044 -8.982 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.426 -0.549 -8.743 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.028 0.271 -10.822 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -8.716 1.220 -9.520 1.00 0.00 H new ATOM 193 N THR A 14 -7.317 -0.376 -6.472 1.00 0.00 N ATOM 194 CA THR A 14 -7.673 -0.060 -5.051 1.00 0.00 C ATOM 195 C THR A 14 -6.374 -0.147 -4.245 1.00 0.00 C ATOM 196 O THR A 14 -6.290 -0.827 -3.242 1.00 0.00 O ATOM 197 CB THR A 14 -8.690 -1.054 -4.503 1.00 0.00 C ATOM 198 OG1 THR A 14 -9.753 -1.195 -5.435 1.00 0.00 O ATOM 199 CG2 THR A 14 -9.243 -0.537 -3.173 1.00 0.00 C ATOM 0 H THR A 14 -6.415 -0.841 -6.576 1.00 0.00 H new ATOM 0 HA THR A 14 -8.124 0.930 -4.984 1.00 0.00 H new ATOM 0 HB THR A 14 -8.210 -2.020 -4.344 1.00 0.00 H new ATOM 0 HG1 THR A 14 -10.389 -1.865 -5.107 1.00 0.00 H new ATOM 0 HG21 THR A 14 -9.970 -1.248 -2.781 1.00 0.00 H new ATOM 0 HG22 THR A 14 -8.427 -0.422 -2.460 1.00 0.00 H new ATOM 0 HG23 THR A 14 -9.726 0.427 -3.330 1.00 0.00 H new ATOM 207 N ASN A 15 -5.341 0.505 -4.719 1.00 0.00 N ATOM 208 CA ASN A 15 -4.016 0.437 -4.037 1.00 0.00 C ATOM 209 C ASN A 15 -4.016 1.303 -2.784 1.00 0.00 C ATOM 210 O ASN A 15 -5.009 1.904 -2.424 1.00 0.00 O ATOM 211 CB ASN A 15 -2.938 0.966 -4.987 1.00 0.00 C ATOM 212 CG ASN A 15 -2.900 0.116 -6.256 1.00 0.00 C ATOM 213 OD1 ASN A 15 -3.931 -0.230 -6.798 1.00 0.00 O ATOM 214 ND2 ASN A 15 -1.747 -0.234 -6.760 1.00 0.00 N ATOM 0 H ASN A 15 -5.362 1.086 -5.557 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.817 -0.599 -3.762 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.144 2.006 -5.241 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.965 0.945 -4.495 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -1.712 -0.798 -7.609 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -0.882 0.057 -6.305 1.00 0.00 H new ATOM 221 N LEU A 16 -2.897 1.374 -2.118 1.00 0.00 N ATOM 222 CA LEU A 16 -2.822 2.204 -0.886 1.00 0.00 C ATOM 223 C LEU A 16 -1.454 2.883 -0.803 1.00 0.00 C ATOM 224 O LEU A 16 -0.421 2.259 -0.944 1.00 0.00 O ATOM 225 CB LEU A 16 -3.113 1.366 0.382 1.00 0.00 C ATOM 226 CG LEU A 16 -2.268 0.079 0.483 1.00 0.00 C ATOM 227 CD1 LEU A 16 -2.808 -0.759 1.642 1.00 0.00 C ATOM 228 CD2 LEU A 16 -2.388 -0.774 -0.779 1.00 0.00 C ATOM 0 H LEU A 16 -2.034 0.894 -2.374 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.592 2.974 -0.939 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -2.929 1.981 1.263 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -4.170 1.098 0.395 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.227 0.368 0.625 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -2.224 -1.675 1.732 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.734 -0.189 2.568 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -3.852 -1.011 1.454 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.779 -1.672 -0.671 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.430 -1.058 -0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -2.041 -0.202 -1.639 1.00 0.00 H new ATOM 240 N TYR A 17 -1.454 4.175 -0.597 1.00 0.00 N ATOM 241 CA TYR A 17 -0.176 4.939 -0.527 1.00 0.00 C ATOM 242 C TYR A 17 0.468 4.750 0.843 1.00 0.00 C ATOM 243 O TYR A 17 0.146 5.435 1.790 1.00 0.00 O ATOM 244 CB TYR A 17 -0.471 6.423 -0.751 1.00 0.00 C ATOM 245 CG TYR A 17 0.605 7.027 -1.620 1.00 0.00 C ATOM 246 CD1 TYR A 17 0.561 6.859 -3.009 1.00 0.00 C ATOM 247 CD2 TYR A 17 1.645 7.758 -1.035 1.00 0.00 C ATOM 248 CE1 TYR A 17 1.559 7.420 -3.814 1.00 0.00 C ATOM 249 CE2 TYR A 17 2.644 8.319 -1.841 1.00 0.00 C ATOM 250 CZ TYR A 17 2.600 8.151 -3.229 1.00 0.00 C ATOM 251 OH TYR A 17 3.585 8.705 -4.022 1.00 0.00 O ATOM 0 H TYR A 17 -2.296 4.738 -0.473 1.00 0.00 H new ATOM 0 HA TYR A 17 0.508 4.576 -1.294 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.445 6.543 -1.225 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.515 6.944 0.205 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -0.243 6.296 -3.460 1.00 0.00 H new ATOM 0 HD2 TYR A 17 1.677 7.889 0.036 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.526 7.289 -4.886 1.00 0.00 H new ATOM 0 HE2 TYR A 17 3.448 8.881 -1.391 1.00 0.00 H new ATOM 0 HH TYR A 17 3.927 9.520 -3.598 1.00 0.00 H new ATOM 261 N VAL A 18 1.380 3.826 0.944 1.00 0.00 N ATOM 262 CA VAL A 18 2.058 3.581 2.244 1.00 0.00 C ATOM 263 C VAL A 18 3.155 4.629 2.449 1.00 0.00 C ATOM 264 O VAL A 18 4.189 4.594 1.811 1.00 0.00 O ATOM 265 CB VAL A 18 2.670 2.182 2.226 1.00 0.00 C ATOM 266 CG1 VAL A 18 1.550 1.140 2.248 1.00 0.00 C ATOM 267 CG2 VAL A 18 3.490 2.006 0.950 1.00 0.00 C ATOM 0 H VAL A 18 1.686 3.227 0.177 1.00 0.00 H new ATOM 0 HA VAL A 18 1.340 3.653 3.061 1.00 0.00 H new ATOM 0 HB VAL A 18 3.312 2.053 3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 18 1.983 0.140 2.235 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.954 1.266 3.152 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.914 1.271 1.373 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.928 1.008 0.934 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.843 2.132 0.082 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.284 2.752 0.922 1.00 0.00 H new ATOM 277 N THR A 19 2.931 5.570 3.327 1.00 0.00 N ATOM 278 CA THR A 19 3.955 6.629 3.564 1.00 0.00 C ATOM 279 C THR A 19 4.763 6.308 4.823 1.00 0.00 C ATOM 280 O THR A 19 4.397 5.459 5.612 1.00 0.00 O ATOM 281 CB THR A 19 3.256 7.980 3.741 1.00 0.00 C ATOM 282 OG1 THR A 19 2.658 8.034 5.028 1.00 0.00 O ATOM 283 CG2 THR A 19 2.179 8.148 2.668 1.00 0.00 C ATOM 0 H THR A 19 2.084 5.651 3.890 1.00 0.00 H new ATOM 0 HA THR A 19 4.629 6.670 2.709 1.00 0.00 H new ATOM 0 HB THR A 19 3.987 8.783 3.644 1.00 0.00 H new ATOM 0 HG1 THR A 19 2.211 8.898 5.145 1.00 0.00 H new ATOM 0 HG21 THR A 19 1.684 9.110 2.797 1.00 0.00 H new ATOM 0 HG22 THR A 19 2.639 8.106 1.681 1.00 0.00 H new ATOM 0 HG23 THR A 19 1.445 7.347 2.760 1.00 0.00 H new ATOM 291 N ASN A 20 5.863 6.990 5.016 1.00 0.00 N ATOM 292 CA ASN A 20 6.707 6.744 6.220 1.00 0.00 C ATOM 293 C ASN A 20 7.241 5.309 6.197 1.00 0.00 C ATOM 294 O ASN A 20 6.779 4.452 6.924 1.00 0.00 O ATOM 295 CB ASN A 20 5.872 6.957 7.485 1.00 0.00 C ATOM 296 CG ASN A 20 6.032 8.402 7.965 1.00 0.00 C ATOM 297 OD1 ASN A 20 5.057 9.074 8.238 1.00 0.00 O ATOM 298 ND2 ASN A 20 7.228 8.912 8.082 1.00 0.00 N ATOM 0 H ASN A 20 6.213 7.711 4.386 1.00 0.00 H new ATOM 0 HA ASN A 20 7.546 7.440 6.216 1.00 0.00 H new ATOM 0 HB2 ASN A 20 4.823 6.744 7.281 1.00 0.00 H new ATOM 0 HB3 ASN A 20 6.191 6.266 8.265 1.00 0.00 H new ATOM 0 HD21 ASN A 20 7.343 9.874 8.402 1.00 0.00 H new ATOM 0 HD22 ASN A 20 8.047 8.349 7.853 1.00 0.00 H new ATOM 305 N LEU A 21 8.216 5.042 5.370 1.00 0.00 N ATOM 306 CA LEU A 21 8.784 3.664 5.303 1.00 0.00 C ATOM 307 C LEU A 21 10.305 3.749 5.164 1.00 0.00 C ATOM 308 O LEU A 21 10.832 4.754 4.730 1.00 0.00 O ATOM 309 CB LEU A 21 8.210 2.914 4.094 1.00 0.00 C ATOM 310 CG LEU A 21 6.871 3.530 3.679 1.00 0.00 C ATOM 311 CD1 LEU A 21 7.118 4.676 2.697 1.00 0.00 C ATOM 312 CD2 LEU A 21 6.008 2.463 3.004 1.00 0.00 C ATOM 0 H LEU A 21 8.644 5.718 4.738 1.00 0.00 H new ATOM 0 HA LEU A 21 8.522 3.128 6.215 1.00 0.00 H new ATOM 0 HB2 LEU A 21 8.913 2.958 3.262 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.074 1.861 4.341 1.00 0.00 H new ATOM 0 HG LEU A 21 6.358 3.911 4.562 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.165 5.114 2.402 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.735 5.437 3.174 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.631 4.294 1.814 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.054 2.900 2.708 1.00 0.00 H new ATOM 0 HD22 LEU A 21 6.523 2.084 2.121 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.831 1.644 3.701 1.00 0.00 H new ATOM 324 N PRO A 22 10.959 2.684 5.536 1.00 0.00 N ATOM 325 CA PRO A 22 12.433 2.672 5.431 1.00 0.00 C ATOM 326 C PRO A 22 12.858 2.032 4.108 1.00 0.00 C ATOM 327 O PRO A 22 12.037 1.694 3.279 1.00 0.00 O ATOM 328 CB PRO A 22 12.896 1.827 6.618 1.00 0.00 C ATOM 329 CG PRO A 22 11.700 0.937 7.004 1.00 0.00 C ATOM 330 CD PRO A 22 10.447 1.611 6.423 1.00 0.00 C ATOM 0 HA PRO A 22 12.866 3.672 5.449 1.00 0.00 H new ATOM 0 HB2 PRO A 22 13.762 1.221 6.350 1.00 0.00 H new ATOM 0 HB3 PRO A 22 13.196 2.460 7.453 1.00 0.00 H new ATOM 0 HG2 PRO A 22 11.820 -0.069 6.603 1.00 0.00 H new ATOM 0 HG3 PRO A 22 11.622 0.841 8.087 1.00 0.00 H new ATOM 0 HD2 PRO A 22 9.838 0.898 5.867 1.00 0.00 H new ATOM 0 HD3 PRO A 22 9.818 2.020 7.213 1.00 0.00 H new ATOM 338 N ARG A 23 14.135 1.862 3.903 1.00 0.00 N ATOM 339 CA ARG A 23 14.609 1.242 2.632 1.00 0.00 C ATOM 340 C ARG A 23 14.833 -0.256 2.845 1.00 0.00 C ATOM 341 O ARG A 23 15.336 -0.946 1.980 1.00 0.00 O ATOM 342 CB ARG A 23 15.922 1.898 2.203 1.00 0.00 C ATOM 343 CG ARG A 23 15.892 2.160 0.697 1.00 0.00 C ATOM 344 CD ARG A 23 17.292 1.958 0.116 1.00 0.00 C ATOM 345 NE ARG A 23 17.185 1.613 -1.328 1.00 0.00 N ATOM 346 CZ ARG A 23 16.766 0.431 -1.686 1.00 0.00 C ATOM 347 NH1 ARG A 23 17.205 -0.632 -1.068 1.00 0.00 N ATOM 348 NH2 ARG A 23 15.909 0.311 -2.661 1.00 0.00 N ATOM 0 H ARG A 23 14.870 2.125 4.559 1.00 0.00 H new ATOM 0 HA ARG A 23 13.858 1.389 1.856 1.00 0.00 H new ATOM 0 HB2 ARG A 23 16.067 2.834 2.743 1.00 0.00 H new ATOM 0 HB3 ARG A 23 16.763 1.252 2.454 1.00 0.00 H new ATOM 0 HG2 ARG A 23 15.185 1.485 0.214 1.00 0.00 H new ATOM 0 HG3 ARG A 23 15.548 3.176 0.501 1.00 0.00 H new ATOM 0 HD2 ARG A 23 17.884 2.865 0.241 1.00 0.00 H new ATOM 0 HD3 ARG A 23 17.809 1.163 0.653 1.00 0.00 H new ATOM 0 HE ARG A 23 17.439 2.301 -2.037 1.00 0.00 H new ATOM 0 HH11 ARG A 23 17.876 -0.538 -0.305 1.00 0.00 H new ATOM 0 HH12 ARG A 23 16.877 -1.556 -1.348 1.00 0.00 H new ATOM 0 HH21 ARG A 23 15.566 1.142 -3.144 1.00 0.00 H new ATOM 0 HH22 ARG A 23 15.581 -0.613 -2.941 1.00 0.00 H new ATOM 362 N THR A 24 14.464 -0.765 3.987 1.00 0.00 N ATOM 363 CA THR A 24 14.657 -2.217 4.252 1.00 0.00 C ATOM 364 C THR A 24 13.529 -3.011 3.589 1.00 0.00 C ATOM 365 O THR A 24 13.538 -4.226 3.574 1.00 0.00 O ATOM 366 CB THR A 24 14.636 -2.467 5.760 1.00 0.00 C ATOM 367 OG1 THR A 24 14.509 -3.862 6.005 1.00 0.00 O ATOM 368 CG2 THR A 24 13.454 -1.726 6.387 1.00 0.00 C ATOM 0 H THR A 24 14.037 -0.238 4.749 1.00 0.00 H new ATOM 0 HA THR A 24 15.616 -2.536 3.843 1.00 0.00 H new ATOM 0 HB THR A 24 15.564 -2.103 6.202 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.469 -4.342 5.151 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.441 -1.906 7.462 1.00 0.00 H new ATOM 0 HG22 THR A 24 13.554 -0.657 6.199 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.524 -2.087 5.948 1.00 0.00 H new ATOM 376 N ILE A 25 12.557 -2.335 3.039 1.00 0.00 N ATOM 377 CA ILE A 25 11.430 -3.050 2.377 1.00 0.00 C ATOM 378 C ILE A 25 11.241 -2.498 0.962 1.00 0.00 C ATOM 379 O ILE A 25 11.120 -1.304 0.762 1.00 0.00 O ATOM 380 CB ILE A 25 10.150 -2.844 3.189 1.00 0.00 C ATOM 381 CG1 ILE A 25 9.663 -1.404 3.020 1.00 0.00 C ATOM 382 CG2 ILE A 25 10.438 -3.110 4.667 1.00 0.00 C ATOM 383 CD1 ILE A 25 8.554 -1.359 1.968 1.00 0.00 C ATOM 0 H ILE A 25 12.495 -1.317 3.020 1.00 0.00 H new ATOM 0 HA ILE A 25 11.653 -4.116 2.322 1.00 0.00 H new ATOM 0 HB ILE A 25 9.382 -3.532 2.835 1.00 0.00 H new ATOM 0 HG12 ILE A 25 9.292 -1.021 3.971 1.00 0.00 H new ATOM 0 HG13 ILE A 25 10.491 -0.762 2.718 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.527 -2.964 5.247 1.00 0.00 H new ATOM 0 HG22 ILE A 25 10.786 -4.135 4.791 1.00 0.00 H new ATOM 0 HG23 ILE A 25 11.206 -2.421 5.018 1.00 0.00 H new ATOM 0 HD11 ILE A 25 8.208 -0.332 1.848 1.00 0.00 H new ATOM 0 HD12 ILE A 25 8.940 -1.725 1.017 1.00 0.00 H new ATOM 0 HD13 ILE A 25 7.723 -1.987 2.288 1.00 0.00 H new ATOM 395 N THR A 26 11.219 -3.354 -0.022 1.00 0.00 N ATOM 396 CA THR A 26 11.044 -2.876 -1.422 1.00 0.00 C ATOM 397 C THR A 26 9.589 -3.057 -1.853 1.00 0.00 C ATOM 398 O THR A 26 8.798 -3.675 -1.168 1.00 0.00 O ATOM 399 CB THR A 26 11.948 -3.683 -2.354 1.00 0.00 C ATOM 400 OG1 THR A 26 11.323 -4.923 -2.659 1.00 0.00 O ATOM 401 CG2 THR A 26 13.292 -3.937 -1.669 1.00 0.00 C ATOM 0 H THR A 26 11.315 -4.364 0.083 1.00 0.00 H new ATOM 0 HA THR A 26 11.310 -1.820 -1.475 1.00 0.00 H new ATOM 0 HB THR A 26 12.115 -3.125 -3.275 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.900 -5.442 -3.258 1.00 0.00 H new ATOM 0 HG21 THR A 26 13.936 -4.512 -2.334 1.00 0.00 H new ATOM 0 HG22 THR A 26 13.768 -2.984 -1.437 1.00 0.00 H new ATOM 0 HG23 THR A 26 13.131 -4.496 -0.747 1.00 0.00 H new ATOM 409 N ASP A 27 9.231 -2.522 -2.987 1.00 0.00 N ATOM 410 CA ASP A 27 7.829 -2.662 -3.468 1.00 0.00 C ATOM 411 C ASP A 27 7.546 -4.132 -3.779 1.00 0.00 C ATOM 412 O ASP A 27 6.594 -4.709 -3.292 1.00 0.00 O ATOM 413 CB ASP A 27 7.636 -1.830 -4.736 1.00 0.00 C ATOM 414 CG ASP A 27 8.877 -1.950 -5.624 1.00 0.00 C ATOM 415 OD1 ASP A 27 9.797 -1.172 -5.430 1.00 0.00 O ATOM 416 OD2 ASP A 27 8.885 -2.815 -6.483 1.00 0.00 O ATOM 0 H ASP A 27 9.850 -1.993 -3.602 1.00 0.00 H new ATOM 0 HA ASP A 27 7.144 -2.311 -2.697 1.00 0.00 H new ATOM 0 HB2 ASP A 27 6.755 -2.173 -5.278 1.00 0.00 H new ATOM 0 HB3 ASP A 27 7.463 -0.786 -4.475 1.00 0.00 H new ATOM 421 N ASP A 28 8.364 -4.744 -4.589 1.00 0.00 N ATOM 422 CA ASP A 28 8.138 -6.176 -4.928 1.00 0.00 C ATOM 423 C ASP A 28 8.296 -7.026 -3.667 1.00 0.00 C ATOM 424 O ASP A 28 7.959 -8.193 -3.646 1.00 0.00 O ATOM 425 CB ASP A 28 9.161 -6.620 -5.976 1.00 0.00 C ATOM 426 CG ASP A 28 8.818 -5.985 -7.326 1.00 0.00 C ATOM 427 OD1 ASP A 28 7.716 -6.207 -7.800 1.00 0.00 O ATOM 428 OD2 ASP A 28 9.664 -5.289 -7.863 1.00 0.00 O ATOM 0 H ASP A 28 9.178 -4.315 -5.030 1.00 0.00 H new ATOM 0 HA ASP A 28 7.132 -6.302 -5.328 1.00 0.00 H new ATOM 0 HB2 ASP A 28 10.164 -6.325 -5.668 1.00 0.00 H new ATOM 0 HB3 ASP A 28 9.160 -7.707 -6.063 1.00 0.00 H new ATOM 433 N GLN A 29 8.811 -6.450 -2.615 1.00 0.00 N ATOM 434 CA GLN A 29 8.992 -7.225 -1.356 1.00 0.00 C ATOM 435 C GLN A 29 7.652 -7.345 -0.627 1.00 0.00 C ATOM 436 O GLN A 29 7.189 -8.431 -0.333 1.00 0.00 O ATOM 437 CB GLN A 29 10.000 -6.503 -0.458 1.00 0.00 C ATOM 438 CG GLN A 29 10.287 -7.358 0.778 1.00 0.00 C ATOM 439 CD GLN A 29 11.664 -6.999 1.342 1.00 0.00 C ATOM 440 OE1 GLN A 29 12.294 -6.062 0.891 1.00 0.00 O ATOM 441 NE2 GLN A 29 12.161 -7.710 2.317 1.00 0.00 N ATOM 0 H GLN A 29 9.114 -5.477 -2.574 1.00 0.00 H new ATOM 0 HA GLN A 29 9.362 -8.222 -1.594 1.00 0.00 H new ATOM 0 HB2 GLN A 29 10.923 -6.316 -1.006 1.00 0.00 H new ATOM 0 HB3 GLN A 29 9.606 -5.532 -0.158 1.00 0.00 H new ATOM 0 HG2 GLN A 29 9.519 -7.192 1.534 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.254 -8.416 0.517 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.633 -8.496 2.696 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.078 -7.480 2.700 1.00 0.00 H new ATOM 450 N LEU A 30 7.025 -6.240 -0.331 1.00 0.00 N ATOM 451 CA LEU A 30 5.717 -6.291 0.381 1.00 0.00 C ATOM 452 C LEU A 30 4.832 -7.371 -0.251 1.00 0.00 C ATOM 453 O LEU A 30 4.120 -8.088 0.427 1.00 0.00 O ATOM 454 CB LEU A 30 5.023 -4.929 0.273 1.00 0.00 C ATOM 455 CG LEU A 30 5.075 -4.209 1.626 1.00 0.00 C ATOM 456 CD1 LEU A 30 6.497 -4.285 2.182 1.00 0.00 C ATOM 457 CD2 LEU A 30 4.683 -2.742 1.429 1.00 0.00 C ATOM 0 H LEU A 30 7.362 -5.303 -0.552 1.00 0.00 H new ATOM 0 HA LEU A 30 5.884 -6.530 1.431 1.00 0.00 H new ATOM 0 HB2 LEU A 30 5.510 -4.322 -0.491 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.987 -5.062 -0.038 1.00 0.00 H new ATOM 0 HG LEU A 30 4.384 -4.682 2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 30 6.539 -3.774 3.144 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.781 -5.329 2.313 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.186 -3.806 1.486 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.718 -2.224 2.388 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.379 -2.269 0.736 1.00 0.00 H new ATOM 0 HD23 LEU A 30 3.673 -2.687 1.023 1.00 0.00 H new ATOM 469 N ASP A 31 4.867 -7.492 -1.549 1.00 0.00 N ATOM 470 CA ASP A 31 4.026 -8.519 -2.225 1.00 0.00 C ATOM 471 C ASP A 31 4.385 -9.909 -1.702 1.00 0.00 C ATOM 472 O ASP A 31 3.525 -10.694 -1.356 1.00 0.00 O ATOM 473 CB ASP A 31 4.275 -8.463 -3.735 1.00 0.00 C ATOM 474 CG ASP A 31 3.656 -9.690 -4.407 1.00 0.00 C ATOM 475 OD1 ASP A 31 2.498 -9.613 -4.783 1.00 0.00 O ATOM 476 OD2 ASP A 31 4.350 -10.685 -4.534 1.00 0.00 O ATOM 0 H ASP A 31 5.442 -6.924 -2.171 1.00 0.00 H new ATOM 0 HA ASP A 31 2.975 -8.318 -2.018 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.843 -7.553 -4.151 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.346 -8.428 -3.935 1.00 0.00 H new ATOM 481 N THR A 32 5.649 -10.219 -1.652 1.00 0.00 N ATOM 482 CA THR A 32 6.073 -11.560 -1.166 1.00 0.00 C ATOM 483 C THR A 32 5.663 -11.742 0.303 1.00 0.00 C ATOM 484 O THR A 32 5.531 -12.852 0.779 1.00 0.00 O ATOM 485 CB THR A 32 7.603 -11.691 -1.343 1.00 0.00 C ATOM 486 OG1 THR A 32 7.875 -12.687 -2.320 1.00 0.00 O ATOM 487 CG2 THR A 32 8.292 -12.076 -0.026 1.00 0.00 C ATOM 0 H THR A 32 6.410 -9.599 -1.928 1.00 0.00 H new ATOM 0 HA THR A 32 5.582 -12.343 -1.744 1.00 0.00 H new ATOM 0 HB THR A 32 7.993 -10.724 -1.661 1.00 0.00 H new ATOM 0 HG1 THR A 32 8.844 -12.774 -2.438 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.367 -12.159 -0.188 1.00 0.00 H new ATOM 0 HG22 THR A 32 8.097 -11.310 0.724 1.00 0.00 H new ATOM 0 HG23 THR A 32 7.903 -13.033 0.322 1.00 0.00 H new ATOM 495 N ILE A 33 5.467 -10.676 1.031 1.00 0.00 N ATOM 496 CA ILE A 33 5.079 -10.836 2.460 1.00 0.00 C ATOM 497 C ILE A 33 3.577 -11.128 2.559 1.00 0.00 C ATOM 498 O ILE A 33 3.123 -11.764 3.490 1.00 0.00 O ATOM 499 CB ILE A 33 5.455 -9.575 3.255 1.00 0.00 C ATOM 500 CG1 ILE A 33 5.508 -9.921 4.745 1.00 0.00 C ATOM 501 CG2 ILE A 33 4.439 -8.451 3.036 1.00 0.00 C ATOM 502 CD1 ILE A 33 6.871 -9.519 5.311 1.00 0.00 C ATOM 0 H ILE A 33 5.557 -9.714 0.703 1.00 0.00 H new ATOM 0 HA ILE A 33 5.621 -11.678 2.891 1.00 0.00 H new ATOM 0 HB ILE A 33 6.428 -9.228 2.906 1.00 0.00 H new ATOM 0 HG12 ILE A 33 4.712 -9.401 5.279 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.343 -10.989 4.888 1.00 0.00 H new ATOM 0 HG21 ILE A 33 4.736 -7.575 3.613 1.00 0.00 H new ATOM 0 HG22 ILE A 33 4.404 -8.194 1.977 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.453 -8.783 3.362 1.00 0.00 H new ATOM 0 HD11 ILE A 33 6.911 -9.764 6.372 1.00 0.00 H new ATOM 0 HD12 ILE A 33 7.658 -10.059 4.784 1.00 0.00 H new ATOM 0 HD13 ILE A 33 7.017 -8.447 5.181 1.00 0.00 H new ATOM 514 N PHE A 34 2.804 -10.692 1.597 1.00 0.00 N ATOM 515 CA PHE A 34 1.339 -10.979 1.639 1.00 0.00 C ATOM 516 C PHE A 34 0.986 -11.956 0.514 1.00 0.00 C ATOM 517 O PHE A 34 0.733 -13.120 0.754 1.00 0.00 O ATOM 518 CB PHE A 34 0.530 -9.693 1.452 1.00 0.00 C ATOM 519 CG PHE A 34 1.245 -8.538 2.097 1.00 0.00 C ATOM 520 CD1 PHE A 34 1.376 -8.489 3.485 1.00 0.00 C ATOM 521 CD2 PHE A 34 1.778 -7.516 1.303 1.00 0.00 C ATOM 522 CE1 PHE A 34 2.043 -7.420 4.084 1.00 0.00 C ATOM 523 CE2 PHE A 34 2.448 -6.445 1.902 1.00 0.00 C ATOM 524 CZ PHE A 34 2.584 -6.397 3.292 1.00 0.00 C ATOM 0 H PHE A 34 3.121 -10.154 0.790 1.00 0.00 H new ATOM 0 HA PHE A 34 1.096 -11.411 2.610 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.386 -9.495 0.390 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.461 -9.809 1.891 1.00 0.00 H new ATOM 0 HD1 PHE A 34 0.962 -9.278 4.095 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.672 -7.555 0.229 1.00 0.00 H new ATOM 0 HE1 PHE A 34 2.143 -7.380 5.159 1.00 0.00 H new ATOM 0 HE2 PHE A 34 2.860 -5.656 1.291 1.00 0.00 H new ATOM 0 HZ PHE A 34 3.105 -5.573 3.756 1.00 0.00 H new ATOM 534 N GLY A 35 0.978 -11.484 -0.710 1.00 0.00 N ATOM 535 CA