USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 907 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 67 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 68 ASN : amide:sc= 0.864 K(o=0.86,f=-3.1!) USER MOD Set 2.1: A 37 CYS SG : rot -47:sc= -0.122 USER MOD Set 2.2: A 40 CYS SG : rot 84:sc= 0.443 USER MOD Set 3.1: A 35 THR OG1 : rot 180:sc= 0.83 USER MOD Set 3.2: A 41 LYS NZ :NH3+ 179:sc= 1.14 (180deg=0.152) USER MOD Set 4.1: A 26 LYS NZ :NH3+ -166:sc= 1.14 (180deg=0.279) USER MOD Set 4.2: A 59 THR OG1 : rot 180:sc= 0.716 USER MOD Set 5.1: A 1 MET N :NH3+ 163:sc= 1.62 (180deg=0.666) USER MOD Set 5.2: A 7 SER OG : rot 174:sc= 2 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0.00453 USER MOD Single : A 4 SER OG : rot 96:sc= 0.85 USER MOD Single : A 6 LYS NZ :NH3+ 179:sc= 1.56 (180deg=1.56) USER MOD Single : A 9 THR OG1 : rot 180:sc=0.000462 USER MOD Single : A 11 LYS NZ :NH3+ -167:sc= 1.24 (180deg=1.22) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -40:sc= 0.00766 USER MOD Single : A 24 SER OG : rot 170:sc= 0.0783 USER MOD Single : A 25 ASN : amide:sc= -0.0221 K(o=-0.022,f=-1.3) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 80:sc= 0.595 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0165 USER MOD Single : A 62 LYS NZ :NH3+ -107:sc= 0.426 (180deg=0.00904) USER MOD Single : A 71 THR OG1 : rot 180:sc=0.000998 USER MOD Single : A 74 ASN : amide:sc= 0.303 X(o=0.3,f=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 73:sc= 0.786 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 93 LYS NZ :NH3+ -175:sc= 3.56 (180deg=3.49) USER MOD Single : A 99 LYS NZ :NH3+ -136:sc= 1.89 (180deg=0.0968) USER MOD Single : A 101 LYS NZ :NH3+ -173:sc= 2.51 (180deg=2.33) USER MOD Single : A 109 SER OG : rot 46:sc= 0.351 USER MOD Single : A 114 ASN : amide:sc= 1.71 K(o=1.7,f=-6.5!) USER MOD Single : A 116 ASN : amide:sc= 0.743 K(o=0.74,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.068 -5.993 14.146 1.00 0.00 N ATOM 2 CA MET A 1 11.080 -4.943 14.434 1.00 0.00 C ATOM 3 C MET A 1 11.716 -5.183 15.801 1.00 0.00 C ATOM 4 O MET A 1 11.008 -5.273 16.799 1.00 0.00 O ATOM 5 CB MET A 1 10.459 -3.534 14.340 1.00 0.00 C ATOM 6 CG MET A 1 11.428 -2.402 14.714 1.00 0.00 C ATOM 7 SD MET A 1 13.013 -2.425 13.825 1.00 0.00 S ATOM 8 CE MET A 1 13.695 -0.836 14.366 1.00 0.00 C ATOM 0 H1 MET A 1 9.448 -5.675 13.374 1.00 0.00 H new ATOM 0 H2 MET A 1 10.549 -6.871 13.865 1.00 0.00 H new ATOM 0 H3 MET A 1 9.498 -6.168 14.998 1.00 0.00 H new ATOM 0 HA MET A 1 11.865 -5.002 13.680 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.101 -3.372 13.323 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.589 -3.486 14.995 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.937 -1.447 14.527 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.628 -2.453 15.784 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.674 -0.687 13.911 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.027 -0.031 14.061 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.795 -0.834 15.451 1.00 0.00 H new ATOM 19 N THR A 2 13.048 -5.269 15.878 1.00 0.00 N ATOM 20 CA THR A 2 13.785 -5.667 17.099 1.00 0.00 C ATOM 21 C THR A 2 13.581 -4.708 18.284 1.00 0.00 C ATOM 22 O THR A 2 13.529 -5.145 19.433 1.00 0.00 O ATOM 23 CB THR A 2 15.290 -5.784 16.784 1.00 0.00 C ATOM 24 OG1 THR A 2 15.475 -6.492 15.572 1.00 0.00 O ATOM 25 CG2 THR A 2 16.074 -6.536 17.861 1.00 0.00 C ATOM 0 H THR A 2 13.660 -5.063 15.088 1.00 0.00 H new ATOM 0 HA THR A 2 13.377 -6.631 17.404 1.00 0.00 H new ATOM 0 HB THR A 2 15.662 -4.761 16.726 1.00 0.00 H new ATOM 0 HG1 THR A 2 16.433 -6.561 15.377 1.00 0.00 H new ATOM 0 HG21 THR A 2 17.126 -6.583 17.579 1.00 0.00 H new ATOM 0 HG22 THR A 2 15.977 -6.014 18.813 1.00 0.00 H new ATOM 0 HG23 THR A 2 15.679 -7.547 17.959 1.00 0.00 H new ATOM 33 N ASP A 3 13.425 -3.406 18.021 1.00 0.00 N ATOM 34 CA ASP A 3 13.289 -2.366 19.057 1.00 0.00 C ATOM 35 C ASP A 3 11.883 -2.283 19.693 1.00 0.00 C ATOM 36 O ASP A 3 11.738 -1.775 20.808 1.00 0.00 O ATOM 37 CB ASP A 3 13.687 -1.020 18.431 1.00 0.00 C ATOM 38 CG ASP A 3 13.801 0.106 19.474 1.00 0.00 C ATOM 39 OD1 ASP A 3 14.717 0.047 20.332 1.00 0.00 O ATOM 40 OD2 ASP A 3 13.004 1.073 19.416 1.00 0.00 O ATOM 0 H ASP A 3 13.389 -3.036 17.071 1.00 0.00 H new ATOM 0 HA ASP A 3 13.949 -2.631 19.883 1.00 0.00 H new ATOM 0 HB2 ASP A 3 14.641 -1.131 17.916 1.00 0.00 H new ATOM 0 HB3 ASP A 3 12.949 -0.741 17.679 1.00 0.00 H new ATOM 45 N SER A 4 10.848 -2.779 19.004 1.00 0.00 N ATOM 46 CA SER A 4 9.424 -2.580 19.344 1.00 0.00 C ATOM 47 C SER A 4 8.561 -3.854 19.281 1.00 0.00 C ATOM 48 O SER A 4 7.346 -3.789 19.475 1.00 0.00 O ATOM 49 CB SER A 4 8.845 -1.484 18.436 1.00 0.00 C ATOM 50 OG SER A 4 9.033 -1.795 17.063 1.00 0.00 O ATOM 0 H SER A 4 10.977 -3.348 18.168 1.00 0.00 H new ATOM 0 HA SER A 4 9.392 -2.278 20.391 1.00 0.00 H new ATOM 0 HB2 SER A 4 7.781 -1.364 18.641 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.323 -0.531 18.663 1.00 0.00 H new ATOM 0 HG SER A 4 8.223 -2.218 16.710 1.00 0.00 H new ATOM 56 N GLU A 5 9.175 -5.012 19.015 1.00 0.00 N ATOM 57 CA GLU A 5 8.558 -6.286 18.605 1.00 0.00 C ATOM 58 C GLU A 5 7.755 -6.186 17.294 1.00 0.00 C ATOM 59 O GLU A 5 8.178 -6.714 16.260 1.00 0.00 O ATOM 60 CB GLU A 5 7.791 -6.939 19.770 1.00 0.00 C ATOM 61 CG GLU A 5 7.362 -8.369 19.468 1.00 0.00 C ATOM 62 CD GLU A 5 6.677 -9.023 20.684 1.00 0.00 C ATOM 63 OE1 GLU A 5 5.435 -8.903 20.827 1.00 0.00 O ATOM 64 OE2 GLU A 5 7.373 -9.670 21.505 1.00 0.00 O ATOM 0 H GLU A 5 10.189 -5.093 19.085 1.00 0.00 H new ATOM 0 HA GLU A 5 9.370 -6.969 18.357 1.00 0.00 H new ATOM 0 HB2 GLU A 5 8.419 -6.934 20.661 1.00 0.00 H new ATOM 0 HB3 GLU A 5 6.909 -6.341 19.999 1.00 0.00 H new ATOM 0 HG2 GLU A 5 6.679 -8.373 18.619 1.00 0.00 H new ATOM 0 HG3 GLU A 5 8.233 -8.958 19.180 1.00 0.00 H new ATOM 71 N LYS A 6 6.628 -5.470 17.308 1.00 0.00 N ATOM 72 CA LYS A 6 5.789 -5.204 16.130 1.00 0.00 C ATOM 73 C LYS A 6 6.418 -4.123 15.235 1.00 0.00 C ATOM 74 O LYS A 6 6.863 -3.083 15.724 1.00 0.00 O ATOM 75 CB LYS A 6 4.365 -4.830 16.587 1.00 0.00 C ATOM 76 CG LYS A 6 3.395 -4.769 15.397 1.00 0.00 C ATOM 77 CD LYS A 6 2.033 -4.158 15.753 1.00 0.00 C ATOM 78 CE LYS A 6 1.222 -3.853 14.483 1.00 0.00 C ATOM 79 NZ LYS A 6 1.801 -2.719 13.710 1.00 0.00 N ATOM 0 H LYS A 6 6.261 -5.047 18.160 1.00 0.00 H new ATOM 0 HA LYS A 6 5.723 -6.106 15.522 1.00 0.00 H new ATOM 0 HB2 LYS A 6 4.009 -5.562 17.312 1.00 0.00 H new ATOM 0 HB3 LYS A 6 4.385 -3.865 17.093 1.00 0.00 H new ATOM 0 HG2 LYS A 6 3.849 -4.185 14.597 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.243 -5.776 15.009 1.00 0.00 H new ATOM 0 HD2 LYS A 6 1.476 -4.846 16.389 1.00 0.00 H new ATOM 0 HD3 LYS A 6 2.179 -3.242 16.325 1.00 0.00 H new ATOM 0 HE2 LYS A 6 1.188 -4.742 13.853 1.00 0.00 H new ATOM 0 HE3 LYS A 6 0.194 -3.617 14.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 1.234 -2.558 12.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 1.795 -1.860 14.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 2.779 -2.947 13.440 1.00 0.00 H new ATOM 93 N SER A 7 6.421 -4.360 13.924 1.00 0.00 N ATOM 94 CA SER A 7 6.842 -3.402 12.885 1.00 0.00 C ATOM 95 C SER A 7 5.731 -2.394 12.539 1.00 0.00 C ATOM 96 O SER A 7 4.551 -2.630 12.817 1.00 0.00 O ATOM 97 CB SER A 7 7.293 -4.169 11.639 1.00 0.00 C ATOM 98 OG SER A 7 8.310 -5.103 11.972 1.00 0.00 O ATOM 0 H SER A 7 6.121 -5.254 13.535 1.00 0.00 H new ATOM 0 HA SER A 7 7.677 -2.821 13.276 1.00 0.00 H new ATOM 0 HB2 SER A 7 6.443 -4.690 11.197 1.00 0.00 H new ATOM 0 HB3 SER A 7 7.664 -3.470 10.889 1.00 0.00 H new ATOM 0 HG SER A 7 8.522 -5.650 11.187 1.00 0.00 H new ATOM 104 N ALA A 8 6.074 -1.254 11.932 1.00 0.00 N ATOM 105 CA ALA A 8 5.184 -0.084 11.849 1.00 0.00 C ATOM 106 C ALA A 8 4.126 -0.115 10.713 1.00 0.00 C ATOM 107 O ALA A 8 3.715 0.933 10.209 1.00 0.00 O ATOM 108 CB ALA A 8 6.052 1.180 11.832 1.00 0.00 C ATOM 0 H ALA A 8 6.978 -1.113 11.482 1.00 0.00 H new ATOM 0 HA ALA A 8 4.551 -0.097 12.737 1.00 0.00 H new ATOM 0 HB1 ALA A 8 5.412 2.060 11.771 1.00 0.00 H new ATOM 0 HB2 ALA A 8 6.646 1.226 12.745 1.00 0.00 H new ATOM 0 HB3 ALA A 8 6.716 1.154 10.968 1.00 0.00 H new ATOM 114 N THR A 9 3.664 -1.302 10.307 1.00 0.00 N ATOM 115 CA THR A 9 2.589 -1.498 9.312 1.00 0.00 C ATOM 116 C THR A 9 1.195 -1.540 9.954 1.00 0.00 C ATOM 117 O THR A 9 1.041 -1.887 11.130 1.00 0.00 O ATOM 118 CB THR A 9 2.805 -2.785 8.498 1.00 0.00 C ATOM 119 OG1 THR A 9 2.997 -3.887 9.362 1.00 0.00 O ATOM 120 CG2 THR A 9 4.025 -2.704 7.587 1.00 0.00 C ATOM 0 H THR A 9 4.034 -2.181 10.668 1.00 0.00 H new ATOM 0 HA THR A 9 2.636 -0.635 8.648 1.00 0.00 H new ATOM 0 HB THR A 9 1.911 -2.909 7.887 1.00 0.00 H new ATOM 0 HG1 THR A 9 3.132 -4.700 8.831 1.00 0.00 H new ATOM 0 HG21 THR A 9 4.130 -3.639 7.036 1.00 0.00 H new ATOM 0 HG22 THR A 9 3.900 -1.880 6.884 1.00 0.00 H new ATOM 0 HG23 THR A 9 4.918 -2.535 8.189 1.00 0.00 H new ATOM 128 N ILE A 10 0.167 -1.218 9.166 1.00 0.00 N ATOM 129 CA ILE A 10 -1.264 -1.348 9.506 1.00 0.00 C ATOM 130 C ILE A 10 -2.038 -1.987 8.341 1.00 0.00 C ATOM 131 O ILE A 10 -1.556 -1.977 7.207 1.00 0.00 O ATOM 132 CB ILE A 10 -1.882 0.018 9.908 1.00 0.00 C ATOM 133 CG1 ILE A 10 -1.787 1.070 8.777 1.00 0.00 C ATOM 134 CG2 ILE A 10 -1.249 0.528 11.215 1.00 0.00 C ATOM 135 CD1 ILE A 10 -2.518 2.386 9.072 1.00 0.00 C ATOM 0 H ILE A 10 0.309 -0.842 8.229 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.344 -2.005 10.372 1.00 0.00 H new ATOM 0 HB ILE A 10 -2.946 -0.142 10.080 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -0.736 1.287 8.587 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -2.194 