GLY A 35 0.647 -12.362 -1.871 1.00 0.00 C ATOM 536 C GLY A 35 -0.397 -13.400 -1.464 1.00 0.00 C ATOM 537 O GLY A 35 -0.076 -14.544 -1.206 1.00 0.00 O ATOM 0 H GLY A 35 1.190 -10.516 -0.954 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.269 -11.759 -2.697 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.548 -12.861 -2.228 1.00 0.00 H new ATOM 541 N LYS A 36 -1.646 -13.020 -1.394 1.00 0.00 N ATOM 542 CA LYS A 36 -2.682 -14.012 -0.992 1.00 0.00 C ATOM 543 C LYS A 36 -4.093 -13.434 -1.162 1.00 0.00 C ATOM 544 O LYS A 36 -5.013 -13.824 -0.471 1.00 0.00 O ATOM 545 CB LYS A 36 -2.461 -14.398 0.471 1.00 0.00 C ATOM 546 CG LYS A 36 -2.529 -15.919 0.609 1.00 0.00 C ATOM 547 CD LYS A 36 -3.989 -16.349 0.755 1.00 0.00 C ATOM 548 CE LYS A 36 -4.383 -17.225 -0.435 1.00 0.00 C ATOM 549 NZ LYS A 36 -5.663 -17.928 -0.133 1.00 0.00 N ATOM 0 H LYS A 36 -1.988 -12.080 -1.595 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.594 -14.890 -1.632 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.492 -14.033 0.813 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -3.218 -13.930 1.101 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.083 -16.395 -0.264 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.954 -16.243 1.477 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -4.126 -16.899 1.686 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.634 -15.472 0.804 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -4.494 -16.613 -1.330 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.597 -17.951 -0.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -5.931 -18.524 -0.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -5.541 -18.524 0.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -6.411 -17.227 0.044 1.00 0.00 H new ATOM 563 N TYR A 37 -4.286 -12.521 -2.077 1.00 0.00 N ATOM 564 CA TYR A 37 -5.656 -11.953 -2.273 1.00 0.00 C ATOM 565 C TYR A 37 -5.990 -11.909 -3.770 1.00 0.00 C ATOM 566 O TYR A 37 -6.422 -12.890 -4.344 1.00 0.00 O ATOM 567 CB TYR A 37 -5.744 -10.539 -1.675 1.00 0.00 C ATOM 568 CG TYR A 37 -4.361 -9.959 -1.503 1.00 0.00 C ATOM 569 CD1 TYR A 37 -3.534 -10.419 -0.471 1.00 0.00 C ATOM 570 CD2 TYR A 37 -3.905 -8.961 -2.372 1.00 0.00 C ATOM 571 CE1 TYR A 37 -2.253 -9.882 -0.308 1.00 0.00 C ATOM 572 CE2 TYR A 37 -2.624 -8.426 -2.211 1.00 0.00 C ATOM 573 CZ TYR A 37 -1.799 -8.884 -1.180 1.00 0.00 C ATOM 574 OH TYR A 37 -0.536 -8.353 -1.029 1.00 0.00 O ATOM 0 H TYR A 37 -3.564 -12.146 -2.692 1.00 0.00 H new ATOM 0 HA TYR A 37 -6.376 -12.592 -1.761 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -6.337 -9.897 -2.326 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -6.254 -10.574 -0.712 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -3.886 -11.189 0.200 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -4.543 -8.604 -3.167 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -1.615 -10.236 0.488 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -2.271 -7.658 -2.884 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.382 -7.673 -1.718 1.00 0.00 H new ATOM 584 N GLY A 38 -5.798 -10.785 -4.409 1.00 0.00 N ATOM 585 CA GLY A 38 -6.108 -10.690 -5.866 1.00 0.00 C ATOM 586 C GLY A 38 -4.817 -10.479 -6.647 1.00 0.00 C ATOM 587 O GLY A 38 -3.730 -10.624 -6.125 1.00 0.00 O ATOM 0 H GLY A 38 -5.440 -9.929 -3.985 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -6.605 -11.600 -6.203 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.796 -9.864 -6.049 1.00 0.00 H new ATOM 591 N SER A 39 -4.927 -10.132 -7.897 1.00 0.00 N ATOM 592 CA SER A 39 -3.705 -9.902 -8.707 1.00 0.00 C ATOM 593 C SER A 39 -3.164 -8.508 -8.399 1.00 0.00 C ATOM 594 O SER A 39 -3.379 -7.583 -9.156 1.00 0.00 O ATOM 595 CB SER A 39 -4.045 -10.002 -10.194 1.00 0.00 C ATOM 596 OG SER A 39 -2.856 -10.259 -10.929 1.00 0.00 O ATOM 0 H SER A 39 -5.809 -9.998 -8.391 1.00 0.00 H new ATOM 0 HA SER A 39 -2.955 -10.654 -8.463 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.769 -10.799 -10.361 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.506 -9.076 -10.537 1.00 0.00 H new ATOM 0 HG SER A 39 -3.069 -10.326 -11.883 1.00 0.00 H new ATOM 602 N ILE A 40 -2.479 -8.362 -7.282 1.00 0.00 N ATOM 603 CA ILE A 40 -1.908 -7.029 -6.878 1.00 0.00 C ATOM 604 C ILE A 40 -1.696 -6.150 -8.136 1.00 0.00 C ATOM 605 O ILE A 40 -1.174 -6.603 -9.136 1.00 0.00 O ATOM 606 CB ILE A 40 -0.580 -7.229 -6.105 1.00 0.00 C ATOM 607 CG1 ILE A 40 -0.189 -8.719 -6.017 1.00 0.00 C ATOM 608 CG2 ILE A 40 -0.740 -6.668 -4.694 1.00 0.00 C ATOM 609 CD1 ILE A 40 -0.801 -9.349 -4.759 1.00 0.00 C ATOM 0 H ILE A 40 -2.289 -9.119 -6.626 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.608 -6.520 -6.216 1.00 0.00 H new ATOM 0 HB ILE A 40 0.210 -6.706 -6.643 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.537 -9.248 -6.904 1.00 0.00 H new ATOM 0 HG13 ILE A 40 0.896 -8.818 -5.992 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.189 -6.804 -4.141 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.977 -5.606 -4.750 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.546 -7.194 -4.183 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -0.520 -10.401 -4.705 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -0.432 -8.829 -3.875 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.887 -9.266 -4.802 1.00 0.00 H new ATOM 621 N VAL A 41 -2.160 -4.915 -8.113 1.00 0.00 N ATOM 622 CA VAL A 41 -2.056 -4.033 -9.327 1.00 0.00 C ATOM 623 C VAL A 41 -0.892 -3.027 -9.274 1.00 0.00 C ATOM 624 O VAL A 41 -1.109 -1.839 -9.369 1.00 0.00 O ATOM 625 CB VAL A 41 -3.351 -3.243 -9.472 1.00 0.00 C ATOM 626 CG1 VAL A 41 -4.541 -4.183 -9.375 1.00 0.00 C ATOM 627 CG2 VAL A 41 -3.449 -2.206 -8.352 1.00 0.00 C ATOM 0 H VAL A 41 -2.606 -4.481 -7.305 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.872 -4.696 -10.172 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.354 -2.744 -10.441 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.464 -3.613 -9.479 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.482 -4.927 -10.169 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.531 -4.684 -8.407 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.376 -1.642 -8.458 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.440 -2.711 -7.386 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.601 -1.524 -8.412 1.00 0.00 H new ATOM 637 N GLN A 42 0.324 -3.496 -9.146 1.00 0.00 N ATOM 638 CA GLN A 42 1.526 -2.582 -9.138 1.00 0.00 C ATOM 639 C GLN A 42 1.944 -2.143 -7.729 1.00 0.00 C ATOM 640 O GLN A 42 1.224 -1.463 -7.024 1.00 0.00 O ATOM 641 CB GLN A 42 1.256 -1.333 -9.981 1.00 0.00 C ATOM 642 CG GLN A 42 2.572 -0.606 -10.261 1.00 0.00 C ATOM 643 CD GLN A 42 2.393 0.891 -10.002 1.00 0.00 C ATOM 644 OE1 GLN A 42 1.470 1.296 -9.324 1.00 0.00 O ATOM 645 NE2 GLN A 42 3.244 1.736 -10.517 1.00 0.00 N ATOM 0 H GLN A 42 0.546 -4.486 -9.045 1.00 0.00 H new ATOM 0 HA GLN A 42 2.345 -3.163 -9.562 1.00 0.00 H new ATOM 0 HB2 GLN A 42 0.777 -1.612 -10.919 1.00 0.00 H new ATOM 0 HB3 GLN A 42 0.568 -0.670 -9.457 1.00 0.00 H new ATOM 0 HG2 GLN A 42 3.362 -1.004 -9.624 1.00 0.00 H new ATOM 0 HG3 GLN A 42 2.880 -0.773 -11.293 1.00 0.00 H new ATOM 0 HE21 GLN A 42 4.019 1.396 -11.086 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.134 2.736 -10.350 1.00 0.00 H new ATOM 654 N LYS A 43 3.144 -2.512 -7.350 1.00 0.00 N ATOM 655 CA LYS A 43 3.712 -2.120 -6.025 1.00 0.00 C ATOM 656 C LYS A 43 4.929 -1.229 -6.312 1.00 0.00 C ATOM 657 O LYS A 43 5.696 -1.514 -7.210 1.00 0.00 O ATOM 658 CB LYS A 43 4.180 -3.373 -5.269 1.00 0.00 C ATOM 659 CG LYS A 43 3.447 -3.482 -3.932 1.00 0.00 C ATOM 660 CD LYS A 43 4.015 -4.657 -3.132 1.00 0.00 C ATOM 661 CE LYS A 43 2.881 -5.352 -2.379 1.00 0.00 C ATOM 662 NZ LYS A 43 2.078 -6.165 -3.332 1.00 0.00 N ATOM 0 H LYS A 43 3.768 -3.083 -7.920 1.00 0.00 H new ATOM 0 HA LYS A 43 2.967 -1.603 -5.420 1.00 0.00 H new ATOM 0 HB2 LYS A 43 3.991 -4.262 -5.870 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.256 -3.325 -5.100 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.559 -2.556 -3.368 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.380 -3.626 -4.101 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.508 -5.362 -3.801 1.00 0.00 H new ATOM 0 HD3 LYS A 43 4.769 -4.303 -2.430 1.00 0.00 H new ATOM 0 HE2 LYS A 43 3.288 -5.989 -1.594 1.00 0.00 H new ATOM 0 HE3 LYS A 43 2.247 -4.612 -1.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 1.121 -5.766 -3.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 2.533 -6.153 -4.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.018 -7.145 -2.988 1.00 0.00 H new ATOM 676 N ASN A 44 5.127 -0.158 -5.592 1.00 0.00 N ATOM 677 CA ASN A 44 6.311 0.698 -5.905 1.00 0.00 C ATOM 678 C ASN A 44 6.808 1.435 -4.660 1.00 0.00 C ATOM 679 O ASN A 44 6.210 1.383 -3.604 1.00 0.00 O ATOM 680 CB ASN A 44 5.930 1.720 -6.976 1.00 0.00 C ATOM 681 CG ASN A 44 6.463 1.259 -8.333 1.00 0.00 C ATOM 682 OD1 ASN A 44 5.732 1.211 -9.302 1.00 0.00 O ATOM 683 ND2 ASN A 44 7.716 0.912 -8.445 1.00 0.00 N ATOM 0 H ASN A 44 4.539 0.157 -4.820 1.00 0.00 H new ATOM 0 HA ASN A 44 7.112 0.053 -6.266 1.00 0.00 H new ATOM 0 HB2 ASN A 44 4.847 1.832 -7.018 1.00 0.00 H new ATOM 0 HB3 ASN A 44 6.342 2.697 -6.724 1.00 0.00 H new ATOM 0 HD21 ASN A 44 8.081 0.601 -9.345 1.00 0.00 H new ATOM 0 HD22 ASN A 44 8.331 0.952 -7.632 1.00 0.00 H new ATOM 690 N ILE A 45 7.911 2.124 -4.794 1.00 0.00 N ATOM 691 CA ILE A 45 8.482 2.880 -3.644 1.00 0.00 C ATOM 692 C ILE A 45 9.137 4.161 -4.169 1.00 0.00 C ATOM 693 O ILE A 45 10.146 4.119 -4.843 1.00 0.00 O ATOM 694 CB ILE A 45 9.541 2.021 -2.946 1.00 0.00 C ATOM 695 CG1 ILE A 45 8.857 0.903 -2.155 1.00 0.00 C ATOM 696 CG2 ILE A 45 10.358 2.890 -1.990 1.00 0.00 C ATOM 697 CD1 ILE A 45 9.917 0.050 -1.457 1.00 0.00 C ATOM 0 H ILE A 45 8.445 2.195 -5.660 1.00 0.00 H new ATOM 0 HA ILE A 45 7.691 3.129 -2.936 1.00 0.00 H new ATOM 0 HB ILE A 45 10.201 1.585 -3.696 1.00 0.00 H new ATOM 0 HG12 ILE A 45 8.175 1.329 -1.419 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.259 0.284 -2.823 1.00 0.00 H new ATOM 0 HG21 ILE A 45 11.111 2.277 -1.494 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.849 3.685 -2.551 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.697 3.328 -1.242 1.00 0.00 H new ATOM 0 HD11 ILE A 45 9.430 -0.746 -0.894 1.00 0.00 H new ATOM 0 HD12 ILE A 45 10.581 -0.387 -2.203 1.00 0.00 H new ATOM 0 HD13 ILE A 45 10.496 0.674 -0.776 1.00 0.00 H new ATOM 709 N LEU A 46 8.570 5.298 -3.871 1.00 0.00 N ATOM 710 CA LEU A 46 9.166 6.574 -4.362 1.00 0.00 C ATOM 711 C LEU A 46 9.964 7.235 -3.236 1.00 0.00 C ATOM 712 O LEU A 46 9.594 7.176 -2.080 1.00 0.00 O ATOM 713 CB LEU A 46 8.047 7.515 -4.816 1.00 0.00 C ATOM 714 CG LEU A 46 7.064 6.747 -5.699 1.00 0.00 C ATOM 715 CD1 LEU A 46 5.819 7.601 -5.939 1.00 0.00 C ATOM 716 CD2 LEU A 46 7.730 6.427 -7.040 1.00 0.00 C ATOM 0 H LEU A 46 7.723 5.399 -3.311 1.00 0.00 H new ATOM 0 HA LEU A 46 9.831 6.366 -5.200 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.529 7.927 -3.950 1.00 0.00 H new ATOM 0 HB3 LEU A 46 8.466 8.357 -5.367 1.00 0.00 H new ATOM 0 HG LEU A 46 6.777 5.819 -5.204 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.118 7.053 -6.569 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.346 7.831 -4.984 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.104 8.529 -6.435 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.031 5.879 -7.672 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.016 7.355 -7.535 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.618 5.819 -6.869 1.00 0.00 H new ATOM 728 N ARG A 47 11.061 7.866 -3.564 1.00 0.00 N ATOM 729 CA ARG A 47 11.881 8.530 -2.510 1.00 0.00 C ATOM 730 C ARG A 47 11.986 10.025 -2.815 1.00 0.00 C ATOM 731 O ARG A 47 11.169 10.814 -2.381 1.00 0.00 O ATOM 732 CB ARG A 47 13.289 7.916 -2.463 1.00 0.00 C ATOM 733 CG ARG A 47 13.559 7.098 -3.730 1.00 0.00 C ATOM 734 CD ARG A 47 14.993 6.565 -3.698 1.00 0.00 C ATOM 735 NE ARG A 47 15.376 6.094 -5.058 1.00 0.00 N ATOM 736 CZ ARG A 47 16.544 5.544 -5.257 1.00 0.00 C ATOM 737 NH1 ARG A 47 17.601 6.295 -5.408 1.00 0.00 N ATOM 738 NH2 ARG A 47 16.656 4.245 -5.304 1.00 0.00 N ATOM 0 H ARG A 47 11.423 7.950 -4.514 1.00 0.00 H new ATOM 0 HA ARG A 47 11.400 8.383 -1.543 1.00 0.00 H new ATOM 0 HB2 ARG A 47 14.034 8.706 -2.367 1.00 0.00 H new ATOM 0 HB3 ARG A 47 13.385 7.279 -1.584 1.00 0.00 H new ATOM 0 HG2 ARG A 47 12.853 6.270 -3.798 1.00 0.00 H new ATOM 0 HG3 ARG A 47 13.410 7.718 -4.614 1.00 0.00 H new ATOM 0 HD2 ARG A 47 15.676 7.347 -3.366 1.00 0.00 H new ATOM 0 HD3 ARG A 47 15.073 5.747 -2.982 1.00 0.00 H new ATOM 0 HE ARG A 47 14.725 6.201 -5.836 1.00 0.00 H new ATOM 0 HH11 ARG A 47 17.515 7.311 -5.371 1.00 0.00 H new ATOM 0 HH12 ARG A 47 18.513 5.866 -5.563 1.00 0.00 H new ATOM 0 HH21 ARG A 47 15.831 3.657 -5.185 1.00 0.00 H new ATOM 0 HH22 ARG A 47 17.569 3.817 -5.459 1.00 0.00 H new ATOM 752 N ASP A 48 12.986 10.425 -3.551 1.00 0.00 N ATOM 753 CA ASP A 48 13.141 11.872 -3.875 1.00 0.00 C ATOM 754 C ASP A 48 12.555 12.157 -5.261 1.00 0.00 C ATOM 755 O ASP A 48 12.820 11.453 -6.215 1.00 0.00 O ATOM 756 CB ASP A 48 14.627 12.239 -3.862 1.00 0.00 C ATOM 757 CG ASP A 48 15.328 11.485 -2.730 1.00 0.00 C ATOM 758 OD1 ASP A 48 15.639 10.320 -2.922 1.00 0.00 O ATOM 759 OD2 ASP A 48 15.547 12.085 -1.691 1.00 0.00 O ATOM 0 H ASP A 48 13.702 9.813 -3.942 1.00 0.00 H new ATOM 0 HA ASP A 48 12.611 12.468 -3.132 1.00 0.00 H new ATOM 0 HB2 ASP A 48 15.083 11.986 -4.819 1.00 0.00 H new ATOM 0 HB3 ASP A 48 14.746 13.314 -3.726 1.00 0.00 H new ATOM 764 N LYS A 49 11.758 13.187 -5.380 1.00 0.00 N ATOM 765 CA LYS A 49 11.154 13.517 -6.704 1.00 0.00 C ATOM 766 C LYS A 49 11.044 15.038 -6.858 1.00 0.00 C ATOM 767 O LYS A 49 10.141 15.540 -7.497 1.00 0.00 O ATOM 768 CB LYS A 49 9.759 12.897 -6.799 1.00 0.00 C ATOM 769 CG LYS A 49 9.858 11.510 -7.437 1.00 0.00 C ATOM 770 CD LYS A 49 8.477 10.853 -7.451 1.00 0.00 C ATOM 771 CE LYS A 49 7.467 11.799 -8.099 1.00 0.00 C ATOM 772 NZ LYS A 49 6.642 11.042 -9.084 1.00 0.00 N ATOM 0 H LYS A 49 11.500 13.813 -4.618 1.00 0.00 H new ATOM 0 HA LYS A 49 11.787 13.117 -7.496 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.315 12.821 -5.806 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.105 13.536 -7.393 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.243 11.593 -8.453 1.00 0.00 H new ATOM 0 HG3 LYS A 49 10.561 10.891 -6.879 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.516 9.913 -8.002 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.166 10.614 -6.434 1.00 0.00 H new ATOM 0 HE2 LYS A 49 6.827 12.243 -7.337 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.986 12.618 -8.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 5.954 11.684 -9.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.260 10.638 -9.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 6.136 10.275 -8.597 1.00 0.00 H new ATOM 786 N LEU A 50 11.955 15.775 -6.283 1.00 0.00 N ATOM 787 CA LEU A 50 11.898 17.261 -6.402 1.00 0.00 C ATOM 788 C LEU A 50 13.311 17.836 -6.286 1.00 0.00 C ATOM 789 O LEU A 50 13.840 18.402 -7.222 1.00 0.00 O ATOM 790 CB LEU A 50 11.026 17.833 -5.282 1.00 0.00 C ATOM 791 CG LEU A 50 10.275 19.066 -5.791 1.00 0.00 C ATOM 792 CD1 LEU A 50 11.254 20.012 -6.488 1.00 0.00 C ATOM 793 CD2 LEU A 50 9.195 18.633 -6.784 1.00 0.00 C ATOM 0 H LEU A 50 12.736 15.413 -5.736 1.00 0.00 H new ATOM 0 HA LEU A 50 11.471 17.529 -7.368 1.00 0.00 H new ATOM 0 HB2 LEU A 50 10.317 17.079 -4.939 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.646 18.100 -4.426 1.00 0.00 H new ATOM 0 HG LEU A 50 9.812 19.579 -4.948 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.717 20.889 -6.850 1.00 0.00 H new ATOM 0 HD12 LEU A 50 12.024 20.323 -5.782 1.00 0.00 H new ATOM 0 HD13 LEU A 50 11.719 19.499 -7.330 1.00 0.00 H new ATOM 0 HD21 LEU A 50 8.661 19.511 -7.146 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.659 18.118 -7.625 1.00 0.00 H new ATOM 0 HD23 LEU A 50 8.494 17.960 -6.289 1.00 0.00 H new ATOM 805 N THR A 51 13.924 17.700 -5.144 1.00 0.00 N ATOM 806 CA THR A 51 15.301 18.242 -4.968 1.00 0.00 C ATOM 807 C THR A 51 16.054 17.398 -3.938 1.00 0.00 C ATOM 808 O THR A 51 16.918 17.884 -3.236 1.00 0.00 O ATOM 809 CB THR A 51 15.222 19.690 -4.479 1.00 0.00 C ATOM 810 OG1 THR A 51 14.379 20.435 -5.347 1.00 0.00 O ATOM 811 CG2 THR A 51 16.622 20.305 -4.472 1.00 0.00 C ATOM 0 H THR A 51 13.532 17.237 -4.324 1.00 0.00 H new ATOM 0 HA THR A 51 15.828 18.208 -5.922 1.00 0.00 H new ATOM 0 HB THR A 51 14.814 19.711 -3.469 1.00 0.00 H new ATOM 0 HG1 THR A 51 14.326 21.362 -5.035 1.00 0.00 H new ATOM 0 HG21 THR A 51 16.565 21.336 -4.124 1.00 0.00 H new ATOM 0 HG22 THR A 51 17.268 19.732 -3.806 1.00 0.00 H new ATOM 0 HG23 THR A 51 17.033 20.285 -5.481 1.00 0.00 H new ATOM 819 N GLY A 52 15.736 16.135 -3.844 1.00 0.00 N ATOM 820 CA GLY A 52 16.438 15.260 -2.863 1.00 0.00 C ATOM 821 C GLY A 52 15.945 15.566 -1.447 1.00 0.00 C ATOM 822 O GLY A 52 16.717 15.893 -0.569 1.00 0.00 O ATOM 0 H GLY A 52 15.020 15.672 -4.404 1.00 0.00 H new ATOM 0 HA2 GLY A 52 16.257 14.212 -3.102 1.00 0.00 H new ATOM 0 HA3 GLY A 52 17.514 15.420 -2.925 1.00 0.00 H new ATOM 826 N ARG A 53 14.665 15.456 -1.214 1.00 0.00 N ATOM 827 CA ARG A 53 14.131 15.736 0.149 1.00 0.00 C ATOM 828 C ARG A 53 13.876 14.413 0.875 1.00 0.00 C ATOM 829 O ARG A 53 14.097 13.352 0.326 1.00 0.00 O ATOM 830 CB ARG A 53 12.823 16.521 0.037 1.00 0.00 C ATOM 831 CG ARG A 53 13.129 18.020 0.024 1.00 0.00 C ATOM 832 CD ARG A 53 11.851 18.807 0.314 1.00 0.00 C ATOM 833 NE ARG A 53 11.285 19.320 -0.965 1.00 0.00 N ATOM 834 CZ ARG A 53 10.072 18.994 -1.317 1.00 0.00 C ATOM 835 NH1 ARG A 53 9.056 19.677 -0.863 1.00 0.00 N ATOM 836 NH2 ARG A 53 9.874 17.984 -2.120 1.00 0.00 N ATOM 0 H ARG A 53 13.968 15.185 -1.907 1.00 0.00 H new ATOM 0 HA ARG A 53 14.856 16.325 0.710 1.00 0.00 H new ATOM 0 HB2 ARG A 53 12.294 16.239 -0.873 1.00 0.00 H new ATOM 0 HB3 ARG A 53 12.168 16.280 0.874 1.00 0.00 H new ATOM 0 HG2 ARG A 53 13.889 18.253 0.770 1.00 0.00 H new ATOM 0 HG3 ARG A 53 13.535 18.310 -0.945 1.00 0.00 H new ATOM 0 HD2 ARG A 53 11.124 18.169 0.816 1.00 0.00 H new ATOM 0 HD3 ARG A 53 12.066 19.636 0.988 1.00 0.00 H new ATOM 0 HE ARG A 53 11.845 19.925 -1.565 1.00 0.00 H new ATOM 0 HH11 ARG A 53 9.211 20.465 -0.234 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.107 19.423 -1.138 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.668 17.449 -2.472 1.00 0.00 H new ATOM 0 HH22 ARG A 53 8.925 17.729 -2.395 1.00 0.00 H new ATOM 850 N PRO A 54 13.417 14.522 2.092 1.00 0.00 N ATOM 851 CA PRO A 54 13.146 13.288 2.863 1.00 0.00 C ATOM 852 C PRO A 54 11.637 13.068 3.009 1.00 0.00 C ATOM 853 O PRO A 54 10.939 13.861 3.611 1.00 0.00 O ATOM 854 CB PRO A 54 13.790 13.539 4.227 1.00 0.00 C ATOM 855 CG PRO A 54 13.889 15.068 4.380 1.00 0.00 C ATOM 856 CD PRO A 54 13.809 15.657 2.961 1.00 0.00 C ATOM 0 HA PRO A 54 13.543 12.397 2.377 1.00 0.00 H new ATOM 0 HB2 PRO A 54 13.189 13.106 5.027 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.776 13.077 4.283 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.080 15.448 5.004 1.00 0.00 H new ATOM 0 HG3 PRO A 54 14.824 15.349 4.864 1.00 0.00 H new ATOM 0 HD2 PRO A 54 13.077 16.463 2.910 1.00 0.00 H new ATOM 0 HD3 PRO A 54 14.767 16.076 2.654 1.00 0.00 H new ATOM 864 N ARG A 55 11.131 11.996 2.465 1.00 0.00 N ATOM 865 CA ARG A 55 9.670 11.721 2.575 1.00 0.00 C ATOM 866 C ARG A 55 9.449 10.217 2.746 1.00 0.00 C ATOM 867 O ARG A 55 8.968 9.763 3.765 1.00 0.00 O ATOM 868 CB ARG A 55 8.961 12.199 1.305 1.00 0.00 C ATOM 869 CG ARG A 55 7.482 12.453 