0.640 7.862 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -1.692 1.487 11.484 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.431 -0.192 12.013 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -0.175 0.651 11.075 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -2.400 3.065 8.228 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -3.578 2.186 9.231 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -2.097 2.843 9.967 1.00 0.00 H new ATOM 147 N LYS A 11 -3.250 -2.501 8.583 1.00 0.00 N ATOM 148 CA LYS A 11 -4.209 -2.855 7.518 1.00 0.00 C ATOM 149 C LYS A 11 -5.526 -2.082 7.628 1.00 0.00 C ATOM 150 O LYS A 11 -5.967 -1.743 8.727 1.00 0.00 O ATOM 151 CB LYS A 11 -4.387 -4.377 7.366 1.00 0.00 C ATOM 152 CG LYS A 11 -5.096 -5.073 8.540 1.00 0.00 C ATOM 153 CD LYS A 11 -5.449 -6.535 8.214 1.00 0.00 C ATOM 154 CE LYS A 11 -4.207 -7.405 7.971 1.00 0.00 C ATOM 155 NZ LYS A 11 -4.579 -8.798 7.618 1.00 0.00 N ATOM 0 H LYS A 11 -3.598 -2.685 9.524 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.767 -2.525 6.578 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -4.952 -4.572 6.454 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -3.404 -4.830 7.235 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.454 -5.042 9.421 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -6.006 -4.527 8.789 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -6.028 -6.957 9.036 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.085 -6.562 7.329 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.610 -6.972 7.168 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.584 -7.409 8.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -3.738 -9.407 7.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.303 -9.143 8.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.957 -8.822 6.649 1.00 0.00 H new ATOM 169 N VAL A 12 -6.122 -1.783 6.475 1.00 0.00 N ATOM 170 CA VAL A 12 -7.349 -0.985 6.305 1.00 0.00 C ATOM 171 C VAL A 12 -8.446 -1.805 5.613 1.00 0.00 C ATOM 172 O VAL A 12 -8.156 -2.773 4.907 1.00 0.00 O ATOM 173 CB VAL A 12 -7.064 0.338 5.561 1.00 0.00 C ATOM 174 CG1 VAL A 12 -6.162 1.250 6.402 1.00 0.00 C ATOM 175 CG2 VAL A 12 -6.400 0.151 4.190 1.00 0.00 C ATOM 0 H VAL A 12 -5.747 -2.105 5.583 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.716 -0.719 7.296 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.044 0.788 5.401 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.974 2.176 5.859 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.654 1.477 7.348 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.216 0.746 6.598 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.233 1.125 3.731 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.445 -0.360 4.315 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -7.050 -0.445 3.549 1.00 0.00 H new ATOM 185 N THR A 13 -9.711 -1.442 5.838 1.00 0.00 N ATOM 186 CA THR A 13 -10.896 -2.176 5.355 1.00 0.00 C ATOM 187 C THR A 13 -11.920 -1.265 4.687 1.00 0.00 C ATOM 188 O THR A 13 -11.921 -0.047 4.878 1.00 0.00 O ATOM 189 CB THR A 13 -11.573 -2.969 6.487 1.00 0.00 C ATOM 190 OG1 THR A 13 -11.975 -2.094 7.522 1.00 0.00 O ATOM 191 CG2 THR A 13 -10.652 -4.030 7.094 1.00 0.00 C ATOM 0 H THR A 13 -9.952 -0.609 6.375 1.00 0.00 H new ATOM 0 HA THR A 13 -10.525 -2.873 4.604 1.00 0.00 H new ATOM 0 HB THR A 13 -12.432 -3.469 6.041 1.00 0.00 H new ATOM 0 HG1 THR A 13 -12.406 -2.608 8.236 1.00 0.00 H new ATOM 0 HG21 THR A 13 -11.180 -4.559 7.887 1.00 0.00 H new ATOM 0 HG22 THR A 13 -10.354 -4.738 6.321 1.00 0.00 H new ATOM 0 HG23 THR A 13 -9.765 -3.549 7.507 1.00 0.00 H new ATOM 199 N ASP A 14 -12.822 -1.858 3.907 1.00 0.00 N ATOM 200 CA ASP A 14 -13.824 -1.159 3.094 1.00 0.00 C ATOM 201 C ASP A 14 -14.752 -0.212 3.889 1.00 0.00 C ATOM 202 O ASP A 14 -15.250 0.773 3.340 1.00 0.00 O ATOM 203 CB ASP A 14 -14.622 -2.204 2.297 1.00 0.00 C ATOM 204 CG ASP A 14 -15.807 -2.802 3.080 1.00 0.00 C ATOM 205 OD1 ASP A 14 -15.578 -3.566 4.045 1.00 0.00 O ATOM 206 OD2 ASP A 14 -16.974 -2.506 2.726 1.00 0.00 O ATOM 0 H ASP A 14 -12.880 -2.872 3.818 1.00 0.00 H new ATOM 0 HA ASP A 14 -13.288 -0.492 2.419 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -14.996 -1.743 1.383 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -13.952 -3.010 1.997 1.00 0.00 H new ATOM 211 N ALA A 15 -14.955 -0.480 5.184 1.00 0.00 N ATOM 212 CA ALA A 15 -15.769 0.337 6.087 1.00 0.00 C ATOM 213 C ALA A 15 -15.036 1.575 6.656 1.00 0.00 C ATOM 214 O ALA A 15 -15.694 2.485 7.170 1.00 0.00 O ATOM 215 CB ALA A 15 -16.275 -0.578 7.209 1.00 0.00 C ATOM 0 H ALA A 15 -14.546 -1.293 5.644 1.00 0.00 H new ATOM 0 HA ALA A 15 -16.597 0.756 5.515 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.887 -0.000 7.902 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.873 -1.382 6.781 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -15.425 -1.003 7.743 1.00 0.00 H new ATOM 221 N SER A 16 -13.699 1.623 6.568 1.00 0.00 N ATOM 222 CA SER A 16 -12.848 2.606 7.271 1.00 0.00 C ATOM 223 C SER A 16 -11.755 3.249 6.403 1.00 0.00 C ATOM 224 O SER A 16 -11.093 4.181 6.858 1.00 0.00 O ATOM 225 CB SER A 16 -12.200 1.948 8.499 1.00 0.00 C ATOM 226 OG SER A 16 -13.185 1.447 9.394 1.00 0.00 O ATOM 0 H SER A 16 -13.164 0.969 5.996 1.00 0.00 H new ATOM 0 HA SER A 16 -13.517 3.416 7.561 1.00 0.00 H new ATOM 0 HB2 SER A 16 -11.549 1.135 8.178 1.00 0.00 H new ATOM 0 HB3 SER A 16 -11.572 2.674 9.015 1.00 0.00 H new ATOM 0 HG SER A 16 -12.745 1.032 10.165 1.00 0.00 H new ATOM 232 N PHE A 17 -11.573 2.813 5.150 1.00 0.00 N ATOM 233 CA PHE A 17 -10.505 3.263 4.246 1.00 0.00 C ATOM 234 C PHE A 17 -10.470 4.788 4.086 1.00 0.00 C ATOM 235 O PHE A 17 -9.402 5.396 4.133 1.00 0.00 O ATOM 236 CB PHE A 17 -10.702 2.584 2.880 1.00 0.00 C ATOM 237 CG PHE A 17 -9.527 2.714 1.926 1.00 0.00 C ATOM 238 CD1 PHE A 17 -9.329 3.891 1.174 1.00 0.00 C ATOM 239 CD2 PHE A 17 -8.645 1.631 1.763 1.00 0.00 C ATOM 240 CE1 PHE A 17 -8.249 3.981 0.277 1.00 0.00 C ATOM 241 CE2 PHE A 17 -7.590 1.709 0.840 1.00 0.00 C ATOM 242 CZ PHE A 17 -7.386 2.887 0.101 1.00 0.00 C ATOM 0 H PHE A 17 -12.183 2.116 4.724 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.547 2.979 4.681 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -10.904 1.525 3.043 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -11.586 3.008 2.404 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.007 4.724 1.287 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -8.780 0.735 2.351 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.083 4.893 -0.277 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.934 0.863 0.698 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.567 2.951 -0.601 1.00 0.00 H new ATOM 252 N ALA A 18 -11.635 5.430 3.957 1.00 0.00 N ATOM 253 CA ALA A 18 -11.715 6.882 3.824 1.00 0.00 C ATOM 254 C ALA A 18 -11.292 7.630 5.104 1.00 0.00 C ATOM 255 O ALA A 18 -10.690 8.701 5.023 1.00 0.00 O ATOM 256 CB ALA A 18 -13.126 7.261 3.364 1.00 0.00 C ATOM 0 H ALA A 18 -12.540 4.960 3.942 1.00 0.00 H new ATOM 0 HA ALA A 18 -10.996 7.200 3.069 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.197 8.344 3.261 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.334 6.791 2.403 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.853 6.918 4.100 1.00 0.00 H new ATOM 262 N THR A 19 -11.542 7.054 6.282 1.00 0.00 N ATOM 263 CA THR A 19 -11.136 7.615 7.584 1.00 0.00 C ATOM 264 C THR A 19 -9.653 7.358 7.881 1.00 0.00 C ATOM 265 O THR A 19 -8.998 8.191 8.506 1.00 0.00 O ATOM 266 CB THR A 19 -12.007 7.027 8.712 1.00 0.00 C ATOM 267 OG1 THR A 19 -13.377 7.111 8.365 1.00 0.00 O ATOM 268 CG2 THR A 19 -11.844 7.768 10.041 1.00 0.00 C ATOM 0 H THR A 19 -12.041 6.168 6.365 1.00 0.00 H new ATOM 0 HA THR A 19 -11.283 8.694 7.535 1.00 0.00 H new ATOM 0 HB THR A 19 -11.677 5.995 8.833 1.00 0.00 H new ATOM 0 HG1 THR A 19 -13.921 6.733 9.087 1.00 0.00 H new ATOM 0 HG21 THR A 19 -12.482 7.307 10.795 1.00 0.00 H new ATOM 0 HG22 THR A 19 -10.804 7.713 10.363 1.00 0.00 H new ATOM 0 HG23 THR A 19 -12.129 8.812 9.913 1.00 0.00 H new ATOM 276 N ASP A 20 -9.095 6.237 7.413 1.00 0.00 N ATOM 277 CA ASP A 20 -7.702 5.850 7.676 1.00 0.00 C ATOM 278 C ASP A 20 -6.706 6.435 6.658 1.00 0.00 C ATOM 279 O ASP A 20 -5.644 6.931 7.040 1.00 0.00 O ATOM 280 CB ASP A 20 -7.584 4.317 7.709 1.00 0.00 C ATOM 281 CG ASP A 20 -8.297 3.660 8.905 1.00 0.00 C ATOM 282 OD1 ASP A 20 -8.250 4.211 10.032 1.00 0.00 O ATOM 283 OD2 ASP A 20 -8.861 2.553 8.732 1.00 0.00 O ATOM 0 H ASP A 20 -9.601 5.565 6.835 1.00 0.00 H new ATOM 0 HA ASP A 20 -7.436 6.269 8.646 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.997 3.911 6.785 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.529 4.044 7.734 1.00 0.00 H new ATOM 288 N VAL A 21 -7.041 6.377 5.364 1.00 0.00 N ATOM 289 CA VAL A 21 -6.162 6.763 4.246 1.00 0.00 C ATOM 290 C VAL A 21 -6.475 8.175 3.745 1.00 0.00 C ATOM 291 O VAL A 21 -5.582 9.019 3.658 1.00 0.00 O ATOM 292 CB VAL A 21 -6.268 5.733 3.098 1.00 0.00 C ATOM 293 CG1 VAL A 21 -5.279 6.025 1.965 1.00 0.00 C ATOM 294 CG2 VAL A 21 -6.004 4.298 3.579 1.00 0.00 C ATOM 0 H VAL A 21 -7.956 6.051 5.053 1.00 0.00 H new ATOM 0 HA VAL A 21 -5.136 6.770 4.613 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.291 5.822 2.733 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.391 5.275 1.182 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -5.480 7.013 1.552 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -4.261 5.995 2.354 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -6.090 3.611 2.737 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -5.000 4.234 