1.609 1.00 0.00 C ATOM 870 CD ARG A 55 6.958 13.568 0.701 1.00 0.00 C ATOM 871 NE ARG A 55 6.165 14.537 1.511 1.00 0.00 N ATOM 872 CZ ARG A 55 4.924 14.269 1.814 1.00 0.00 C ATOM 873 NH1 ARG A 55 4.647 13.594 2.894 1.00 0.00 N ATOM 874 NH2 ARG A 55 3.960 14.680 1.037 1.00 0.00 N ATOM 0 H ARG A 55 11.666 11.298 1.949 1.00 0.00 H new ATOM 0 HA ARG A 55 9.264 12.251 3.437 1.00 0.00 H new ATOM 0 HB2 ARG A 55 9.429 13.112 0.936 1.00 0.00 H new ATOM 0 HB3 ARG A 55 9.058 11.451 0.518 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.906 11.541 1.452 1.00 0.00 H new ATOM 0 HG3 ARG A 55 7.358 12.733 2.655 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.790 14.078 0.216 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.338 13.146 -0.090 1.00 0.00 H new ATOM 0 HE ARG A 55 6.592 15.408 1.828 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.400 13.275 3.503 1.00 0.00 H new ATOM 0 HH12 ARG A 55 3.677 13.385 3.130 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.176 15.211 0.193 1.00 0.00 H new ATOM 0 HH22 ARG A 55 2.990 14.471 1.273 1.00 0.00 H new ATOM 888 N GLY A 56 9.796 9.441 1.757 1.00 0.00 N ATOM 889 CA GLY A 56 9.608 7.967 1.865 1.00 0.00 C ATOM 890 C GLY A 56 8.136 7.620 1.632 1.00 0.00 C ATOM 891 O GLY A 56 7.301 7.806 2.493 1.00 0.00 O ATOM 0 H GLY A 56 10.202 9.764 0.879 1.00 0.00 H new ATOM 0 HA2 GLY A 56 10.233 7.456 1.133 1.00 0.00 H new ATOM 0 HA3 GLY A 56 9.922 7.621 2.850 1.00 0.00 H new ATOM 895 N VAL A 57 7.813 7.115 0.472 1.00 0.00 N ATOM 896 CA VAL A 57 6.395 6.755 0.188 1.00 0.00 C ATOM 897 C VAL A 57 6.348 5.507 -0.696 1.00 0.00 C ATOM 898 O VAL A 57 7.337 5.109 -1.278 1.00 0.00 O ATOM 899 CB VAL A 57 5.708 7.915 -0.535 1.00 0.00 C ATOM 900 CG1 VAL A 57 5.830 9.187 0.306 1.00 0.00 C ATOM 901 CG2 VAL A 57 6.376 8.139 -1.893 1.00 0.00 C ATOM 0 H VAL A 57 8.468 6.937 -0.289 1.00 0.00 H new ATOM 0 HA VAL A 57 5.880 6.554 1.127 1.00 0.00 H new ATOM 0 HB VAL A 57 4.655 7.675 -0.682 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.340 10.013 -0.210 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.354 9.030 1.274 1.00 0.00 H new ATOM 0 HG13 VAL A 57 6.883 9.425 0.454 1.00 0.00 H new ATOM 0 HG21 VAL A 57 5.886 8.966 -2.408 1.00 0.00 H new ATOM 0 HG22 VAL A 57 7.429 8.377 -1.745 1.00 0.00 H new ATOM 0 HG23 VAL A 57 6.289 7.234 -2.495 1.00 0.00 H new ATOM 911 N ALA A 58 5.204 4.884 -0.802 1.00 0.00 N ATOM 912 CA ALA A 58 5.098 3.663 -1.650 1.00 0.00 C ATOM 913 C ALA A 58 3.644 3.452 -2.077 1.00 0.00 C ATOM 914 O ALA A 58 2.750 4.166 -1.667 1.00 0.00 O ATOM 915 CB ALA A 58 5.570 2.446 -0.854 1.00 0.00 C ATOM 0 H ALA A 58 4.341 5.168 -0.339 1.00 0.00 H new ATOM 0 HA ALA A 58 5.721 3.788 -2.535 1.00 0.00 H new ATOM 0 HB1 ALA A 58 5.492 1.553 -1.474 1.00 0.00 H new ATOM 0 HB2 ALA A 58 6.607 2.589 -0.552 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.947 2.327 0.033 1.00 0.00 H new ATOM 921 N PHE A 59 3.405 2.472 -2.903 1.00 0.00 N ATOM 922 CA PHE A 59 2.017 2.202 -3.371 1.00 0.00 C ATOM 923 C PHE A 59 1.803 0.689 -3.448 1.00 0.00 C ATOM 924 O PHE A 59 2.287 0.039 -4.351 1.00 0.00 O ATOM 925 CB PHE A 59 1.840 2.813 -4.766 1.00 0.00 C ATOM 926 CG PHE A 59 0.413 3.269 -4.966 1.00 0.00 C ATOM 927 CD1 PHE A 59 -0.263 3.935 -3.939 1.00 0.00 C ATOM 928 CD2 PHE A 59 -0.231 3.032 -6.187 1.00 0.00 C ATOM 929 CE1 PHE A 59 -1.582 4.365 -4.130 1.00 0.00 C ATOM 930 CE2 PHE A 59 -1.551 3.460 -6.378 1.00 0.00 C ATOM 931 CZ PHE A 59 -2.225 4.127 -5.350 1.00 0.00 C ATOM 0 H PHE A 59 4.116 1.843 -3.276 1.00 0.00 H new ATOM 0 HA PHE A 59 1.295 2.639 -2.681 1.00 0.00 H new ATOM 0 HB2 PHE A 59 2.519 3.657 -4.889 1.00 0.00 H new ATOM 0 HB3 PHE A 59 2.104 2.079 -5.527 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.233 4.118 -2.997 1.00 0.00 H new ATOM 0 HD2 PHE A 59 0.290 2.519 -6.982 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -2.103 4.880 -3.336 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -2.048 3.275 -7.319 1.00 0.00 H new ATOM 0 HZ PHE A 59 -3.242 4.459 -5.498 1.00 0.00 H new ATOM 941 N VAL A 60 1.083 0.113 -2.518 1.00 0.00 N ATOM 942 CA VAL A 60 0.861 -1.360 -2.586 1.00 0.00 C ATOM 943 C VAL A 60 -0.215 -1.629 -3.627 1.00 0.00 C ATOM 944 O VAL A 60 -1.111 -0.832 -3.838 1.00 0.00 O ATOM 945 CB VAL A 60 0.425 -1.912 -1.209 1.00 0.00 C ATOM 946 CG1 VAL A 60 -0.622 -3.035 -1.366 1.00 0.00 C ATOM 947 CG2 VAL A 60 1.637 -2.498 -0.491 1.00 0.00 C ATOM 0 H VAL A 60 0.647 0.590 -1.729 1.00 0.00 H new ATOM 0 HA VAL A 60 1.788 -1.861 -2.864 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.009 -1.089 -0.640 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.910 -3.404 -0.382 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.501 -2.644 -1.878 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -0.195 -3.851 -1.949 1.00 0.00 H new ATOM 0 HG21 VAL A 60 1.331 -2.888 0.480 1.00 0.00 H new ATOM 0 HG22 VAL A 60 2.059 -3.305 -1.089 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.388 -1.720 -0.350 1.00 0.00 H new ATOM 957 N ARG A 61 -0.117 -2.747 -4.273 1.00 0.00 N ATOM 958 CA ARG A 61 -1.102 -3.106 -5.316 1.00 0.00 C ATOM 959 C ARG A 61 -2.324 -3.778 -4.679 1.00 0.00 C ATOM 960 O ARG A 61 -2.210 -4.749 -3.963 1.00 0.00 O ATOM 961 CB ARG A 61 -0.470 -4.077 -6.313 1.00 0.00 C ATOM 962 CG ARG A 61 1.021 -4.342 -6.030 1.00 0.00 C ATOM 963 CD ARG A 61 1.635 -5.089 -7.225 1.00 0.00 C ATOM 964 NE ARG A 61 2.604 -6.112 -6.748 1.00 0.00 N ATOM 965 CZ ARG A 61 3.764 -6.225 -7.333 1.00 0.00 C ATOM 966 NH1 ARG A 61 3.902 -5.858 -8.579 1.00 0.00 N ATOM 967 NH2 ARG A 61 4.784 -6.703 -6.675 1.00 0.00 N ATOM 0 H ARG A 61 0.616 -3.439 -4.120 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.412 -2.196 -5.829 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -1.013 -5.022 -6.286 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -0.578 -3.676 -7.321 1.00 0.00 H new ATOM 0 HG2 ARG A 61 1.545 -3.401 -5.865 1.00 0.00 H new ATOM 0 HG3 ARG A 61 1.132 -4.932 -5.120 1.00 0.00 H new ATOM 0 HD2 ARG A 61 0.848 -5.567 -7.808 1.00 0.00 H new ATOM 0 HD3 ARG A 61 2.137 -4.382 -7.886 1.00 0.00 H new ATOM 0 HE ARG A 61 2.362 -6.722 -5.967 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.104 -5.484 -9.092 1.00 0.00 H new ATOM 0 HH12 ARG A 61 4.808 -5.945 -9.039 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.675 -6.989 -5.702 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.691 -6.791 -7.134 1.00 0.00 H new ATOM 981 N TYR A 62 -3.496 -3.273 -4.941 1.00 0.00 N ATOM 982 CA TYR A 62 -4.729 -3.891 -4.368 1.00 0.00 C ATOM 983 C TYR A 62 -5.937 -3.372 -5.146 1.00 0.00 C ATOM 984 O TYR A 62 -5.939 -2.251 -5.578 1.00 0.00 O ATOM 985 CB TYR A 62 -4.864 -3.498 -2.894 1.00 0.00 C ATOM 986 CG TYR A 62 -4.609 -4.704 -2.021 1.00 0.00 C ATOM 987 CD1 TYR A 62 -5.662 -5.560 -1.676 1.00 0.00 C ATOM 988 CD2 TYR A 62 -3.317 -4.963 -1.553 1.00 0.00 C ATOM 989 CE1 TYR A 62 -5.420 -6.675 -0.864 1.00 0.00 C ATOM 990 CE2 TYR A 62 -3.075 -6.076 -0.743 1.00 0.00 C ATOM 991 CZ TYR A 62 -4.127 -6.932 -0.396 1.00 0.00 C ATOM 992 OH TYR A 62 -3.886 -8.029 0.406 1.00 0.00 O ATOM 0 H TYR A 62 -3.656 -2.455 -5.529 1.00 0.00 H new ATOM 0 HA TYR A 62 -4.672 -4.977 -4.443 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -4.156 -2.706 -2.652 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -5.862 -3.103 -2.703 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -6.660 -5.360 -2.036 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.505 -4.302 -1.818 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -6.232 -7.336 -0.599 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.076 -6.276 -0.385 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.573 -8.776 -0.146 1.00 0.00 H new ATOM 1002 N ASN A 63 -6.972 -4.150 -5.318 1.00 0.00 N ATOM 1003 CA ASN A 63 -8.161 -3.619 -6.054 1.00 0.00 C ATOM 1004 C ASN A 63 -9.434 -3.999 -5.304 1.00 0.00 C ATOM 1005 O ASN A 63 -9.870 -3.270 -4.444 1.00 0.00 O ATOM 1006 CB ASN A 63 -8.210 -4.150 -7.483 1.00 0.00 C ATOM 1007 CG ASN A 63 -9.646 -4.084 -8.027 1.00 0.00 C ATOM 1008 OD1 ASN A 63 -10.107 -4.997 -8.680 1.00 0.00 O ATOM 1009 ND2 ASN A 63 -10.379 -3.034 -7.774 1.00 0.00 N ATOM 0 H ASN A 63 -7.049 -5.112 -4.989 1.00 0.00 H new ATOM 0 HA ASN A 63 -8.079 -2.533 -6.107 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -7.546 -3.565 -8.119 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -7.851 -5.179 -7.509 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -11.335 -2.983 -8.125 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -9.995 -2.264 -7.225 1.00 0.00 H new ATOM 1016 N LYS A 64 -10.032 -5.134 -5.628 1.00 0.00 N ATOM 1017 CA LYS A 64 -11.293 -5.573 -4.934 1.00 0.00 C ATOM 1018 C LYS A 64 -11.482 -4.746 -3.667 1.00 0.00 C ATOM 1019 O LYS A 64 -10.860 -5.005 -2.670 1.00 0.00 O ATOM 1020 CB LYS A 64 -11.173 -7.053 -4.561 1.00 0.00 C ATOM 1021 CG LYS A 64 -12.137 -7.878 -5.417 1.00 0.00 C ATOM 1022 CD LYS A 64 -11.723 -7.792 -6.887 1.00 0.00 C ATOM 1023 CE LYS A 64 -12.791 -8.462 -7.753 1.00 0.00 C ATOM 1024 NZ LYS A 64 -12.302 -8.564 -9.156 1.00 0.00 N ATOM 0 H LYS A 64 -9.696 -5.775 -6.347 1.00 0.00 H new ATOM 0 HA LYS A 64 -12.147 -5.430 -5.595 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.150 -7.395 -4.715 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -11.400 -7.192 -3.504 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -12.133 -8.917 -5.088 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.155 -7.509 -5.294 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.601 -6.750 -7.182 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -10.760 -8.280 -7.035 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -13.020 -9.454 -7.364 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.715 -7.885 -7.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -13.028 -9.020 -9.