3.999 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.735 4.030 4.342 1.00 0.00 H new ATOM 304 N LEU A 22 -7.747 8.456 3.438 1.00 0.00 N ATOM 305 CA LEU A 22 -8.161 9.691 2.751 1.00 0.00 C ATOM 306 C LEU A 22 -8.368 10.892 3.695 1.00 0.00 C ATOM 307 O LEU A 22 -8.422 12.035 3.237 1.00 0.00 O ATOM 308 CB LEU A 22 -9.385 9.433 1.851 1.00 0.00 C ATOM 309 CG LEU A 22 -9.269 8.204 0.928 1.00 0.00 C ATOM 310 CD1 LEU A 22 -10.557 8.030 0.120 1.00 0.00 C ATOM 311 CD2 LEU A 22 -8.106 8.270 -0.060 1.00 0.00 C ATOM 0 H LEU A 22 -8.523 7.832 3.659 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.327 9.983 2.113 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -10.263 9.311 2.485 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.557 10.316 1.235 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.089 7.361 1.596 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -10.465 7.159 -0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -11.397 7.888 0.800 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -10.728 8.919 -0.488 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -8.096 7.367 -0.671 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.224 9.142 -0.703 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.167 8.347 0.488 1.00 0.00 H new ATOM 323 N SER A 23 -8.432 10.657 5.011 1.00 0.00 N ATOM 324 CA SER A 23 -8.484 11.710 6.040 1.00 0.00 C ATOM 325 C SER A 23 -7.095 12.295 6.371 1.00 0.00 C ATOM 326 O SER A 23 -6.984 13.320 7.049 1.00 0.00 O ATOM 327 CB SER A 23 -9.150 11.150 7.303 1.00 0.00 C ATOM 328 OG SER A 23 -9.671 12.190 8.113 1.00 0.00 O ATOM 0 H SER A 23 -8.450 9.714 5.400 1.00 0.00 H new ATOM 0 HA SER A 23 -9.074 12.535 5.640 1.00 0.00 H new ATOM 0 HB2 SER A 23 -9.952 10.468 7.022 1.00 0.00 H new ATOM 0 HB3 SER A 23 -8.424 10.570 7.873 1.00 0.00 H new ATOM 0 HG SER A 23 -9.044 12.943 8.122 1.00 0.00 H new ATOM 334 N SER A 24 -6.017 11.647 5.908 1.00 0.00 N ATOM 335 CA SER A 24 -4.633 11.975 6.275 1.00 0.00 C ATOM 336 C SER A 24 -4.138 13.312 5.706 1.00 0.00 C ATOM 337 O SER A 24 -4.422 13.661 4.557 1.00 0.00 O ATOM 338 CB SER A 24 -3.695 10.852 5.839 1.00 0.00 C ATOM 339 OG SER A 24 -2.410 11.092 6.380 1.00 0.00 O ATOM 0 H SER A 24 -6.084 10.866 5.256 1.00 0.00 H new ATOM 0 HA SER A 24 -4.627 12.080 7.360 1.00 0.00 H new ATOM 0 HB2 SER A 24 -4.075 9.889 6.182 1.00 0.00 H new ATOM 0 HB3 SER A 24 -3.643 10.805 4.751 1.00 0.00 H new ATOM 0 HG SER A 24 -1.845 10.303 6.244 1.00 0.00 H new ATOM 345 N ASN A 25 -3.339 14.032 6.502 1.00 0.00 N ATOM 346 CA ASN A 25 -2.639 15.267 6.126 1.00 0.00 C ATOM 347 C ASN A 25 -1.185 15.038 5.643 1.00 0.00 C ATOM 348 O ASN A 25 -0.470 16.000 5.350 1.00 0.00 O ATOM 349 CB ASN A 25 -2.737 16.279 7.287 1.00 0.00 C ATOM 350 CG ASN A 25 -1.943 15.910 8.535 1.00 0.00 C ATOM 351 OD1 ASN A 25 -1.399 14.823 8.684 1.00 0.00 O ATOM 352 ND2 ASN A 25 -1.865 16.806 9.492 1.00 0.00 N ATOM 0 H ASN A 25 -3.154 13.759 7.467 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.139 15.685 5.252 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -2.394 17.251 6.931 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -3.786 16.392 7.562 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -1.355 16.593 10.349 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -2.315 17.714 9.378 1.00 0.00 H new ATOM 359 N LYS A 26 -0.748 13.774 5.554 1.00 0.00 N ATOM 360 CA LYS A 26 0.573 13.323 5.069 1.00 0.00 C ATOM 361 C LYS A 26 0.423 12.272 3.951 1.00 0.00 C ATOM 362 O LYS A 26 -0.682 11.759 3.752 1.00 0.00 O ATOM 363 CB LYS A 26 1.420 12.803 6.255 1.00 0.00 C ATOM 364 CG LYS A 26 0.795 11.592 6.971 1.00 0.00 C ATOM 365 CD LYS A 26 1.706 10.949 8.025 1.00 0.00 C ATOM 366 CE LYS A 26 2.906 10.220 7.400 1.00 0.00 C ATOM 367 NZ LYS A 26 3.512 9.277 8.374 1.00 0.00 N ATOM 0 H LYS A 26 -1.338 12.990 5.834 1.00 0.00 H new ATOM 0 HA LYS A 26 1.100 14.170 4.630 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.410 12.529 5.891 1.00 0.00 H new ATOM 0 HB3 LYS A 26 1.557 13.610 6.975 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.132 11.906 7.450 1.00 0.00 H new ATOM 0 HG3 LYS A 26 0.531 10.840 6.227 1.00 0.00 H new ATOM 0 HD2 LYS A 26 2.068 11.719 8.706 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.126 10.243 8.620 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.585 9.677 6.511 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.652 10.947 7.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 4.445 8.974 8.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 3.619 9.750 9.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 2.896 8.446 8.481 1.00 0.00 H new ATOM 381 N PRO A 27 1.490 11.933 3.205 1.00 0.00 N ATOM 382 CA PRO A 27 1.464 10.812 2.269 1.00 0.00 C ATOM 383 C PRO A 27 1.122 9.472 2.937 1.00 0.00 C ATOM 384 O PRO A 27 1.625 9.152 4.020 1.00 0.00 O ATOM 385 CB PRO A 27 2.844 10.786 1.607 1.00 0.00 C ATOM 386 CG PRO A 27 3.315 12.234 1.725 1.00 0.00 C ATOM 387 CD PRO A 27 2.745 12.659 3.078 1.00 0.00 C ATOM 0 HA PRO A 27 0.670 10.951 1.536 1.00 0.00 H new ATOM 0 HB2 PRO A 27 3.521 10.100 2.115 1.00 0.00 H new ATOM 0 HB3 PRO A 27 2.786 10.465 0.567 1.00 0.00 H new ATOM 0 HG2 PRO A 27 4.402 12.310 1.701 1.00 0.00 H new ATOM 0 HG3 PRO A 27 2.934 12.852 0.912 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.429 12.410 3.890 1.00 0.00 H new ATOM 0 HD3 PRO A 27 2.583 13.736 3.117 1.00 0.00 H new ATOM 395 N VAL A 28 0.293 8.668 2.268 1.00 0.00 N ATOM 396 CA VAL A 28 -0.123 7.325 2.708 1.00 0.00 C ATOM 397 C VAL A 28 0.015 6.351 1.541 1.00 0.00 C ATOM 398 O VAL A 28 -0.470 6.612 0.441 1.00 0.00 O ATOM 399 CB VAL A 28 -1.559 7.296 3.276 1.00 0.00 C ATOM 400 CG1 VAL A 28 -1.883 5.918 3.875 1.00 0.00 C ATOM 401 CG2 VAL A 28 -1.772 8.333 4.383 1.00 0.00 C ATOM 0 H VAL A 28 -0.123 8.938 1.377 1.00 0.00 H new ATOM 0 HA VAL A 28 0.532 7.025 3.526 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.214 7.523 2.435 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.899 5.922 4.269 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -1.797 5.155 3.101 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.183 5.698 4.681 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.797 8.271 4.748 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -1.082 8.136 5.204 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.588 9.332 3.986 1.00 0.00 H new ATOM 411 N LEU A 29 0.683 5.226 1.775 1.00 0.00 N ATOM 412 CA LEU A 29 1.040 4.231 0.769 1.00 0.00 C ATOM 413 C LEU A 29 0.342 2.910 1.097 1.00 0.00 C ATOM 414 O LEU A 29 0.605 2.318 2.142 1.00 0.00 O ATOM 415 CB LEU A 29 2.579 4.144 0.751 1.00 0.00 C ATOM 416 CG LEU A 29 3.237 3.284 -0.345 1.00 0.00 C ATOM 417 CD1 LEU A 29 3.431 1.839 0.106 1.00 0.00 C ATOM 418 CD2 LEU A 29 2.475 3.248 -1.669 1.00 0.00 C ATOM 0 H LEU A 29 1.004 4.972 2.709 1.00 0.00 H new ATOM 0 HA LEU A 29 0.706 4.499 -0.233 1.00 0.00 H new ATOM 0 HB2 LEU A 29 2.971 5.157 0.662 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.904 3.760 1.718 1.00 0.00 H new ATOM 0 HG LEU A 29 4.194 3.778 -0.513 1.00 0.00 H new ATOM 0 HD11 LEU A 29 3.898 1.267 -0.696 1.00 0.00 H new ATOM 0 HD12 LEU A 29 4.071 1.816 0.988 1.00 0.00 H new ATOM 0 HD13 LEU A 29 2.463 1.400 0.349 1.00 0.00 H new ATOM 0 HD21 LEU A 29 3.011 2.620 -2.380 1.00 0.00 H new ATOM 0 HD22 LEU A 29 1.478 2.840 -1.504 1.00 0.00 H new ATOM 0 HD23 LEU A 29 2.392 4.259 -2.069 1.00 0.00 H new ATOM 430 N VAL A 30 -0.565 2.461 0.226 1.00 0.00 N ATOM 431 CA VAL A 30 -1.399 1.274 0.464 1.00 0.00 C ATOM 432 C VAL A 30 -0.998 0.133 -0.468 1.00 0.00 C ATOM 433 O VAL A 30 -1.067 0.263 -1.690 1.00 0.00 O ATOM 434 CB VAL A 30 -2.903 1.579 0.348 1.00 0.00 C ATOM 435 CG1 VAL A 30 -3.715 0.388 0.879 1.00 0.00 C ATOM 436 CG2 VAL A 30 -3.326 2.828 1.135 1.00 0.00 C ATOM 0 H VAL A 30 -0.745 2.912 -0.671 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.220 0.961 1.493 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.099 1.760 -0.709 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.779 0.607 0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.481 -0.502 0.294 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.462 0.212 1.924 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.397 2.989 1.013 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.098 2.687 2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.783 3.696 0.760 1.00 0.00 H new ATOM 446 N ASP A 31 -0.609 -0.999 0.116 1.00 0.00 N ATOM 447 CA ASP A 31 -0.314 -2.255 -0.575 1.00 0.00 C ATOM 448 C ASP A 31 -1.575 -3.134 -0.663 1.00 0.00 C ATOM 449 O ASP A 31 -2.024 -3.720 0.324 1.00 0.00 O ATOM 450 CB ASP A 31 0.838 -2.946 0.168 1.00 0.00 C ATOM 451 CG ASP A 31 1.173 -4.346 -0.372 1.00 0.00 C ATOM 452 OD1 ASP A 31 1.102 -4.553 -1.605 1.00 0.00 O ATOM 453 OD2 ASP A 31 1.544 -5.221 0.447 1.00 0.00 O ATOM 0 H ASP A 31 -0.485 -1.070 1.126 1.00 0.00 H new ATOM 0 HA ASP A 31 -0.005 -2.069 -1.604 1.00 0.00 H new ATOM 0 HB2 ASP A 31 1.727 -2.319 0.103 1.00 0.00 H new ATOM 0 HB3 ASP A 31 0.581 -3.026 1.224 1.00 0.00 H new ATOM 458 N PHE A 32 -2.155 -3.222 -1.857 1.00 0.00 N ATOM 459 CA PHE A 32 -3.267 -4.110 -2.187 1.00 0.00 C ATOM 460 C PHE A 32 -2.713 -5.512 -2.451 1.00 0.00 C ATOM 461 O PHE A 32 -1.939 -5.722 -3.393 1.00 0.00 O ATOM 462 CB PHE A 32 -4.054 -3.555 -3.380 1.00 0.00 C ATOM 463 CG PHE A 32 -4.929 -2.364 -3.033 1.00 0.00 C ATOM 464 CD1 PHE A 32 -4.357 -1.109 -2.737 1.00 0.00 C ATOM 465 CD2 PHE A 32 -6.327 -2.514 -2.988 1.00 0.00 C ATOM 466 CE1 PHE A 32 -5.182 -0.026 -2.390 1.00 0.00 C ATOM 467 CE2 PHE A 32 -7.148 -1.419 -2.669 1.00 0.00 C ATOM 468 CZ PHE A 32 -6.575 -0.172 -2.374 1.00 0.00 C ATOM 0 H PHE A 32 -1.853 -2.657 -2.650 1.00 0.00 H new ATOM 0 HA PHE A 32 -3.968 -4.172 -1.354 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.353 -3.264 -4.163 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.680 -4.347 -3.791 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -3.285 -0.981 -2.777 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -6.771 -3.475 -3.200 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.739 0.925 -2.134 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -8.221 -1.537 -2.651 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.206 0.672 -2.136 1.00 0.00 H new ATOM 478 N TRP A 33 -3.079 -6.454 -1.581 1.00 0.00 N ATOM 479 CA TRP A 33 -2.415 -7.751 -1.453 1.00 0.00 C ATOM 480 C TRP A 33 -3.373 -8.878 -1.039 1.00 0.00 C ATOM 481 O TRP A 33 -4.489 -8.634 -0.577 1.00 0.00 O ATOM 482 CB TRP A 33 -1.280 -7.620 -0.420 1.00 0.00 C ATOM 483 CG TRP A 33 -1.688 -7.858 1.004 1.00 0.00 C ATOM 484 CD1 TRP A 33 -2.537 -7.086 1.714 1.00 0.00 C ATOM 485 CD2 TRP A 33 -1.356 -8.986 1.872 1.00 0.00 C ATOM 486 NE1 TRP A 33 -2.788 -7.671 2.938 1.00 0.00 N ATOM 487 CE2 TRP A 33 -2.084 -8.844 3.091 1.00 0.00 C ATOM 488 CE3 TRP A 33 -0.516 -10.116 1.756 1.00 0.00 C ATOM 489 CZ2 TRP A 33 -1.994 -9.777 4.134 1.00 0.00 C ATOM 490 CZ3 TRP A 33 -0.408 -11.053 2.802 1.00 0.00 C ATOM 491 CH2 TRP A 33 -1.147 -10.890 3.987 1.00 0.00 C ATOM 0 H TRP A 33 -3.859 -6.335 -0.934 1.00 0.00 H new ATOM 0 HA TRP A 33 -2.023 -8.025 -2.433 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.490 -8.326 -0.679 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -0.852 -6.620 -0.497 1.00 0.00 H new ATOM 0 HD1 TRP A 33 -2.957 -6.151 1.375 1.00 0.00 H new ATOM 0 HE1 TRP A 33 -3.416 -7.283 3.641 1.00 0.00 H new ATOM 0 HE3 TRP A 33 0.053 -10.264 0.850 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -2.568 -9.643 5.039 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 0.248 -11.904 2.693 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -1.064 -11.617 4.781 1.00 0.00 H new ATOM 502 N ALA A 34 -2.893 -10.119 -1.131 1.00 0.00 N ATOM 503 CA ALA A 34 -3.461 -11.277 -0.444 1.00 0.00 C ATOM 504 C ALA A 34 -2.371 -12.317 -0.142 1.00 0.00 C ATOM 505 O ALA A 34 -1.382 -12.425 -0.873 1.00 0.00 O ATOM 506 CB ALA A 34 -4.575 -11.892 -1.298 1.00 0.00 C ATOM 0 H ALA A 34 -2.079 -10.351 -1.700 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.885 -10.950 0.505 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.995 -12.755 -0.781 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -5.358 -11.152 -1.463 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -4.166 -12.208 -2.258 1.00 0.00 H new ATOM 512 N THR A 35 -2.578 -13.131 0.897 1.00 0.00 N ATOM 513 CA THR A 35 -1.634 -14.193 1.298 1.00 0.00 C ATOM 514 C THR A 35 -1.498 -15.312 0.252 1.00 0.00 C ATOM 515 O THR A 35 -0.480 -16.007 0.212 1.00 0.00 O ATOM 516 CB THR A 35 -2.006 -14.734 2.691 1.00 0.00 C ATOM 517 OG1 THR A 35 -0.952 -15.509 3.221 1.00 0.00 O ATOM 518 CG2 THR A 35 -3.271 -15.594 2.707 1.00 0.00 C ATOM 0 H THR A 35 -3.406 -13.077 1.490 1.00 0.00 H new ATOM 0 HA THR A 35 -0.643 -13.743 1.357 1.00 0.00 H new ATOM 0 HB THR A 35 -2.194 -13.847 3.296 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.205 -15.843 4.107 1.00 0.00 H new ATOM 0 HG21 THR A 35 -3.465 -15.937 3.723 1.00 0.00 H new ATOM 0 HG22 THR A 35 -4.117 -15.003 2.355 1.00 0.00 H new ATOM 0 HG23 THR A 35 -3.133 -16.456 2.054 1.00 0.00 H new ATOM 526 N TRP A 36 -2.479 -15.448 -0.652 1.00 0.00 N ATOM 527 CA TRP A 36 -2.434 -16.375 -1.791 1.00 0.00 C ATOM 528 C TRP A 36 -1.521 -15.923 -2.946 1.00 0.00 C ATOM 529 O TRP A 36 -1.243 -16.717 -3.846 1.00 0.00 O ATOM 530 CB TRP A 36 -3.862 -16.698 -2.268 1.00 0.00 C ATOM 531 CG TRP A 36 -4.811 -15.576 -2.608 1.00 0.00 C ATOM 532 CD1 TRP A 36 -5.917 -15.272 -1.889 1.00 0.00 C ATOM 533 CD2 TRP A 36 -4.848 -14.672 -3.767 1.00 0.00 C ATOM 534 NE1 TRP A 36 -6.661 -14.312 -2.536 1.00 0.00 N ATOM 535 CE2 TRP A 36 -6.043 -13.886 -3.688 1.00 0.00 C ATOM 536 CE3 TRP A 36 -4.010 -14.427 -4.881 1.00 0.00 C ATOM 537 CZ2 TRP A 36 -6.391 -12.929 -4.652 1.00 0.00 C ATOM 538 CZ3 TRP A 36 -4.331 -13.439 -5.837 1.00 0.00 C ATOM 539 CH2 TRP A 36 -5.524 -12.702 -5.733 1.00 0.00 C ATOM 0 H TRP A 36 -3.342 -14.906 -0.611 1.00 0.00 H new ATOM 0 HA TRP A 36 -1.967 -17.290 -1.427 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -3.774 -17.329 -3.153 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -4.335 -17.300 -1.493 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -6.178 -15.720 -0.942 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -7.559 -13.960 -2.203 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -3.107 -15.007 -5.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -7.313 -12.374 -4.564 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -3.654 -13.247 -6.656 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -5.772 -11.964 -6.482 1.00 0.00 H new ATOM 550 N CYS A 37 -1.029 -14.678 -2.933 1.00 0.00 N ATOM 551 CA CYS A 37 -0.135 -14.141 -3.963 1.00 0.00 C ATOM 552 C CYS A 37 1.335 -14.213 -3.509 1.00 0.00 C ATOM 553 O CYS A 37 1.767 -13.474 -2.620 1.00 0.00 O ATOM 554 CB CYS A 37 -0.609 -12.724 -4.307 1.00 0.00 C ATOM 555 SG CYS A 37 0.396 -12.017 -5.644 1.00 0.00 S ATOM 0 H CYS A 37 -1.245 -14.007 -2.196 1.00 0.00 H new ATOM 0 HA CYS A 37 -0.177 -14.742 -4.872 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.657 -12.749 -4.607 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.545 -12.089 -3.423 1.00 0.00 H new ATOM 0 HG CYS A 37 1.656 -12.212 -5.390 1.00 0.00 H new ATOM 561 N GLY A 38 2.127 -15.080 -4.150 1.00 0.00 N ATOM 562 CA GLY A 38 3.564 -15.232 -3.880 1.00 0.00 C ATOM 563 C GLY A 38 4.352 -13.920 -4.024 1.00 0.00 C ATOM 564 O GLY A 38 5.043 -13.538 -3.081 1.00 0.00 O ATOM 0 H GLY A 38 1.785 -15.704 -4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.698 -15.619 -2.870 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.978 -15.973 -4.563 1.00 0.00 H new ATOM 568 N PRO A 39 4.195 -13.154 -5.121 1.00 0.00 N ATOM 569 CA PRO A 39 4.786 -11.821 -5.255 1.00 0.00 C ATOM 570 C PRO A 39 4.377 -10.819 -4.159 1.00 0.00 C ATOM 571 O PRO A 39 5.202 -10.001 -3.750 1.00 0.00 O ATOM 572 CB PRO A 39 4.370 -11.347 -6.648 1.00 0.00 C ATOM 573 CG PRO A 39 4.256 -12.646 -7.440 1.00 0.00 C ATOM 574 CD PRO A 39 3.678 -13.608 -6.405 1.00 0.00 C ATOM 0 HA PRO A 39 5.867 -11.879 -5.131 1.00 0.00 H new ATOM 0 HB2 PRO A 39 3.424 -10.806 -6.623 1.00 0.00 H new ATOM 0 HB3 PRO A 39 5.110 -10.675 -7.082 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.602 -12.539 -8.305 1.00 0.00 H new ATOM 0 HG3 PRO A 39 5.224 -12.982 -7.812 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.588 -13.590 -6.418 1.00 0.00 H new ATOM 0 HD3 PRO A 39 3.982 -14.634 -6.610 1.00 0.00 H new ATOM 582 N CYS A 40 3.153 -10.896 -3.613 1.00 0.00 N ATOM 583 CA CYS A 40 2.769 -10.086 -2.446 1.00 0.00 C ATOM 584 C CYS A 40 3.548 -10.513 -1.195 1.00 0.00 C ATOM 585 O CYS A 40 4.093 -9.670 -0.484 1.00 0.00 O ATOM 586 CB CYS A 40 1.265 -10.179 -2.169 1.00 0.00 C ATOM 587 SG CYS A 40 0.318 -9.278 -3.423 1.00 0.00 S ATOM 0 H CYS A 40 2.415 -11.509 -3.959 1.00 0.00 H new ATOM 0 HA CYS A 40 3.017 -9.051 -2.682 1.00 0.00 H new ATOM 0 HB2 CYS A 40 0.958 -11.225 -2.158 1.00 0.00 H new ATOM 0 HB3 CYS A 40 1.047 -9.772 -1.182 1.00 0.00 H new ATOM 0 HG CYS A 40 0.145 -10.037 -4.464 1.00 0.00 H new ATOM 593 N LYS A 41 3.661 -11.825 -0.957 1.00 0.00 N ATOM 594 CA LYS A 41 4.439 -12.404 0.155 1.00 0.00 C ATOM 595 C LYS A 41 5.941 -12.084 0.042 1.00 0.00 C ATOM 596 O LYS A 41 6.609 -11.924 1.064 1.00 0.00 O ATOM 597 CB LYS A 41 4.159 -13.920 0.210 1.00 0.00 C ATOM 598 CG LYS A 41 2.688 -14.243 0.560 1.00 0.00 C ATOM 599 CD LYS A 41 2.453 -14.382 2.073 1.00 0.00 C ATOM 600 CE LYS A 41 2.666 -15.827 2.544 1.00 0.00 C ATOM 601 NZ LYS A 41 1.489 -16.682 2.232 1.00 0.00 N ATOM 0 H LYS A 41 3.208 -12.530 -1.539 1.00 0.00 H new ATOM 0 HA LYS A 41 4.123 -11.950 1.094 1.00 0.00 H new ATOM 0 HB2 LYS A 41 4.405 -14.366 -0.754 1.00 0.00 H new ATOM 0 HB3 LYS A 41 4.814 -14.380 0.950 1.00 0.00 H new ATOM 0 HG2 LYS A 41 2.045 -13.456 0.168 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.396 -15.169 0.065 1.00 0.00 H new ATOM 0 HD2 LYS A 41 3.131 -13.719 2.610 1.00 0.00 H new ATOM 0 HD3 LYS A 41 1.439 -14.065 2.316 1.00 0.00 H new ATOM 0 HE2 LYS A 41 3.554 -16.240 2.065 1.00 0.00 H new ATOM 0 HE3 LYS A 41 2.850 -15.837 3.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 1.673 -17.655 2.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 0.651 -16.311 2.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 1.319 -16.678 1.206 1.00 0.00 H new ATOM 615 N MET A 42 6.458 -11.920 -1.180 1.00 0.00 N ATOM 616 CA MET A 42 7.831 -11.477 -1.477 1.00 0.00 C ATOM 617 C MET A 42 8.056 -9.966 -1.267 1.00 0.00 C ATOM 618 O MET A 42 9.131 -9.581 -0.804 1.00 0.00 O ATOM 619 CB MET A 42 8.200 -11.857 -2.920 1.00 0.00 C ATOM 620 CG MET A 42 8.329 -13.371 -3.120 1.00 0.00 C ATOM 621 SD MET A 42 8.450 -13.865 -4.861 1.00 0.00 S ATOM 622 CE MET A 42 8.436 -15.666 -4.660 1.00 0.00 C ATOM 0 H MET A 42 5.914 -12.098 -2.024 1.00 0.00 H new ATOM 0 HA MET A 42 8.478 -11.989 -0.765 1.00 0.00 H new ATOM 0 HB2 MET A 42 7.441 -11.469 -3.599 1.00 0.00 H new ATOM 0 HB3 MET A 42 9.142 -11.378 -3.188 1.00 0.00 H new ATOM 0 HG2 MET A 42 9.212 -13.726 -2.588 1.00 0.00 H new ATOM 0 HG3 MET A 42 7.467 -13.863 -2.670 1.00 0.00 H new ATOM 0 HE1 MET A 42 8.504 -16.142 -5.638 1.00 0.00 H new ATOM 0 HE2 MET A 42 9.285 -15.970 -4.049 1.00 0.00 H new ATOM 0 HE3 MET A 42 7.510 -15.970 -4.172 1.00 0.00 H new ATOM 632 N VAL A 43 7.076 -9.104 -1.578 1.00 0.00 N ATOM 633 CA VAL A 43 7.201 -7.634 -1.420 1.00 0.00 C ATOM 634 C VAL A 43 6.812 -7.128 -0.021 1.00 0.00 C ATOM 635 O VAL A 43 7.321 -6.097 0.416 1.00 0.00 O ATOM 636 CB VAL A 43 6.474 -6.909 -2.576 1.00 0.00 C ATOM 637 CG1 VAL A 43 4.999 -6.605 -2.296 1.00 0.00 C ATOM 638 CG2 VAL A 43 7.184 -5.611 -2.967 1.00 0.00 C ATOM 0 H VAL A 43 6.172 -9.399 -1.947 1.00 0.00 H new ATOM 0 HA VAL A 43 8.259 -7.381 -1.493 1.00 0.00 H new ATOM 0 HB VAL A 43 6.509 -7.617 -3.404 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.563 -6.096 -3.156 1.00 0.00 H new ATOM 0 HG12 VAL A 43 4.463 -7.537 -2.116 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.920 -5.965 -1.417 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.642 -5.131 -3.782 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.215 -4.940 -2.108 1.00 0.00 H new ATOM 0 HG23 VAL A 43 8.201 -5.835 -3.289 1.00 0.00 H new ATOM 648 N ALA A 44 6.001 -7.876 0.732 1.00 0.00 N ATOM 649 CA ALA A 44 5.640 -7.586 2.125 1.00 0.00 C ATOM 650 C ALA A 44 6.834 -7.259 3.058 1.00 0.00 C ATOM 651 O ALA A 44 6.756 -6.237 3.743 1.00 0.00 O ATOM 652 CB ALA A 44 4.794 -8.749 2.663 1.00 0.00 C ATOM 0 H ALA A 44 5.563 -8.727 0.379 1.00 0.00 H new ATOM 0 HA ALA A 44 5.062 -6.662 2.121 1.00 0.00 H new ATOM 0 HB1 ALA A 44 4.517 -8.549 3.698 1.00 0.00 H new ATOM 0 HB2 ALA A 44 3.892 -8.852 2.060 1.00 0.00 H new ATOM 0 HB3 ALA A 44 5.371 -9.672 2.614 1.00 0.00 H new ATOM 658 N PRO A 45 7.956 -8.014 3.089 1.00 0.00 N ATOM 659 CA PRO A 45 9.116 -7.653 3.912 1.00 0.00 C ATOM 660 C PRO A 45 9.822 -6.363 3.456 1.00 0.00 C ATOM 661 O PRO A 45 10.396 -5.667 4.294 1.00 0.00 O ATOM 662 CB PRO A 45 10.054 -8.865 3.864 1.00 0.00 C ATOM 663 CG PRO A 45 9.687 -9.552 2.552 1.00 0.00 C ATOM 664 CD PRO A 45 8.182 -9.315 2.471 1.00 0.00 C ATOM 0 HA PRO A 45 8.796 -7.426 4.929 1.00 0.00 H new ATOM 0 HB2 PRO A 45 11.101 -8.562 3.879 1.00 0.00 H new ATOM 0 HB3 PRO A 45 9.901 -9.524 4.718 1.00 0.00 H new ATOM 0 HG2 PRO A 45 10.214 -9.116 1.703 1.00 0.00 H new ATOM 0 HG3 PRO A 45 9.931 -10.614 2.567 1.00 0.00 H new ATOM 0 HD2 PRO A 45 7.839 -9.322 1.436 1.00 0.00 H new ATOM 0 HD3 PRO A 45 7.633 -10.098 2.994 1.00 0.00 H new ATOM 672 N VAL A 46 9.750 -5.991 2.168 1.00 0.00 N ATOM 673 CA VAL A 46 10.290 -4.703 1.686 1.00 0.00 C ATOM 674 C VAL A 46 9.408 -3.561 2.198 1.00 0.00 C ATOM 675 O VAL A 46 9.903 -2.597 2.779 1.00 0.00 O ATOM 676 CB VAL A 46 10.448 -4.672 0.147 1.00 0.00 C ATOM 677 CG1 VAL A 46 10.900 -3.301 -0.335 1.00 0.00 C ATOM 678 CG2 VAL A 46 11.466 -5.719 -0.320 1.00 0.00 C ATOM 0 H VAL A 46 9.323 -6.562 1.439 1.00 0.00 H new ATOM 0 HA VAL A 46 11.296 -4.576 2.086 1.00 0.00 H new ATOM 0 HB VAL A 46 9.470 -4.897 -0.278 1.00 0.00 H new ATOM 0 HG11 VAL A 46 11.002 -3.312 -1.420 1.00 0.00 H new ATOM 0 HG12 VAL A 46 10.162 -2.553 -0.047 1.00 0.00 H new ATOM 0 HG13 VAL A 46 11.861 -3.055 0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 46 11.559 -5.677 -1.405 1.00 0.00 H new ATOM 0 HG22 VAL A 46 12.435 -5.513 0.135 1.00 0.00 H new ATOM 0 HG23 VAL A 46 11.129 -6.712 -0.023 1.00 0.00 H new ATOM 688 N LEU A 47 8.089 -3.712 2.059 1.00 0.00 N ATOM 689 CA LEU A 47 7.075 -2.767 2.536 1.00 0.00 C ATOM 690 C LEU A 47 7.129 -2.575 4.058 1.00 0.00 C ATOM 691 O LEU A 47 6.977 -1.454 4.530 1.00 0.00 O ATOM 692 CB LEU A 47 5.695 -3.294 2.095 1.00 0.00 C ATOM 693 CG LEU A 47 5.237 -2.903 0.676 1.00 0.00 C ATOM 694 CD1 LEU A 47 4.494 -1.565 0.714 1.00 0.00 C ATOM 695 CD2 LEU A 47 6.354 -2.780 -0.360 1.00 0.00 C ATOM 0 H LEU A 47 7.683 -4.524 1.595 1.00 0.00 H new ATOM 0 HA LEU A 47 7.267 -1.785 2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.706 -4.382 2.163 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.949 -2.938 2.806 1.00 0.00 H new ATOM 0 HG LEU A 47 4.598 -3.728 0.361 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.175 -1.297 -0.293 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.621 -1.652 1.361 1.00 0.00 H new ATOM 0 HD13 LEU A 47 5.157 -0.792 1.102 1.00 0.00 H new ATOM 0 HD21 LEU A 47 5.927 -2.502 -1.324 1.00 0.00 H new ATOM 0 HD22 LEU A 47 7.062 -2.015 -0.042 1.00 0.00 H new ATOM 0 HD23 LEU A 47 6.870 -3.736 -0.454 1.00 0.00 H new ATOM 707 N GLU A 48 7.396 -3.634 4.823 1.00 0.00 N ATOM 708 CA GLU A 48 7.539 -3.581 6.283 1.00 0.00 C ATOM 709 C GLU A 48 8.774 -2.771 6.726 1.00 0.00 C ATOM 710 O GLU A 48 8.703 -1.975 7.669 1.00 0.00 O ATOM 711 CB GLU A 48 7.588 -5.023 6.815 1.00 0.00 C ATOM 712 CG GLU A 48 7.371 -5.084 8.327 1.00 0.00 C ATOM 713 CD GLU A 48 7.561 -6.510 8.879 1.00 0.00 C ATOM 714 OE1 GLU A 48 6.824 -7.438 8.466 1.00 0.00 O ATOM 715 OE2 GLU A 48 8.435 -6.698 9.759 1.00 0.00 O ATOM 0 H GLU A 48 7.522 -4.571 4.441 1.00 0.00 H new ATOM 0 HA GLU A 48 6.681 -3.058 6.705 1.00 0.00 H new ATOM 0 HB2 GLU A 48 6.825 -5.620 6.315 1.00 0.00 H new ATOM 0 HB3 GLU A 48 8.552 -5.467 6.569 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.069 -4.408 8.821 1.00 0.00 H new ATOM 0 HG3 GLU A 48 6.366 -4.734 8.564 1.00 0.00 H new ATOM 722 N GLU A 49 9.894 -2.907 6.009 1.00 0.00 N ATOM 723 CA GLU A 49 11.082 -2.078 6.236 1.00 0.00 C ATOM 724 C GLU A 49 10.829 -0.612 5.861 1.00 0.00 C ATOM 725 O GLU A 49 11.150 0.269 6.654 1.00 0.00 O ATOM 726 CB GLU A 49 12.298 -2.638 5.485 1.00 0.00 C ATOM 727 CG GLU A 49 12.871 -3.884 6.178 1.00 0.00 C ATOM 728 CD GLU A 49 14.130 -4.412 5.463 1.00 0.00 C ATOM 729 OE1 GLU A 49 15.050 -3.606 5.181 1.00 0.00 O ATOM 730 OE2 GLU A 49 14.225 -5.637 5.203 1.00 0.00 O ATOM 0 H GLU A 49 10.003 -3.590 5.260 1.00 0.00 H new ATOM 0 HA GLU A 49 11.302 -2.108 7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 49 12.011 -2.889 4.464 1.00 0.00 H new ATOM 0 HB3 GLU A 49 13.070 -1.871 5.419 1.00 0.00 H new ATOM 0 HG2 GLU A 49 13.115 -3.644 7.213 1.00 0.00 H new ATOM 0 HG3 GLU A 49 12.113 -4.667 6.203 1.00 0.00 H new ATOM 737 N ILE A 50 10.186 -0.323 4.722 1.00 0.00 N ATOM 738 CA ILE A 50 9.797 1.057 4.371 1.00 0.00 C ATOM 739 C ILE A 50 8.824 1.639 5.412 1.00 0.00 C ATOM 740 O ILE A 50 8.986 2.788 5.821 1.00 0.00 O ATOM 741 CB ILE A 50 9.218 1.124 2.937 1.00 0.00 C ATOM 742 CG1 ILE A 50 10.234 0.694 1.849 1.00 0.00 C ATOM 743 CG2 ILE A 50 8.683 2.529 2.604 1.00 0.00 C ATOM 744 CD1 ILE A 50 11.537 1.501 1.783 1.00 0.00 C ATOM 0 H ILE A 50 9.923 -1.022 4.027 1.00 0.00 H new ATOM 0 HA ILE A 50 10.693 1.677 4.386 1.00 0.00 H new ATOM 0 HB ILE A 50 8.395 0.410 2.927 1.00 0.00 H new ATOM 0 HG12 ILE A 50 10.488 -0.354 2.012 1.00 0.00 H new ATOM 0 HG13 ILE A 50 9.743 0.756 0.878 1.00 0.00 H new ATOM 0 HG21 ILE A 50 8.285 2.536 1.589 1.00 0.00 H new ATOM 0 HG22 ILE A 50 7.892 2.793 3.306 1.00 0.00 H new ATOM 0 HG23 ILE A 50 9.493 3.254 2.681 1.00 0.00 H new ATOM 0 HD11 ILE A 50 12.168 1.109 0.985 1.00 0.00 H new ATOM 0 HD12 ILE A 50 11.307 2.547 1.583 1.00 0.00 H new ATOM 0 HD13 ILE A 50 12.063 1.421 2.734 1.00 0.00 H new ATOM 756 N ALA A 51 7.870 0.851 5.915 1.00 0.00 N ATOM 757 CA ALA A 51 6.951 1.270 6.971 1.00 0.00 C ATOM 758 C ALA A 51 7.692 1.683 8.252 1.00 0.00 C ATOM 759 O ALA A 51 7.408 2.736 8.823 1.00 0.00 O ATOM 760 CB ALA A 51 5.983 0.121 7.271 1.00 0.00 C ATOM 0 H ALA A 51 7.714 -0.105 5.596 1.00 0.00 H new ATOM 0 HA ALA A 51 6.404 2.146 6.621 1.00 0.00 H new ATOM 0 HB1 ALA A 51 5.292 0.423 8.058 1.00 0.00 H new ATOM 0 HB2 ALA A 51 5.421 -0.126 6.370 1.00 0.00 H new ATOM 0 HB3 ALA A 51 6.546 -0.753 7.598 1.00 0.00 H new ATOM 766 N THR A 52 8.653 0.865 8.689 1.00 0.00 N ATOM 767 CA THR A 52 9.398 1.081 9.938 1.00 0.00 C ATOM 768 C THR A 52 10.459 2.181 9.812 1.00 0.00 C ATOM 769 O THR A 52 10.680 2.937 10.759 1.00 0.00 O ATOM 770 CB THR A 52 9.983 -0.256 10.419 1.00 0.00 C ATOM 771 OG1 THR A 52 8.934 -1.198 10.554 1.00 0.00 O ATOM 772 CG2 THR A 52 10.649 -0.169 11.788 1.00 0.00 C ATOM 0 H THR A 52 8.940 0.027 8.184 1.00 0.00 H new ATOM 0 HA THR A 52 8.705 1.448 10.695 1.00 0.00 H new ATOM 0 HB THR A 52 10.729 -0.542 9.678 1.00 0.00 H new ATOM 0 HG1 THR A 52 8.703 -1.559 9.673 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.040 -1.148 12.065 1.00 0.00 H new ATOM 0 HG22 THR A 52 11.467 0.551 11.750 1.00 0.00 H new ATOM 0 HG23 THR A 52 9.917 0.153 12.529 1.00 0.00 H new ATOM 780 N GLU A 53 11.099 2.315 8.647 1.00 0.00 N ATOM 781 CA GLU A 53 12.239 3.218 8.421 1.00 0.00 C ATOM 782 C GLU A 53 11.894 4.563 7.753 1.00 0.00 C ATOM 783 O GLU A 53 12.716 5.482 7.795 1.00 0.00 O ATOM 784 CB GLU A 53 13.335 2.479 7.639 1.00 0.00 C ATOM 785 CG GLU A 53 13.852 1.236 8.378 1.00 0.00 C ATOM 786 CD GLU A 53 15.155 0.721 7.743 1.00 0.00 C ATOM 787 OE1 GLU A 53 15.171 0.457 6.518 1.00 0.00 O ATOM 788 OE2 GLU A 53 16.172 0.574 8.464 1.00 0.00 O ATOM 0 H GLU A 53 10.836 1.788 7.814 1.00 0.00 H new ATOM 0 HA GLU A 53 12.597 3.497 9.412 1.00 0.00 H new ATOM 0 HB2 GLU A 53 12.944 2.182 6.666 1.00 0.00 H new ATOM 0 HB3 GLU A 53 14.166 3.160 7.455 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.025 1.477 9.427 1.00 0.00 H new ATOM 0 HG3 GLU A 53 13.095 0.452 8.352 1.00 0.00 H new ATOM 795 N ARG A 54 10.719 4.701 7.121 1.00 0.00 N ATOM 796 CA ARG A 54 10.250 5.934 6.442 1.00 0.00 C ATOM 797 C ARG A 54 8.925 6.472 7.000 1.00 0.00 C ATOM 798 O ARG A 54 8.257 7.276 6.348 1.00 0.00 O ATOM 799 CB ARG A 54 10.223 5.744 4.906 1.00 0.00 C ATOM 800 CG ARG A 54 11.558 5.276 4.298 1.00 0.00 C ATOM 801 CD ARG A 54 12.683 6.304 4.483 1.00 0.00 C ATOM 802 NE ARG A 54 13.976 5.780 4.002 1.00 0.00 N ATOM 803 CZ ARG A 54 14.983 5.334 4.730 1.00 0.00 C ATOM 804 NH1 ARG A 54 14.956 5.261 6.028 1.00 0.00 N ATOM 805 NH2 ARG A 54 16.079 4.977 4.134 1.00 0.00 N ATOM 0 H ARG A 54 10.043 3.939 7.062 1.00 0.00 H new ATOM 0 HA ARG A 54 10.979 6.713 