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -12.105 -7.612 -9.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.431 -9.132 -9.180 1.00 0.00 H new ATOM 1038 N ARG A 65 -12.279 -3.713 -3.733 1.00 0.00 N ATOM 1039 CA ARG A 65 -12.469 -2.812 -2.553 1.00 0.00 C ATOM 1040 C ARG A 65 -12.293 -3.601 -1.249 1.00 0.00 C ATOM 1041 O ARG A 65 -11.568 -3.192 -0.362 1.00 0.00 O ATOM 1042 CB ARG A 65 -13.870 -2.204 -2.600 1.00 0.00 C ATOM 1043 CG ARG A 65 -13.903 -1.078 -3.635 1.00 0.00 C ATOM 1044 CD ARG A 65 -14.088 -1.675 -5.032 1.00 0.00 C ATOM 1045 NE ARG A 65 -15.099 -0.881 -5.782 1.00 0.00 N ATOM 1046 CZ ARG A 65 -16.338 -0.862 -5.380 1.00 0.00 C ATOM 1047 NH1 ARG A 65 -16.964 -1.984 -5.148 1.00 0.00 N ATOM 1048 NH2 ARG A 65 -16.950 0.277 -5.204 1.00 0.00 N ATOM 0 H ARG A 65 -12.813 -3.450 -4.561 1.00 0.00 H new ATOM 0 HA ARG A 65 -11.723 -2.018 -2.587 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -14.602 -2.970 -2.857 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -14.144 -1.818 -1.618 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -14.717 -0.388 -3.412 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -12.978 -0.504 -3.593 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -13.139 -1.674 -5.568 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -14.410 -2.714 -4.955 1.00 0.00 H new ATOM 0 HE ARG A 65 -14.822 -0.353 -6.609 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -16.483 -2.873 -5.282 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -17.934 -1.971 -4.833 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.458 1.153 -5.381 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.920 0.291 -4.889 1.00 0.00 H new ATOM 1062 N GLU A 66 -12.922 -4.740 -1.135 1.00 0.00 N ATOM 1063 CA GLU A 66 -12.752 -5.555 0.101 1.00 0.00 C ATOM 1064 C GLU A 66 -11.292 -6.007 0.173 1.00 0.00 C ATOM 1065 O GLU A 66 -10.618 -5.829 1.169 1.00 0.00 O ATOM 1066 CB GLU A 66 -13.672 -6.778 0.045 1.00 0.00 C ATOM 1067 CG GLU A 66 -14.840 -6.583 1.016 1.00 0.00 C ATOM 1068 CD GLU A 66 -15.949 -7.587 0.692 1.00 0.00 C ATOM 1069 OE1 GLU A 66 -15.641 -8.617 0.116 1.00 0.00 O ATOM 1070 OE2 GLU A 66 -17.089 -7.309 1.028 1.00 0.00 O ATOM 0 H GLU A 66 -13.542 -5.139 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.009 -4.967 0.982 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.047 -6.918 -0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -13.115 -7.678 0.306 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.500 -6.720 2.042 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.223 -5.565 0.940 1.00 0.00 H new ATOM 1077 N GLU A 67 -10.797 -6.576 -0.892 1.00 0.00 N ATOM 1078 CA GLU A 67 -9.377 -7.022 -0.919 1.00 0.00 C ATOM 1079 C GLU A 67 -8.477 -5.904 -0.372 1.00 0.00 C ATOM 1080 O GLU A 67 -7.591 -6.152 0.415 1.00 0.00 O ATOM 1081 CB GLU A 67 -8.972 -7.351 -2.357 1.00 0.00 C ATOM 1082 CG GLU A 67 -9.580 -8.695 -2.765 1.00 0.00 C ATOM 1083 CD GLU A 67 -8.983 -9.808 -1.900 1.00 0.00 C ATOM 1084 OE1 GLU A 67 -8.135 -9.502 -1.078 1.00 0.00 O ATOM 1085 OE2 GLU A 67 -9.385 -10.946 -2.074 1.00 0.00 O ATOM 0 H GLU A 67 -11.320 -6.752 -1.750 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.264 -7.912 -0.299 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -9.314 -6.566 -3.031 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.886 -7.391 -2.440 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.663 -8.668 -2.645 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.381 -8.892 -3.818 1.00 0.00 H new ATOM 1092 N ALA A 68 -8.686 -4.670 -0.758 1.00 0.00 N ATOM 1093 CA ALA A 68 -7.817 -3.602 -0.199 1.00 0.00 C ATOM 1094 C ALA A 68 -8.006 -3.613 1.311 1.00 0.00 C ATOM 1095 O ALA A 68 -7.060 -3.523 2.066 1.00 0.00 O ATOM 1096 CB ALA A 68 -8.203 -2.232 -0.759 1.00 0.00 C ATOM 0 H ALA A 68 -9.402 -4.366 -1.418 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.777 -3.786 -0.469 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.552 -1.468 -0.334 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.094 -2.239 -1.844 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -9.238 -2.011 -0.499 1.00 0.00 H new ATOM 1102 N GLN A 69 -9.228 -3.762 1.757 1.00 0.00 N ATOM 1103 CA GLN A 69 -9.479 -3.823 3.220 1.00 0.00 C ATOM 1104 C GLN A 69 -8.449 -4.775 3.820 1.00 0.00 C ATOM 1105 O GLN A 69 -7.921 -4.548 4.890 1.00 0.00 O ATOM 1106 CB GLN A 69 -10.892 -4.352 3.481 1.00 0.00 C ATOM 1107 CG GLN A 69 -11.340 -3.943 4.886 1.00 0.00 C ATOM 1108 CD GLN A 69 -11.383 -5.178 5.786 1.00 0.00 C ATOM 1109 OE1 GLN A 69 -10.624 -5.285 6.728 1.00 0.00 O ATOM 1110 NE2 GLN A 69 -12.248 -6.124 5.536 1.00 0.00 N ATOM 0 H GLN A 69 -10.058 -3.843 1.169 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.395 -2.833 3.669 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -11.583 -3.955 2.738 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -10.909 -5.438 3.384 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -10.653 -3.203 5.298 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -12.324 -3.476 4.844 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -12.886 -6.036 4.745 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -12.285 -6.951 6.132 1.00 0.00 H new ATOM 1119 N GLU A 70 -8.135 -5.830 3.111 1.00 0.00 N ATOM 1120 CA GLU A 70 -7.106 -6.778 3.613 1.00 0.00 C ATOM 1121 C GLU A 70 -5.794 -6.021 3.707 1.00 0.00 C ATOM 1122 O GLU A 70 -5.116 -6.053 4.703 1.00 0.00 O ATOM 1123 CB GLU A 70 -6.914 -7.941 2.637 1.00 0.00 C ATOM 1124 CG GLU A 70 -7.570 -9.203 3.200 1.00 0.00 C ATOM 1125 CD GLU A 70 -9.093 -9.076 3.115 1.00 0.00 C ATOM 1126 OE1 GLU A 70 -9.575 -7.955 3.102 1.00 0.00 O ATOM 1127 OE2 GLU A 70 -9.752 -10.102 3.068 1.00 0.00 O ATOM 0 H GLU A 70 -8.547 -6.072 2.210 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.420 -7.176 4.578 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -7.352 -7.693 1.670 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.851 -8.116 2.470 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -7.237 -10.078 2.641 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -7.265 -9.351 4.236 1.00 0.00 H new ATOM 1134 N ALA A 71 -5.435 -5.331 2.662 1.00 0.00 N ATOM 1135 CA ALA A 71 -4.166 -4.566 2.686 1.00 0.00 C ATOM 1136 C ALA A 71 -4.249 -3.489 3.773 1.00 0.00 C ATOM 1137 O ALA A 71 -3.263 -2.886 4.141 1.00 0.00 O ATOM 1138 CB ALA A 71 -3.926 -3.917 1.323 1.00 0.00 C ATOM 0 H ALA A 71 -5.967 -5.266 1.794 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.337 -5.239 2.905 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.992 -3.356 1.347 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.866 -4.690 0.557 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -4.749 -3.241 1.092 1.00 0.00 H new ATOM 1144 N ILE A 72 -5.417 -3.250 4.304 1.00 0.00 N ATOM 1145 CA ILE A 72 -5.538 -2.228 5.379 1.00 0.00 C ATOM 1146 C ILE A 72 -5.195 -2.890 6.713 1.00 0.00 C ATOM 1147 O ILE A 72 -4.179 -2.614 7.309 1.00 0.00 O ATOM 1148 CB ILE A 72 -6.969 -1.683 5.433 1.00 0.00 C ATOM 1149 CG1 ILE A 72 -7.346 -1.096 4.070 1.00 0.00 C ATOM 1150 CG2 ILE A 72 -7.054 -0.585 6.496 1.00 0.00 C ATOM 1151 CD1 ILE A 72 -6.334 -0.019 3.681 1.00 0.00 C ATOM 0 H ILE A 72 -6.286 -3.715 4.042 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.858 -1.400 5.178 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.655 -2.492 5.684 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.364 -1.883 3.316 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -8.349 -0.670 4.110 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -8.071 -0.196 6.536 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -6.785 -0.998 7.468 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -6.367 0.222 6.242 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -6.602 0.399 2.711 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -6.338 0.772 4.431 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -5.338 -0.459 3.624 1.00 0.00 H new ATOM 1163 N SER A 73 -6.034 -3.774 7.178 1.00 0.00 N ATOM 1164 CA SER A 73 -5.758 -4.462 8.473 1.00 0.00 C ATOM 1165 C SER A 73 -4.660 -5.518 8.291 1.00 0.00 C ATOM 1166 O SER A 73 -4.331 -6.244 9.208 1.00 0.00 O ATOM 1167 CB SER A 73 -7.037 -5.142 8.959 1.00 0.00 C ATOM 1168 OG SER A 73 -7.331 -4.701 10.277 1.00 0.00 O ATOM 0 H SER A 73 -6.901 -4.051 6.717 1.00 0.00 H new ATOM 0 HA SER A 73 -5.423 -3.726 9.204 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.865 -4.905 8.291 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.915 -6.225 8.944 1.00 0.00 H new ATOM 0 HG SER A 73 -8.152 -5.134 10.591 1.00 0.00 H new ATOM 1174 N ALA A 74 -4.093 -5.615 7.120 1.00 0.00 N ATOM 1175 CA ALA A 74 -3.025 -6.630 6.886 1.00 0.00 C ATOM 1176 C ALA A 74 -1.764 -5.941 6.362 1.00 0.00 C ATOM 1177 O ALA A 74 -0.683 -6.134 6.881 1.00 0.00 O ATOM 1178 CB ALA A 74 -3.500 -7.657 5.853 1.00 0.00 C ATOM 0 H ALA A 74 -4.323 -5.035 6.313 1.00 0.00 H new ATOM 0 HA ALA A 74 -2.805 -7.134 7.827 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -2.716 -8.395 5.687 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -4.396 -8.156 6.222 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.727 -7.151 4.915 1.00 0.00 H new ATOM 1184 N LEU A 75 -1.885 -5.146 5.330 1.00 0.00 N ATOM 1185 CA LEU A 75 -0.677 -4.467 4.783 1.00 0.00 C ATOM 1186 C LEU A 75 -0.346 -3.223 5.615 1.00 0.00 C ATOM 1187 O LEU A 75 0.807 -2.905 5.815 1.00 0.00 O ATOM 1188 CB LEU A 75 -0.905 -4.076 3.314 1.00 0.00 C ATOM 1189 CG LEU A 75 -0.197 -5.087 2.403 1.00 0.00 C ATOM 1190 CD1 LEU A 75 -1.210 -6.024 1.746 1.00 0.00 C ATOM 1191 CD2 LEU A 75 0.572 -4.349 1.306 1.00 0.00 C ATOM 0 H LEU A 75 -2.760 -4.940 4.848 1.00 0.00 H new ATOM 0 HA LEU A 75 0.164 -5.158 4.835 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.972 -4.055 3.093 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.522 -3.072 