6.663 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.450 5.018 4.656 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.937 6.687 4.441 1.00 0.00 H new ATOM 0 HG2 ARG A 54 11.853 4.333 4.759 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.420 5.081 3.234 1.00 0.00 H new ATOM 0 HD2 ARG A 54 12.435 7.218 3.943 1.00 0.00 H new ATOM 0 HD3 ARG A 54 12.766 6.569 5.537 1.00 0.00 H new ATOM 0 HE ARG A 54 14.107 5.760 2.991 1.00 0.00 H new ATOM 0 HH11 ARG A 54 14.124 5.558 6.538 1.00 0.00 H new ATOM 0 HH12 ARG A 54 15.767 4.907 6.536 1.00 0.00 H new ATOM 0 HH21 ARG A 54 16.152 5.043 3.119 1.00 0.00 H new ATOM 0 HH22 ARG A 54 16.867 4.630 4.681 1.00 0.00 H new ATOM 819 N ALA A 55 8.580 6.093 8.235 1.00 0.00 N ATOM 820 CA ALA A 55 7.406 6.568 8.981 1.00 0.00 C ATOM 821 C ALA A 55 7.299 8.109 9.073 1.00 0.00 C ATOM 822 O ALA A 55 6.203 8.662 9.184 1.00 0.00 O ATOM 823 CB ALA A 55 7.466 5.959 10.388 1.00 0.00 C ATOM 0 H ALA A 55 9.133 5.419 8.765 1.00 0.00 H new ATOM 0 HA ALA A 55 6.516 6.249 8.438 1.00 0.00 H new ATOM 0 HB1 ALA A 55 6.605 6.294 10.967 1.00 0.00 H new ATOM 0 HB2 ALA A 55 7.452 4.872 10.315 1.00 0.00 H new ATOM 0 HB3 ALA A 55 8.383 6.278 10.884 1.00 0.00 H new ATOM 829 N THR A 56 8.436 8.809 9.019 1.00 0.00 N ATOM 830 CA THR A 56 8.539 10.279 9.028 1.00 0.00 C ATOM 831 C THR A 56 8.038 10.951 7.741 1.00 0.00 C ATOM 832 O THR A 56 7.684 12.130 7.779 1.00 0.00 O ATOM 833 CB THR A 56 9.998 10.700 9.263 1.00 0.00 C ATOM 834 OG1 THR A 56 10.851 10.004 8.374 1.00 0.00 O ATOM 835 CG2 THR A 56 10.462 10.380 10.685 1.00 0.00 C ATOM 0 H THR A 56 9.347 8.354 8.966 1.00 0.00 H new ATOM 0 HA THR A 56 7.891 10.614 9.838 1.00 0.00 H new ATOM 0 HB THR A 56 10.046 11.777 9.099 1.00 0.00 H new ATOM 0 HG1 THR A 56 11.779 10.279 8.529 1.00 0.00 H new ATOM 0 HG21 THR A 56 11.499 10.694 10.809 1.00 0.00 H new ATOM 0 HG22 THR A 56 9.834 10.911 11.401 1.00 0.00 H new ATOM 0 HG23 THR A 56 10.384 9.307 10.860 1.00 0.00 H new ATOM 843 N ASP A 57 7.976 10.229 6.613 1.00 0.00 N ATOM 844 CA ASP A 57 7.532 10.754 5.309 1.00 0.00 C ATOM 845 C ASP A 57 6.265 10.066 4.770 1.00 0.00 C ATOM 846 O ASP A 57 5.408 10.729 4.188 1.00 0.00 O ATOM 847 CB ASP A 57 8.683 10.647 4.301 1.00 0.00 C ATOM 848 CG ASP A 57 8.448 11.584 3.105 1.00 0.00 C ATOM 849 OD1 ASP A 57 8.654 12.811 3.258 1.00 0.00 O ATOM 850 OD2 ASP A 57 8.081 11.094 2.014 1.00 0.00 O ATOM 0 H ASP A 57 8.238 9.244 6.578 1.00 0.00 H new ATOM 0 HA ASP A 57 7.258 11.799 5.456 1.00 0.00 H new ATOM 0 HB2 ASP A 57 9.624 10.901 4.788 1.00 0.00 H new ATOM 0 HB3 ASP A 57 8.772 9.618 3.951 1.00 0.00 H new ATOM 855 N LEU A 58 6.110 8.759 5.017 1.00 0.00 N ATOM 856 CA LEU A 58 4.971 7.932 4.601 1.00 0.00 C ATOM 857 C LEU A 58 4.256 7.332 5.822 1.00 0.00 C ATOM 858 O LEU A 58 4.869 7.112 6.865 1.00 0.00 O ATOM 859 CB LEU A 58 5.442 6.776 3.690 1.00 0.00 C ATOM 860 CG LEU A 58 6.243 7.132 2.425 1.00 0.00 C ATOM 861 CD1 LEU A 58 6.504 5.846 1.635 1.00 0.00 C ATOM 862 CD2 LEU A 58 5.504 8.106 1.512 1.00 0.00 C ATOM 0 H LEU A 58 6.807 8.225 5.536 1.00 0.00 H new ATOM 0 HA LEU A 58 4.282 8.576 4.054 1.00 0.00 H new ATOM 0 HB2 LEU A 58 6.052 6.103 4.293 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.560 6.215 3.380 1.00 0.00 H new ATOM 0 HG LEU A 58 7.167 7.611 2.749 1.00 0.00 H new ATOM 0 HD11 LEU A 58 7.071 6.081 0.734 1.00 0.00 H new ATOM 0 HD12 LEU A 58 7.073 5.150 2.251 1.00 0.00 H new ATOM 0 HD13 LEU A 58 5.554 5.391 1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 58 6.117 8.320 0.637 1.00 0.00 H new ATOM 0 HD22 LEU A 58 4.560 7.662 1.194 1.00 0.00 H new ATOM 0 HD23 LEU A 58 5.306 9.032 2.052 1.00 0.00 H new ATOM 874 N THR A 59 2.973 7.002 5.683 1.00 0.00 N ATOM 875 CA THR A 59 2.326 5.938 6.477 1.00 0.00 C ATOM 876 C THR A 59 2.060 4.758 5.548 1.00 0.00 C ATOM 877 O THR A 59 1.447 4.940 4.498 1.00 0.00 O ATOM 878 CB THR A 59 1.029 6.421 7.144 1.00 0.00 C ATOM 879 OG1 THR A 59 1.333 7.436 8.078 1.00 0.00 O ATOM 880 CG2 THR A 59 0.313 5.320 7.927 1.00 0.00 C ATOM 0 H THR A 59 2.347 7.459 5.020 1.00 0.00 H new ATOM 0 HA THR A 59 2.988 5.640 7.290 1.00 0.00 H new ATOM 0 HB THR A 59 0.383 6.766 6.337 1.00 0.00 H new ATOM 0 HG1 THR A 59 0.507 7.747 8.504 1.00 0.00 H new ATOM 0 HG21 THR A 59 -0.595 5.724 8.374 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.054 4.504 7.253 1.00 0.00 H new ATOM 0 HG23 THR A 59 0.970 4.947 8.713 1.00 0.00 H new ATOM 888 N VAL A 60 2.521 3.554 5.902 1.00 0.00 N ATOM 889 CA VAL A 60 2.361 2.352 5.063 1.00 0.00 C ATOM 890 C VAL A 60 1.239 1.469 5.606 1.00 0.00 C ATOM 891 O VAL A 60 1.273 1.032 6.759 1.00 0.00 O ATOM 892 CB VAL A 60 3.676 1.571 4.920 1.00 0.00 C ATOM 893 CG1 VAL A 60 3.516 0.316 4.049 1.00 0.00 C ATOM 894 CG2 VAL A 60 4.772 2.440 4.286 1.00 0.00 C ATOM 0 H VAL A 60 3.016 3.381 6.777 1.00 0.00 H new ATOM 0 HA VAL A 60 2.084 2.679 4.061 1.00 0.00 H new ATOM 0 HB VAL A 60 3.957 1.278 5.931 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.472 -0.202 3.978 1.00 0.00 H new ATOM 0 HG12 VAL A 60 2.777 -0.347 4.499 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.185 0.605 3.052 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.691 1.860 4.198 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.452 2.765 3.296 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.953 3.313 4.913 1.00 0.00 H new ATOM 904 N ALA A 61 0.258 1.194 4.751 1.00 0.00 N ATOM 905 CA ALA A 61 -0.924 0.394 5.037 1.00 0.00 C ATOM 906 C ALA A 61 -1.086 -0.764 4.035 1.00 0.00 C ATOM 907 O ALA A 61 -0.463 -0.778 2.971 1.00 0.00 O ATOM 908 CB ALA A 61 -2.144 1.325 5.044 1.00 0.00 C ATOM 0 H ALA A 61 0.269 1.542 3.792 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.822 -0.075 6.015 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -3.043 0.746 5.257 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -2.015 2.089 5.811 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -2.243 1.803 4.069 1.00 0.00 H new ATOM 914 N LYS A 62 -1.948 -1.729 4.361 1.00 0.00 N ATOM 915 CA LYS A 62 -2.296 -2.879 3.511 1.00 0.00 C ATOM 916 C LYS A 62 -3.812 -2.997 3.324 1.00 0.00 C ATOM 917 O LYS A 62 -4.559 -2.790 4.278 1.00 0.00 O ATOM 918 CB LYS A 62 -1.704 -4.176 4.093 1.00 0.00 C ATOM 919 CG LYS A 62 -0.182 -4.112 4.318 1.00 0.00 C ATOM 920 CD LYS A 62 0.416 -5.461 4.745 1.00 0.00 C ATOM 921 CE LYS A 62 0.493 -6.447 3.571 1.00 0.00 C ATOM 922 NZ LYS A 62 0.983 -7.782 4.006 1.00 0.00 N ATOM 0 H LYS A 62 -2.442 -1.735 5.253 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.860 -2.716 2.525 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -2.194 -4.396 5.041 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -1.929 -5.003 3.419 1.00 0.00 H new ATOM 0 HG2 LYS A 62 0.302 -3.780 3.400 1.00 0.00 H new ATOM 0 HG3 LYS A 62 0.036 -3.365 5.082 1.00 0.00 H new ATOM 0 HD2 LYS A 62 1.414 -5.303 5.153 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -0.190 -5.891 5.542 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -0.493 -6.551 3.118 1.00 0.00 H new ATOM 0 HE3 LYS A 62 1.156 -6.048 2.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 1.958 -7.920 3.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 0.963 -7.838 5.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.371 -8.523 3.608 1.00 0.00 H new ATOM 936 N LEU A 63 -4.264 -3.345 2.119 1.00 0.00 N ATOM 937 CA LEU A 63 -5.658 -3.707 1.829 1.00 0.00 C ATOM 938 C LEU A 63 -5.708 -5.169 1.379 1.00 0.00 C ATOM 939 O LEU A 63 -5.147 -5.543 0.348 1.00 0.00 O ATOM 940 CB LEU A 63 -6.261 -2.709 0.814 1.00 0.00 C ATOM 941 CG LEU A 63 -7.761 -2.854 0.454 1.00 0.00 C ATOM 942 CD1 LEU A 63 -8.069 -4.110 -0.361 1.00 0.00 C ATOM 943 CD2 LEU A 63 -8.656 -2.820 1.690 1.00 0.00 C ATOM 0 H LEU A 63 -3.661 -3.385 1.297 1.00 0.00 H new ATOM 0 HA LEU A 63 -6.281 -3.632 2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.107 -1.703 1.204 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.687 -2.785 -0.110 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.982 -1.988 -0.170 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -9.136 -4.150 -0.579 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.509 -4.084 -1.296 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.782 -4.993 0.209 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.698 -2.925 1.388 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -8.387 -3.639 2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -8.523 -1.871 2.210 1.00 0.00 H new ATOM 955 N ASP A 64 -6.398 -5.988 2.167 1.00 0.00 N ATOM 956 CA ASP A 64 -6.548 -7.423 1.961 1.00 0.00 C ATOM 957 C ASP A 64 -7.650 -7.656 0.915 1.00 0.00 C ATOM 958 O ASP A 64 -8.841 -7.617 1.243 1.00 0.00 O ATOM 959 CB ASP A 64 -6.906 -8.081 3.309 1.00 0.00 C ATOM 960 CG ASP A 64 -5.778 -8.119 4.358 1.00 0.00 C ATOM 961 OD1 ASP A 64 -5.030 -7.129 4.527 1.00 0.00 O ATOM 962 OD2 ASP A 64 -5.663 -9.140 5.075 1.00 0.00 O ATOM 0 H ASP A 64 -6.887 -5.656 2.999 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.623 -7.867 1.595 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.756 -7.550 3.737 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.233 -9.103 3.117 1.00 0.00 H new ATOM 967 N VAL A 65 -7.283 -7.868 -0.355 1.00 0.00 N ATOM 968 CA VAL A 65 -8.256 -7.960 -1.469 1.00 0.00 C ATOM 969 C VAL A 65 -9.166 -9.187 -1.373 1.00 0.00 C ATOM 970 O VAL A 65 -10.245 -9.213 -1.962 1.00 0.00 O ATOM 971 CB VAL A 65 -7.592 -7.930 -2.863 1.00 0.00 C ATOM 972 CG1 VAL A 65 -6.694 -6.699 -3.025 1.00 0.00 C ATOM 973 CG2 VAL A 65 -6.781 -9.176 -3.226 1.00 0.00 C ATOM 0 H VAL A 65 -6.312 -7.981 -0.646 1.00 0.00 H new ATOM 0 HA VAL A 65 -8.868 -7.065 -1.359 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.436 -7.893 -3.552 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.241 -6.707 -4.016 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.291 -5.795 -2.906 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.910 -6.718 -2.268 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -6.356 -9.056 -4.223 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -5.977 -9.310 -2.503 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.432 -10.050 -3.212 1.00 0.00 H new ATOM 983 N ASP A 66 -8.744 -10.194 -0.605 1.00 0.00 N ATOM 984 CA ASP A 66 -9.488 -11.440 -0.401 1.00 0.00 C ATOM 985 C ASP A 66 -10.727 -11.250 0.497 1.00 0.00 C ATOM 986 O ASP A 66 -11.687 -12.018 0.404 1.00 0.00 O ATOM 987 CB ASP A 66 -8.528 -12.487 0.178 1.00 0.00 C ATOM 988 CG ASP A 66 -9.100 -13.904 0.039 1.00 0.00 C ATOM 989 OD1 ASP A 66 -9.208 -14.380 -1.116 1.00 0.00 O ATOM 990 OD2 ASP A 66 -9.402 -14.550 1.071 1.00 0.00 O ATOM 0 H ASP A 66 -7.859 -10.166 -0.098 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.874 -11.781 -1.362 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -7.569 -12.428 -0.336 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -8.340 -12.270 1.229 1.00 0.00 H new ATOM 995 N THR A 67 -10.727 -10.201 1.330 1.00 0.00 N ATOM 996 CA THR A 67 -11.841 -9.804 2.210 1.00 0.00 C ATOM 997 C THR A 67 -12.412 -8.418 1.883 1.00 0.00 C ATOM 998 O THR A 67 -13.538 -8.121 2.289 1.00 0.00 O ATOM 999 CB THR A 67 -11.429 -9.870 3.690 1.00 0.00 C ATOM 1000 OG1 THR A 67 -10.257 -9.116 3.915 1.00 0.00 O ATOM 1001 CG2 THR A 67 -11.143 -11.303 4.141 1.00 0.00 C ATOM 0 H THR A 67 -9.922 -9.580 1.415 1.00 0.00 H new ATOM 0 HA THR A 67 -12.636 -10.526 2.024 1.00 0.00 H new ATOM 0 HB THR A 67 -12.267 -9.467 4.259 1.00 0.00 H new ATOM 0 HG1 THR A 67 -10.011 -9.169 4.862 1.00 0.00 H new ATOM 0 HG21 THR A 67 -10.856 -11.303 5.192 1.00 0.00 H new ATOM 0 HG22 THR A 67 -12.038 -11.911 4.009 1.00 0.00 H new ATOM 0 HG23 THR A 67 -10.331 -11.717 3.543 1.00 0.00 H new ATOM 1009 N ASN A 68 -11.697 -7.584 1.112 1.00 0.00 N ATOM 1010 CA ASN A 68 -12.140 -6.259 0.661 1.00 0.00 C ATOM 1011 C ASN A 68 -12.117 -6.125 -0.885 1.00 0.00 C ATOM 1012 O ASN A 68 -11.439 -5.238 -1.418 1.00 0.00 O ATOM 1013 CB ASN A 68 -11.275 -5.188 1.353 1.00 0.00 C ATOM 1014 CG ASN A 68 -11.230 -5.292 2.865 1.00 0.00 C ATOM 1015 OD1 ASN A 68 -12.007 -4.674 3.577 1.00 0.00 O ATOM 1016 ND2 ASN A 68 -10.310 -6.062 3.398 1.00 0.00 N ATOM 0 H ASN A 68 -10.764 -7.823 0.775 1.00 0.00 H new ATOM 0 HA ASN A 68 -13.182 -6.115 0.946 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -10.258 -5.256 0.967 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.654 -4.203 1.081 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -10.241 -6.147 4.412 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -9.664 -6.575 2.798 1.00 0.00 H new ATOM 1023 N PRO A 69 -12.856 -6.967 -1.639 1.00 0.00 N ATOM 1024 CA PRO A 69 -12.893 -6.888 -3.104 1.00 0.00 C ATOM 1025 C PRO A 69 -13.531 -5.583 -3.608 1.00 0.00 C ATOM 1026 O PRO A 69 -13.181 -5.104 -4.686 1.00 0.00 O ATOM 1027 CB PRO A 69 -13.682 -8.123 -3.554 1.00 0.00 C ATOM 1028 CG PRO A 69 -14.611 -8.401 -2.374 1.00 0.00 C ATOM 1029 CD PRO A 69 -13.746 -8.024 -1.173 1.00 0.00 C ATOM 0 HA PRO A 69 -11.887 -6.876 -3.523 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -14.242 -7.930 -4.469 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -13.024 -8.969 -3.755 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -15.520 -7.801 -2.423 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -14.920 -9.446 -2.339 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -14.361 -7.679 -0.342 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -13.179 -8.883 -0.815 1.00 0.00 H new ATOM 1037 N GLU A 70 -14.411 -4.962 -2.813 1.00 0.00 N ATOM 1038 CA GLU A 70 -15.014 -3.658 -3.117 1.00 0.00 C ATOM 1039 C GLU A 70 -13.957 -2.545 -3.162 1.00 0.00 C ATOM 1040 O GLU A 70 -13.917 -1.769 -4.116 1.00 0.00 O ATOM 1041 CB GLU A 70 -16.109 -3.328 -2.086 1.00 0.00 C ATOM 1042 CG GLU A 70 -17.283 -4.322 -2.078 1.00 0.00 C ATOM 1043 CD GLU A 70 -18.021 -4.345 -3.428 1.00 0.00 C ATOM 1044 OE1 GLU A 70 -18.938 -3.521 -3.648 1.00 0.00 O ATOM 1045 OE2 GLU A 70 -17.663 -5.155 -4.313 1.00 0.00 O ATOM 0 H GLU A 70 -14.729 -5.357 -1.928 1.00 0.00 H new ATOM 0 HA GLU A 70 -15.467 -3.718 -4.107 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -15.662 -3.302 -1.092 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -16.494 -2.329 -2.288 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -16.912 -5.321 -1.850 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -17.982 -4.053 -1.286 1.00 0.00 H new ATOM 1052 N THR A 71 -13.040 -2.506 -2.189 1.00 0.00 N ATOM 1053 CA THR A 71 -11.911 -1.559 -2.169 1.00 0.00 C ATOM 1054 C THR A 71 -10.926 -1.842 -3.305 1.00 0.00 C ATOM 1055 O THR A 71 -10.442 -0.910 -3.947 1.00 0.00 O ATOM 1056 CB THR A 71 -11.187 -1.580 -0.818 1.00 0.00 C ATOM 1057 OG1 THR A 71 -12.117 -1.665 0.239 1.00 0.00 O ATOM 1058 CG2 THR A 71 -10.381 -0.305 -0.582 1.00 0.00 C ATOM 0 H THR A 71 -13.057 -3.134 -1.385 1.00 0.00 H new ATOM 0 HA THR A 71 -12.326 -0.562 -2.317 1.00 0.00 H new ATOM 0 HB THR A 71 -10.525 -2.445 -0.843 1.00 0.00 H new ATOM 0 HG1 THR A 71 -11.639 -1.679 1.095 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.884 -0.362 0.387 1.00 0.00 H new ATOM 0 HG22 THR A 71 -9.633 -0.197 -1.367 1.00 0.00 H new ATOM 0 HG23 THR A 71 -11.049 0.556 -0.597 1.00 0.00 H new ATOM 1066 N ALA A 72 -10.676 -3.120 -3.610 1.00 0.00 N ATOM 1067 CA ALA A 72 -9.806 -3.535 -4.712 1.00 0.00 C ATOM 1068 C ALA A 72 -10.333 -3.083 -6.088 1.00 0.00 C ATOM 1069 O ALA A 72 -9.566 -2.563 -6.902 1.00 0.00 O ATOM 1070 CB ALA A 72 -9.619 -5.054 -4.630 1.00 0.00 C ATOM 0 H ALA A 72 -11.077 -3.902 -3.092 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.839 -3.043 -4.609 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.973 -5.385 -5.443 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.162 -5.313 -3.675 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.589 -5.545 -4.714 1.00 0.00 H new ATOM 1076 N ARG A 73 -11.640 -3.224 -6.354 1.00 0.00 N ATOM 1077 CA ARG A 73 -12.244 -2.777 -7.624 1.00 0.00 C ATOM 1078 C ARG A 73 -12.486 -1.264 -7.703 1.00 0.00 C ATOM 1079 O ARG A 73 -12.441 -0.713 -8.800 1.00 0.00 O ATOM 1080 CB ARG A 73 -13.487 -3.619 -7.971 1.00 0.00 C ATOM 1081 CG ARG A 73 -14.743 -3.265 -7.160 1.00 0.00 C ATOM 1082 CD ARG A 73 -15.896 -4.225 -7.479 1.00 0.00 C ATOM 1083 NE ARG A 73 -17.124 -3.854 -6.751 1.00 0.00 N ATOM 1084 CZ ARG A 73 -18.047 -2.980 -7.109 1.00 0.00 C ATOM 1085 NH1 ARG A 73 -18.004 -2.343 -8.248 1.00 0.00 N ATOM 1086 NH2 ARG A 73 -19.041 -2.720 -6.315 1.00 0.00 N ATOM 0 H ARG A 73 -12.304 -3.646 -5.705 1.00 0.00 H new ATOM 0 HA ARG A 73 -11.504 -2.959 -8.403 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -13.708 -3.497 -9.031 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -13.253 -4.672 -7.813 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -14.515 -3.307 -6.095 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -15.046 -2.242 -7.381 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -16.091 -4.218 -8.551 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -15.608 -5.242 -7.214 1.00 0.00 H new ATOM 0 HE ARG A 73 -17.279 -4.331 -5.863 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -17.237 -2.513 -8.899 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -18.737 -1.675 -8.487 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -19.110 -3.191 -5.413 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -19.753 -2.045 -6.593 1.00 0.00 H new ATOM 1100 N ASN A 74 -12.674 -0.577 -6.569 1.00 0.00 N ATOM 1101 CA ASN A 74 -12.964 0.867 -6.514 1.00 0.00 C ATOM 1102 C ASN A 74 -11.899 1.734 -7.214 1.00 0.00 C ATOM 1103 O ASN A 74 -12.245 2.680 -7.924 1.00 0.00 O ATOM 1104 CB ASN A 74 -13.124 1.282 -5.039 1.00 0.00 C ATOM 1105 CG ASN A 74 -13.436 2.763 -4.888 1.00 0.00 C ATOM 1106 OD1 ASN A 74 -14.558 3.206 -5.086 1.00 0.00 O ATOM 1107 ND2 ASN A 74 -12.463 3.580 -4.552 1.00 0.00 N ATOM 0 H ASN A 74 -12.629 -1.013 -5.648 1.00 0.00 H new ATOM 0 HA ASN A 74 -13.889 1.041 -7.064 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -13.922 0.696 -4.583 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -12.208 1.049 -4.496 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -12.646 4.579 -4.457 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -11.525 3.215 -4.386 1.00 0.00 H new ATOM 1114 N PHE A 75 -10.615 1.397 -7.043 1.00 0.00 N ATOM 1115 CA PHE A 75 -9.487 2.092 -7.685 1.00 0.00 C ATOM 1116 C PHE A 75 -8.968 1.373 -8.951 1.00 0.00 C ATOM 1117 O PHE A 75 -7.959 1.781 -9.527 1.00 0.00 O ATOM 1118 CB PHE A 75 -8.382 2.338 -6.641 1.00 0.00 C ATOM 1119 CG PHE A 75 -8.833 3.036 -5.369 1.00 0.00 C ATOM 1120 CD1 PHE A 75 -9.023 4.431 -5.355 1.00 0.00 C ATOM 1121 CD2 PHE A 75 -9.049 2.293 -4.191 1.00 0.00 C ATOM 1122 CE1 PHE A 75 -9.423 5.079 -4.172 1.00 0.00 C ATOM 1123 CE2 PHE A 75 -9.451 2.941 -3.009 1.00 0.00 C ATOM 1124 CZ PHE A 75 -9.637 4.334 -2.999 1.00 0.00 C ATOM 0 H PHE A 75 -10.324 0.623 -6.446 1.00 0.00 H new ATOM 0 HA PHE A 75 -9.843 3.055 -8.050 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -7.939 1.379 -6.372 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -7.595 2.934 -7.103 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -8.861 5.005 -6.255 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -8.905 1.223 -4.196 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -9.566 6.149 -4.165 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -9.617 2.368 -2.109 1.00 