3.129 1.00 0.00 H new ATOM 0 HG LEU A 75 0.490 -5.671 3.015 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.687 -6.733 1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.756 -6.567 2.517 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.910 -5.441 1.148 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.072 -5.073 0.663 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -0.122 -3.754 0.712 1.00 0.00 H new ATOM 0 HD23 LEU A 75 1.315 -3.693 1.760 1.00 0.00 H new ATOM 1203 N ASN A 76 -1.330 -2.518 6.115 1.00 0.00 N ATOM 1204 CA ASN A 76 -1.018 -1.306 6.931 1.00 0.00 C ATOM 1205 C ASN A 76 -0.057 -1.692 8.064 1.00 0.00 C ATOM 1206 O ASN A 76 -0.201 -2.726 8.686 1.00 0.00 O ATOM 1207 CB ASN A 76 -2.317 -0.710 7.507 1.00 0.00 C ATOM 1208 CG ASN A 76 -2.649 -1.341 8.865 1.00 0.00 C ATOM 1209 OD1 ASN A 76 -2.577 -2.544 9.024 1.00 0.00 O ATOM 1210 ND2 ASN A 76 -3.015 -0.572 9.853 1.00 0.00 N ATOM 0 H ASN A 76 -2.322 -2.725 5.996 1.00 0.00 H new ATOM 0 HA ASN A 76 -0.544 -0.553 6.301 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -2.209 0.369 7.619 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -3.139 -0.878 6.812 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -3.241 -0.980 10.760 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -3.075 0.437 9.718 1.00 0.00 H new ATOM 1217 N ASN A 77 0.915 -0.866 8.342 1.00 0.00 N ATOM 1218 CA ASN A 77 1.872 -1.186 9.440 1.00 0.00 C ATOM 1219 C ASN A 77 2.464 -2.584 9.236 1.00 0.00 C ATOM 1220 O ASN A 77 2.466 -3.399 10.137 1.00 0.00 O ATOM 1221 CB ASN A 77 1.130 -1.146 10.779 1.00 0.00 C ATOM 1222 CG ASN A 77 0.032 -0.081 10.720 1.00 0.00 C ATOM 1223 OD1 ASN A 77 0.119 0.855 9.949 1.00 0.00 O ATOM 1224 ND2 ASN A 77 -1.006 -0.184 11.504 1.00 0.00 N ATOM 0 H ASN A 77 1.088 0.015 7.858 1.00 0.00 H new ATOM 0 HA ASN A 77 2.679 -0.453 9.435 1.00 0.00 H new ATOM 0 HB2 ASN A 77 0.695 -2.122 10.995 1.00 0.00 H new ATOM 0 HB3 ASN A 77 1.827 -0.922 11.587 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -1.743 0.520 11.469 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -1.080 -0.969 12.151 1.00 0.00 H new ATOM 1231 N VAL A 78 2.971 -2.877 8.067 1.00 0.00 N ATOM 1232 CA VAL A 78 3.555 -4.229 7.841 1.00 0.00 C ATOM 1233 C VAL A 78 5.038 -4.225 8.234 1.00 0.00 C ATOM 1234 O VAL A 78 5.918 -4.091 7.406 1.00 0.00 O ATOM 1235 CB VAL A 78 3.372 -4.646 6.371 1.00 0.00 C ATOM 1236 CG1 VAL A 78 4.475 -5.622 5.942 1.00 0.00 C ATOM 1237 CG2 VAL A 78 2.021 -5.335 6.239 1.00 0.00 C ATOM 0 H VAL A 78 3.005 -2.245 7.267 1.00 0.00 H new ATOM 0 HA VAL A 78 3.036 -4.957 8.464 1.00 0.00 H new ATOM 0 HB VAL A 78 3.426 -3.762 5.735 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.326 -5.904 4.900 1.00 0.00 H new ATOM 0 HG12 VAL A 78 5.448 -5.143 6.053 1.00 0.00 H new ATOM 0 HG13 VAL A 78 4.436 -6.513 6.568 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.868 -5.640 5.204 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.996 -6.213 6.884 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.230 -4.645 6.534 1.00 0.00 H new ATOM 1247 N ILE A 79 5.309 -4.387 9.498 1.00 0.00 N ATOM 1248 CA ILE A 79 6.722 -4.416 9.977 1.00 0.00 C ATOM 1249 C ILE A 79 6.828 -5.467 11.086 1.00 0.00 C ATOM 1250 O ILE A 79 5.950 -6.295 11.231 1.00 0.00 O ATOM 1251 CB ILE A 79 7.135 -3.038 10.523 1.00 0.00 C ATOM 1252 CG1 ILE A 79 6.034 -2.004 10.260 1.00 0.00 C ATOM 1253 CG2 ILE A 79 8.425 -2.585 9.832 1.00 0.00 C ATOM 1254 CD1 ILE A 79 4.982 -2.088 11.367 1.00 0.00 C ATOM 0 H ILE A 79 4.606 -4.502 10.228 1.00 0.00 H new ATOM 0 HA ILE A 79 7.387 -4.666 9.150 1.00 0.00 H new ATOM 0 HB ILE A 79 7.294 -3.120 11.598 1.00 0.00 H new ATOM 0 HG12 ILE A 79 6.462 -1.002 10.225 1.00 0.00 H new ATOM 0 HG13 ILE A 79 5.572 -2.187 9.290 1.00 0.00 H new ATOM 0 HG21 ILE A 79 8.720 -1.609 10.217 1.00 0.00 H new ATOM 0 HG22 ILE A 79 9.217 -3.308 10.030 1.00 0.00 H new ATOM 0 HG23 ILE A 79 8.257 -2.516 8.757 1.00 0.00 H new ATOM 0 HD11 ILE A 79 4.199 -1.353 11.181 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.547 -3.087 11.380 1.00 0.00 H new ATOM 0 HD13 ILE A 79 5.450 -1.884 12.330 1.00 0.00 H new ATOM 1266 N PRO A 80 7.896 -5.408 11.836 1.00 0.00 N ATOM 1267 CA PRO A 80 8.046 -6.401 12.921 1.00 0.00 C ATOM 1268 C PRO A 80 7.472 -5.853 14.231 1.00 0.00 C ATOM 1269 O PRO A 80 7.883 -6.239 15.306 1.00 0.00 O ATOM 1270 CB PRO A 80 9.555 -6.613 13.043 1.00 0.00 C ATOM 1271 CG PRO A 80 10.216 -5.354 12.453 1.00 0.00 C ATOM 1272 CD PRO A 80 9.151 -4.657 11.594 1.00 0.00 C ATOM 0 HA PRO A 80 7.514 -7.329 12.711 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.845 -6.753 14.084 1.00 0.00 H new ATOM 0 HB3 PRO A 80 9.867 -7.506 12.502 1.00 0.00 H new ATOM 0 HG2 PRO A 80 10.567 -4.693 13.246 1.00 0.00 H new ATOM 0 HG3 PRO A 80 11.085 -5.619 11.851 1.00 0.00 H new ATOM 0 HD2 PRO A 80 9.043 -3.610 11.876 1.00 0.00 H new ATOM 0 HD3 PRO A 80 9.423 -4.676 10.539 1.00 0.00 H new ATOM 1280 N GLU A 81 6.522 -4.957 14.146 1.00 0.00 N ATOM 1281 CA GLU A 81 5.916 -4.378 15.385 1.00 0.00 C ATOM 1282 C GLU A 81 7.017 -4.096 16.410 1.00 0.00 C ATOM 1283 O GLU A 81 7.399 -4.955 17.182 1.00 0.00 O ATOM 1284 CB GLU A 81 4.891 -5.352 15.985 1.00 0.00 C ATOM 1285 CG GLU A 81 5.102 -6.759 15.420 1.00 0.00 C ATOM 1286 CD GLU A 81 3.916 -7.646 15.804 1.00 0.00 C ATOM 1287 OE1 GLU A 81 3.044 -7.163 16.508 1.00 0.00 O ATOM 1288 OE2 GLU A 81 3.899 -8.793 15.388 1.00 0.00 O ATOM 0 H GLU A 81 6.139 -4.600 13.271 1.00 0.00 H new ATOM 0 HA GLU A 81 5.408 -3.449 15.127 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.988 -5.370 17.070 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.880 -5.011 15.761 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.201 -6.716 14.335 1.00 0.00 H new ATOM 0 HG3 GLU A 81 6.028 -7.183 15.808 1.00 0.00 H new ATOM 1295 N GLY A 82 7.529 -2.897 16.422 1.00 0.00 N ATOM 1296 CA GLY A 82 8.608 -2.551 17.391 1.00 0.00 C ATOM 1297 C GLY A 82 9.507 -1.480 16.776 1.00 0.00 C ATOM 1298 O GLY A 82 10.718 -1.553 16.844 1.00 0.00 O ATOM 0 H GLY A 82 7.246 -2.139 15.801 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.174 -2.188 18.323 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.193 -3.438 17.635 1.00 0.00 H new ATOM 1302 N GLY A 83 8.920 -0.487 16.166 1.00 0.00 N ATOM 1303 CA GLY A 83 9.734 0.589 15.535 1.00 0.00 C ATOM 1304 C GLY A 83 9.689 0.422 14.015 1.00 0.00 C ATOM 1305 O GLY A 83 8.909 -0.348 13.491 1.00 0.00 O ATOM 0 H GLY A 83 7.910 -0.375 16.077 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.347 1.568 15.818 1.00 0.00 H new ATOM 0 HA3 GLY A 83 10.764 0.539 15.889 1.00 0.00 H new ATOM 1309 N SER A 84 10.519 1.134 13.301 1.00 0.00 N ATOM 1310 CA SER A 84 10.522 1.010 11.814 1.00 0.00 C ATOM 1311 C SER A 84 9.336 1.777 11.226 1.00 0.00 C ATOM 1312 O SER A 84 9.182 1.869 10.025 1.00 0.00 O ATOM 1313 CB SER A 84 10.410 -0.463 11.424 1.00 0.00 C ATOM 1314 OG SER A 84 11.465 -0.794 10.530 1.00 0.00 O ATOM 0 H SER A 84 11.195 1.796 13.683 1.00 0.00 H new ATOM 0 HA SER A 84 11.451 1.425 11.424 1.00 0.00 H new ATOM 0 HB2 SER A 84 10.461 -1.091 12.313 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.446 -0.654 10.953 1.00 0.00 H new ATOM 0 HG SER A 84 11.397 -1.739 10.279 1.00 0.00 H new ATOM 1320 N GLN A 85 8.494 2.326 12.058 1.00 0.00 N ATOM 1321 CA GLN A 85 7.321 3.081 11.536 1.00 0.00 C ATOM 1322 C GLN A 85 6.441 2.143 10.705 1.00 0.00 C ATOM 1323 O GLN A 85 6.936 1.253 10.042 1.00 0.00 O ATOM 1324 CB GLN A 85 7.807 4.235 10.658 1.00 0.00 C ATOM 1325 CG GLN A 85 9.088 4.823 11.251 1.00 0.00 C ATOM 1326 CD GLN A 85 9.400 6.160 10.576 1.00 0.00 C ATOM 1327 OE1 GLN A 85 8.880 6.456 9.518 1.00 0.00 O ATOM 1328 NE2 GLN A 85 10.232 6.987 11.147 1.00 0.00 N ATOM 0 H GLN A 85 8.568 2.284 13.074 1.00 0.00 H new ATOM 0 HA GLN A 85 6.743 3.478 12.370 1.00 0.00 H new ATOM 0 HB2 GLN A 85 7.992 3.881 9.644 1.00 0.00 H new ATOM 0 HB3 GLN A 85 7.038 5.004 10.592 1.00 0.00 H new ATOM 0 HG2 GLN A 85 8.971 4.965 12.325 1.00 0.00 H new ATOM 0 HG3 GLN A 85 9.918 4.130 11.109 1.00 0.00 H new ATOM 0 HE21 GLN A 85 10.669 6.739 12.035 1.00 0.00 H new ATOM 0 HE22 GLN A 85 10.446 7.881 10.706 1.00 0.00 H new ATOM 1337 N PRO A 86 5.160 2.378 10.772 1.00 0.00 N ATOM 1338 CA PRO A 86 4.229 1.523 10.004 1.00 0.00 C ATOM 1339 C PRO A 86 3.794 2.236 8.720 1.00 0.00 C ATOM 1340 O PRO A 86 3.688 3.445 8.677 1.00 0.00 O ATOM 1341 CB PRO A 86 3.039 1.321 10.941 1.00 0.00 C ATOM 1342 CG PRO A 86 3.067 2.497 11.936 1.00 0.00 C ATOM 1343 CD PRO A 86 4.501 3.049 11.916 1.00 0.00 C ATOM 0 HA PRO A 86 4.678 0.578 9.699 1.00 0.00 H new ATOM 0 HB2 PRO A 86 2.103 1.306 10.383 1.00 0.00 H new ATOM 0 HB3 PRO A 86 3.113 0.368 11.464 1.00 0.00 H new ATOM 0 HG2 PRO A 86 2.351 3.266 11.648 1.00 0.00 H new ATOM 0 HG3 PRO A 86 2.793 2.165 12.937 1.00 0.00 H new ATOM 0 HD2 PRO A 86 4.504 4.132 11.792 1.00 0.00 H new ATOM 0 HD3 PRO A 86 5.019 2.833 12.851 1.00 0.00 H new ATOM 1351 N LEU A 87 3.550 1.498 7.672 1.00 0.00 N ATOM 1352 CA LEU A 87 3.133 2.147 6.394 1.00 0.00 C ATOM 1353 C LEU A 87 1.717 2.704 6.509 1.00 0.00 C ATOM 1354 O LEU A 87 0.771 1.975 6.735 1.00 0.00 O ATOM 1355 CB LEU A 87 3.151 1.150 5.224 1.00 0.00 C ATOM 1356 CG LEU A 87 2.910 -0.281 5.704 1.00 0.00 C ATOM 1357 CD1 LEU A 87 2.045 -1.011 4.674 1.00 0.00 C ATOM 1358 CD2 LEU A 87 4.250 -1.006 5.835 1.00 0.00 C ATOM 0 H LEU A 87 3.620 0.481 7.643 1.00 0.00 H new ATOM 0 HA LEU A 87 3.845 2.950 6.203 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.386 1.425 4.498 1.00 0.00 H new ATOM 0 HB3 LEU A 87 4.111 1.206 4.711 1.00 0.00 H new ATOM 0 HG LEU A 87 2.407 -0.265 6.671 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.867 -2.033 5.007 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.092 -0.493 4.567 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.559 -1.027 3.713 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.079 -2.027 6.177 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.749 -1.027 4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.878 -0.482 6.555 1.00 0.00 H new ATOM 1370 N SER A 88 1.555 3.981 6.301 1.00 0.00 N ATOM 1371 CA SER A 88 0.188 4.563 6.343 1.00 0.00 C ATOM 1372 C SER A 88 -0.461 4.244 4.999 1.00 0.00 C ATOM 1373 O SER A 88 -0.121 4.818 3.987 1.00 0.00 O ATOM 1374 CB SER A 88 0.268 6.078 6.542 1.00 0.00 C ATOM 1375 OG SER A 88 -0.911 6.526 7.199 1.00 0.00 O ATOM 0 H SER A 88 2.306 4.642 6.105 1.00 0.00 H new ATOM 0 HA SER A 88 -0.392 4.150 7.169 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.147 6.333 7.133 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.375 6.578 5.579 1.00 0.00 H new ATOM 0 HG SER A 88 -0.864 7.496 7.330 1.00 0.00 H new ATOM 1381 N VAL A 89 -1.348 3.291 4.972 1.00 0.00 N ATOM 1382 CA VAL A 89 -1.971 2.884 3.682 1.00 0.00 C ATOM 1383 C VAL A 89 -3.072 3.871 3.252 1.00 0.00 C ATOM 1384 O VAL A 89 -2.946 5.063 3.446 1.00 0.00 O ATOM 1385 CB VAL A 89 -2.531 1.475 3.861 1.00 0.00 C ATOM 1386 CG1 VAL A 89 -1.374 0.522 4.177 1.00 0.00 C ATOM 1387 CG2 VAL A 89 -3.519 1.469 5.027 1.00 0.00 C ATOM 0 H VAL A 89 -1.670 2.774 5.790 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.224 2.894 2.889 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.039 1.158 2.950 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.760 -0.489 4.307 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -0.658 0.534 3.355 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.879 0.842 5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -3.921 0.464 5.158 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -3.007 1.777 5.939 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.334 2.162 4.817 1.00 0.00 H new ATOM 1397 N ARG A 90 -4.130 3.387 2.634 1.00 0.00 N ATOM 1398 CA ARG A 90 -5.221 4.293 2.148 1.00 0.00 C ATOM 1399 C ARG A 90 -4.837 4.834 0.764 1.00 0.00 C ATOM 1400 O ARG A 90 -3.966 5.672 0.633 1.00 0.00 O ATOM 1401 CB ARG A 90 -5.414 5.460 3.121 1.00 0.00 C ATOM 1402 CG ARG A 90 -6.788 6.089 2.889 1.00 0.00 C ATOM 1403 CD ARG A 90 -6.616 7.540 2.440 1.00 0.00 C ATOM 1404 NE ARG A 90 -7.375 8.436 3.355 1.00 0.00 N ATOM 1405 CZ ARG A 90 -8.243 9.280 2.870 1.00 0.00 C ATOM 1406 NH1 ARG A 90 -9.063 8.903 1.926 1.00 0.00 N ATOM 1407 NH2 ARG A 90 -8.289 10.502 3.326 1.00 0.00 N ATOM 0 H ARG A 90 -4.283 2.396 2.446 1.00 0.00 H new ATOM 0 HA ARG A 90 -6.155 3.734 2.085 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -5.331 5.109 4.149 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -4.631 6.204 2.974 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -7.334 5.526 2.133 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.378 6.048 3.805 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -5.560 7.810 2.443 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -6.973 7.660 1.417 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.216 8.390 4.361 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -9.025 7.949 1.568 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -9.742 9.563 1.547 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.646 10.797 4.061 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.968 11.163 2.947 1.00 0.00 H new ATOM 1421 N LEU A 91 -5.475 4.350 -0.270 1.00 0.00 N ATOM 1422 CA LEU A 91 -5.147 4.820 -1.651 1.00 0.00 C ATOM 1423 C LEU A 91 -4.930 6.335 -1.653 1.00 0.00 C ATOM 1424 O LEU A 91 -5.620 7.075 -0.977 1.00 0.00 O ATOM 1425 CB LEU A 91 -6.303 4.467 -2.590 1.00 0.00 C ATOM 1426 CG LEU A 91 -5.762 3.998 -3.942 1.00 0.00 C ATOM 1427 CD1 LEU A 91 -6.696 2.930 -4.513 1.00 0.00 C ATOM 1428 CD2 LEU A 91 -5.703 5.179 -4.912 1.00 0.00 C ATOM 0 H LEU A 91 -6.212 3.647 -0.218 1.00 0.00 H new ATOM 0 HA LEU A 91 -4.233 4.332 -1.990 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.917 3.684 -2.144 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.946 5.336 -2.729 1.00 0.00 H new ATOM 0 HG LEU A 91 -4.761 3.587 -3.808 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -6.316 2.592 -5.477 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -6.746 2.085 -3.826 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.693 3.351 -4.644 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.317 4.841 -5.874 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -6.704 5.590 -5.047 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.046 5.949 -4.508 1.00 0.00 H new ATOM 1440 N ALA A 92 -3.977 6.801 -2.413 1.00 0.00 N ATOM 1441 CA ALA A 92 -3.709 8.265 -2.472 1.00 0.00 C ATOM 1442 C ALA A 92 -4.334 8.842 -3.745 1.00 0.00 C ATOM 1443 O ALA A 92 -5.143 8.207 -4.393 1.00 0.00 O ATOM 1444 CB ALA A 92 -2.197 8.502 -2.490 1.00 0.00 C ATOM 0 H ALA A 92 -3.370 6.227 -2.998 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.143 8.755 -1.600 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -1.997 9.573 -2.533 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -1.753 8.086 -1.586 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.763 8.016 -3.364 1.00 0.00 H new ATOM 1450 N GLU A 93 -3.968 10.040 -4.111 1.00 0.00 N ATOM 1451 CA GLU A 93 -4.543 10.651 -5.341 1.00 0.00 C ATOM 1452 C GLU A 93 -3.599 10.413 -6.522 1.00 0.00 C ATOM 1453 O GLU A 93 -2.462 10.841 -6.517 1.00 0.00 O ATOM 1454 CB GLU A 93 -4.724 12.155 -5.130 1.00 0.00 C ATOM 1455 CG GLU A 93 -6.196 12.524 -5.334 1.00 0.00 C ATOM 1456 CD GLU A 93 -6.298 13.688 -6.321 1.00 0.00 C ATOM 1457 OE1 GLU A 93 -6.122 13.451 -7.505 1.00 0.00 O ATOM 1458 OE2 GLU A 93 -6.551 14.795 -5.877 1.00 0.00 O ATOM 0 H GLU A 93 -3.296 10.621 -3.611 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.510 10.195 -5.551 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.404 12.434 -4.126 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.098 12.709 -5.830 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -6.749 11.664 -5.712 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.648 12.800 -4.381 1.00 0.00 H new ATOM 1465 N GLU A 94 -4.062 9.732 -7.535 1.00 0.00 N ATOM 1466 CA GLU A 94 -3.196 9.468 -8.717 1.00 0.00 C ATOM 1467 C GLU A 94 -3.819 8.363 -9.569 1.00 0.00 C ATOM 1468 O GLU A 94 -4.582 8.622 -10.478 1.00 0.00 O ATOM 1469 CB GLU A 94 -1.808 9.029 -8.248 1.00 0.00 C ATOM 1470 CG GLU A 94 -0.816 10.177 -8.448 1.00 0.00 C ATOM 1471 CD GLU A 94 0.246 10.133 -7.347 1.00 0.00 C ATOM 1472 OE1 GLU A 94 -0.123 9.936 -6.201 1.00 0.00 O ATOM 1473 OE2 GLU A 94 1.411 10.301 -7.669 1.00 0.00 O ATOM 0 H GLU A 94 -5.005 9.347 -7.594 1.00 0.00 H new ATOM 0 HA GLU A 94 -3.107 10.378 -9.310 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.841 8.742 -7.197 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.484 8.152 -8.808 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -0.343 10.097 -9.427 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.340 11.133 -8.424 1.00 0.00 H new ATOM 1480 N HIS A 95 -3.498 7.130 -9.285 1.00 0.00 N ATOM 1481 CA HIS A 95 -4.073 6.008 -10.080 1.00 0.00 C ATOM 1482 C HIS A 95 -3.458 4.686 -9.618 1.00 0.00 C ATOM 1483 O HIS A 95 -4.031 3.967 -8.824 1.00 0.00 O ATOM 1484 CB HIS A 95 -3.759 6.226 -11.562 1.00 0.00 C ATOM 1485 CG HIS A 95 -4.201 5.025 -12.353 1.00 0.00 C ATOM 1486 ND1 HIS A 95 -3.308 4.231 -13.056 1.00 0.00 N ATOM 1487 CD2 HIS A 95 -5.440 4.468 -12.560 1.00 0.00 C ATOM 1488 CE1 HIS A 95 -4.015 3.251 -13.648 1.00 0.00 C ATOM 1489 NE2 HIS A 95 -5.320 3.349 -13.379 1.00 0.00 N ATOM 0 H HIS A 95 -2.863 6.851 -8.537 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.153 5.974 -9.936 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -4.267 7.120 -11.924 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.690 6.390 -11.697 1.00 0.00 H new ATOM 0 HD1 HIS A 95 -2.299 4.365 -13.114 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -6.366 4.842 -12.149 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -3.580 2.479 -14.266 1.00 0.00 H new ATOM 1497 N GLY A 96 -2.294 4.361 -10.112 1.00 0.00 N ATOM 1498 CA GLY A 96 -1.638 3.085 -9.705 1.00 0.00 C ATOM 1499 C GLY A 96 -1.005 2.431 -10.932 1.00 0.00 C ATOM 1500 O GLY A 96 -0.140 2.996 -11.573 1.00 0.00 O ATOM 0 H GLY A 96 -1.768 4.924 -10.780 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.878 3.278 -8.948 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.370 2.413 -9.257 1.00 0.00 H new ATOM 1504 N LYS A 97 -1.430 1.245 -11.270 1.00 0.00 N ATOM 1505 CA LYS A 97 -0.853 0.561 -12.461 1.00 0.00 C ATOM 1506 C LYS A 97 -1.584 1.041 -13.716 1.00 0.00 C ATOM 1507 O LYS A 97 -2.568 0.418 -14.079 1.00 0.00 O ATOM 1508 CB LYS A 97 -1.025 -0.953 -12.308 1.00 0.00 C ATOM 1509 CG LYS A 97 0.065 -1.683 -13.103 1.00 0.00 C ATOM 1510 CD LYS A 97 -0.225 -1.582 -14.602 1.00 0.00 C ATOM 1511 CE LYS A 97 -0.498 -2.975 -15.168 1.00 0.00 C ATOM 1512 NZ LYS A 97 -1.572 -2.885 -16.197 1.00 0.00 N ATOM 1513 OXT LYS A 97 -1.146 2.023 -14.293 1.00 0.00 O ATOM 0 H LYS A 97 -2.151 0.721 -10.774 1.00 0.00 H new ATOM 0 HA LYS A 97 0.208 0.795 -12.547 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.967 -1.230 -11.255 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.010 -1.254 -12.663 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.040 -1.249 -12.883 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.107 -2.730 -12.802 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.085 -0.934 -14.773 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.623 -1.129 -15.117 1.00 0.00 H new ATOM 0 HE2 LYS A 97 0.410 -3.386 -15.609 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.799 -3.652 -14.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.761 -3.831 -16.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.439 -2.510 -15.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -1.267 -2.251 -16.963 1.00 0.00 H new TER 1527 LYS A 97