0.00 H new ATOM 0 HZ PHE A 75 -9.944 4.832 -2.091 1.00 0.00 H new ATOM 1134 N GLN A 76 -9.632 0.287 -9.377 1.00 0.00 N ATOM 1135 CA GLN A 76 -9.166 -0.682 -10.381 1.00 0.00 C ATOM 1136 C GLN A 76 -7.761 -1.244 -10.069 1.00 0.00 C ATOM 1137 O GLN A 76 -6.860 -1.275 -10.910 1.00 0.00 O ATOM 1138 CB GLN A 76 -9.350 -0.127 -11.805 1.00 0.00 C ATOM 1139 CG GLN A 76 -9.288 -1.250 -12.857 1.00 0.00 C ATOM 1140 CD GLN A 76 -9.539 -0.772 -14.291 1.00 0.00 C ATOM 1141 OE1 GLN A 76 -9.744 0.401 -14.584 1.00 0.00 O ATOM 1142 NE2 GLN A 76 -9.536 -1.670 -15.254 1.00 0.00 N ATOM 0 H GLN A 76 -10.554 0.049 -9.012 1.00 0.00 H new ATOM 0 HA GLN A 76 -9.803 -1.565 -10.326 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -10.308 0.388 -11.876 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.576 0.611 -12.012 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -8.308 -1.726 -12.809 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -10.025 -2.012 -12.604 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -9.368 -2.652 -15.035 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -9.702 -1.384 -16.219 1.00 0.00 H new ATOM 1151 N VAL A 77 -7.568 -1.694 -8.828 1.00 0.00 N ATOM 1152 CA VAL A 77 -6.303 -2.219 -8.292 1.00 0.00 C ATOM 1153 C VAL A 77 -6.378 -3.707 -7.915 1.00 0.00 C ATOM 1154 O VAL A 77 -5.573 -4.210 -7.130 1.00 0.00 O ATOM 1155 CB VAL A 77 -5.779 -1.330 -7.157 1.00 0.00 C ATOM 1156 CG1 VAL A 77 -5.438 0.088 -7.629 1.00 0.00 C ATOM 1157 CG2 VAL A 77 -6.751 -1.239 -5.983 1.00 0.00 C ATOM 0 H VAL A 77 -8.318 -1.705 -8.137 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.568 -2.178 -9.096 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.865 -1.820 -6.820 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -5.072 0.674 -6.786 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.668 0.040 -8.399 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.331 0.560 -8.038 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.328 -0.597 -5.210 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.697 -0.820 -6.326 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.922 -2.235 -5.575 1.00 0.00 H new ATOM 1167 N VAL A 78 -7.329 -4.436 -8.509 1.00 0.00 N ATOM 1168 CA VAL A 78 -7.515 -5.893 -8.336 1.00 0.00 C ATOM 1169 C VAL A 78 -6.307 -6.726 -8.809 1.00 0.00 C ATOM 1170 O VAL A 78 -6.121 -7.858 -8.361 1.00 0.00 O ATOM 1171 CB VAL A 78 -8.790 -6.384 -9.053 1.00 0.00 C ATOM 1172 CG1 VAL A 78 -10.053 -5.779 -8.434 1.00 0.00 C ATOM 1173 CG2 VAL A 78 -8.803 -6.082 -10.560 1.00 0.00 C ATOM 0 H VAL A 78 -8.013 -4.023 -9.143 1.00 0.00 H new ATOM 0 HA VAL A 78 -7.615 -6.046 -7.261 1.00 0.00 H new ATOM 0 HB VAL A 78 -8.782 -7.466 -8.920 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.931 -6.148 -8.965 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -10.117 -6.066 -7.384 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -10.012 -4.693 -8.512 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -9.729 -6.455 -10.998 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -8.736 -5.005 -10.716 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -7.953 -6.571 -11.036 1.00 0.00 H new ATOM 1183 N SER A 79 -5.475 -6.169 -9.697 1.00 0.00 N ATOM 1184 CA SER A 79 -4.272 -6.789 -10.275 1.00 0.00 C ATOM 1185 C SER A 79 -3.088 -6.775 -9.296 1.00 0.00 C ATOM 1186 O SER A 79 -2.123 -6.026 -9.470 1.00 0.00 O ATOM 1187 CB SER A 79 -3.909 -6.107 -11.605 1.00 0.00 C ATOM 1188 OG SER A 79 -5.024 -6.107 -12.487 1.00 0.00 O ATOM 0 H SER A 79 -5.629 -5.225 -10.051 1.00 0.00 H new ATOM 0 HA SER A 79 -4.499 -7.837 -10.473 1.00 0.00 H new ATOM 0 HB2 SER A 79 -3.586 -5.083 -11.419 1.00 0.00 H new ATOM 0 HB3 SER A 79 -3.071 -6.626 -12.070 1.00 0.00 H new ATOM 0 HG SER A 79 -4.776 -5.668 -13.327 1.00 0.00 H new ATOM 1194 N ILE A 80 -3.171 -7.579 -8.233 1.00 0.00 N ATOM 1195 CA ILE A 80 -2.151 -7.630 -7.175 1.00 0.00 C ATOM 1196 C ILE A 80 -0.850 -8.342 -7.619 1.00 0.00 C ATOM 1197 O ILE A 80 -0.920 -9.269 -8.434 1.00 0.00 O ATOM 1198 CB ILE A 80 -2.715 -8.200 -5.854 1.00 0.00 C ATOM 1199 CG1 ILE A 80 -3.110 -9.690 -5.907 1.00 0.00 C ATOM 1200 CG2 ILE A 80 -3.887 -7.328 -5.369 1.00 0.00 C ATOM 1201 CD1 ILE A 80 -3.291 -10.265 -4.495 1.00 0.00 C ATOM 0 H ILE A 80 -3.951 -8.218 -8.079 1.00 0.00 H new ATOM 0 HA ILE A 80 -1.867 -6.596 -6.978 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.897 -8.162 -5.134 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.036 -9.804 -6.471 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -2.343 -10.254 -6.437 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -4.281 -7.734 -4.437 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.538 -6.309 -5.202 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.673 -7.323 -6.124 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -3.569 -11.317 -4.563 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -2.356 -10.172 -3.942 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -4.076 -9.715 -3.976 1.00 0.00 H new ATOM 1213 N PRO A 81 0.337 -7.946 -7.104 1.00 0.00 N ATOM 1214 CA PRO A 81 0.576 -6.831 -6.178 1.00 0.00 C ATOM 1215 C PRO A 81 0.330 -5.462 -6.821 1.00 0.00 C ATOM 1216 O PRO A 81 0.762 -5.212 -7.948 1.00 0.00 O ATOM 1217 CB PRO A 81 2.046 -6.932 -5.738 1.00 0.00 C ATOM 1218 CG PRO A 81 2.497 -8.318 -6.188 1.00 0.00 C ATOM 1219 CD PRO A 81 1.581 -8.647 -7.363 1.00 0.00 C ATOM 0 HA PRO A 81 -0.118 -6.906 -5.341 1.00 0.00 H new ATOM 0 HB2 PRO A 81 2.651 -6.151 -6.199 1.00 0.00 H new ATOM 0 HB3 PRO A 81 2.144 -6.816 -4.659 1.00 0.00 H new ATOM 0 HG2 PRO A 81 3.545 -8.318 -6.488 1.00 0.00 H new ATOM 0 HG3 PRO A 81 2.395 -9.050 -5.387 1.00 0.00 H new ATOM 0 HD2 PRO A 81 2.023 -8.324 -8.306 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.415 -9.722 -7.441 1.00 0.00 H new ATOM 1227 N THR A 82 -0.306 -4.556 -6.078 1.00 0.00 N ATOM 1228 CA THR A 82 -0.400 -3.129 -6.419 1.00 0.00 C ATOM 1229 C THR A 82 -0.137 -2.280 -5.177 1.00 0.00 C ATOM 1230 O THR A 82 -0.841 -2.393 -4.177 1.00 0.00 O ATOM 1231 CB THR A 82 -1.761 -2.771 -7.046 1.00 0.00 C ATOM 1232 OG1 THR A 82 -1.826 -3.198 -8.394 1.00 0.00 O ATOM 1233 CG2 THR A 82 -1.996 -1.262 -7.105 1.00 0.00 C ATOM 0 H THR A 82 -0.780 -4.793 -5.206 1.00 0.00 H new ATOM 0 HA THR A 82 0.361 -2.915 -7.169 1.00 0.00 H new ATOM 0 HB THR A 82 -2.501 -3.262 -6.414 1.00 0.00 H new ATOM 0 HG1 THR A 82 -1.921 -4.173 -8.424 1.00 0.00 H new ATOM 0 HG21 THR A 82 -2.969 -1.063 -7.555 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.972 -0.850 -6.096 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.216 -0.795 -7.706 1.00 0.00 H new ATOM 1241 N LEU A 83 0.820 -1.365 -5.271 1.00 0.00 N ATOM 1242 CA LEU A 83 0.969 -0.220 -4.380 1.00 0.00 C ATOM 1243 C LEU A 83 0.245 0.972 -5.010 1.00 0.00 C ATOM 1244 O LEU A 83 0.468 1.280 -6.183 1.00 0.00 O ATOM 1245 CB LEU A 83 2.459 0.119 -4.203 1.00 0.00 C ATOM 1246 CG LEU A 83 3.213 -0.655 -3.113 1.00 0.00 C ATOM 1247 CD1 LEU A 83 3.264 -2.163 -3.354 1.00 0.00 C ATOM 1248 CD2 LEU A 83 4.650 -0.128 -3.078 1.00 0.00 C ATOM 0 H LEU A 83 1.538 -1.401 -5.994 1.00 0.00 H new ATOM 0 HA LEU A 83 0.545 -0.451 -3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.963 -0.053 -5.154 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.543 1.184 -3.985 1.00 0.00 H new ATOM 0 HG LEU A 83 2.679 -0.501 -2.175 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.812 -2.643 -2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.250 -2.560 -3.391 1.00 0.00 H new ATOM 0 HD13 LEU A 83 3.766 -2.363 -4.300 1.00 0.00 H new ATOM 0 HD21 LEU A 83 5.214 -0.659 -2.311 1.00 0.00 H new ATOM 0 HD22 LEU A 83 5.119 -0.286 -4.049 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.641 0.938 -2.849 1.00 0.00 H new ATOM 1260 N ILE A 84 -0.569 1.678 -4.228 1.00 0.00 N ATOM 1261 CA ILE A 84 -1.132 2.979 -4.604 1.00 0.00 C ATOM 1262 C ILE A 84 -0.738 4.011 -3.534 1.00 0.00 C ATOM 1263 O ILE A 84 -0.913 3.795 -2.332 1.00 0.00 O ATOM 1264 CB ILE A 84 -2.646 2.847 -4.919 1.00 0.00 C ATOM 1265 CG1 ILE A 84 -3.155 3.846 -5.983 1.00 0.00 C ATOM 1266 CG2 ILE A 84 -3.507 2.857 -3.660 1.00 0.00 C ATOM 1267 CD1 ILE A 84 -3.260 5.323 -5.575 1.00 0.00 C ATOM 0 H ILE A 84 -0.861 1.361 -3.304 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.714 3.354 -5.538 1.00 0.00 H new ATOM 0 HB ILE A 84 -2.755 1.862 -5.373 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -2.495 3.782 -6.848 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.141 3.516 -6.310 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.557 2.762 -3.937 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.224 2.022 -3.019 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -3.356 3.794 -3.124 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -3.630 5.908 -6.417 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.948 5.421 -4.736 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.276 5.690 -5.282 1.00 0.00 H new ATOM 1279 N LEU A 85 -0.131 5.110 -3.977 1.00 0.00 N ATOM 1280 CA LEU A 85 0.392 6.188 -3.146 1.00 0.00 C ATOM 1281 C LEU A 85 -0.545 7.399 -3.213 1.00 0.00 C ATOM 1282 O LEU A 85 -0.744 7.988 -4.280 1.00 0.00 O ATOM 1283 CB LEU A 85 1.821 6.514 -3.623 1.00 0.00 C ATOM 1284 CG LEU A 85 2.573 7.548 -2.767 1.00 0.00 C ATOM 1285 CD1 LEU A 85 2.892 7.059 -1.359 1.00 0.00 C ATOM 1286 CD2 LEU A 85 3.899 7.899 -3.440 1.00 0.00 C ATOM 0 H LEU A 85 0.016 5.279 -4.972 1.00 0.00 H new ATOM 0 HA LEU A 85 0.441 5.890 -2.099 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.400 5.591 -3.643 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.771 6.881 -4.648 1.00 0.00 H new ATOM 0 HG LEU A 85 1.909 8.409 -2.685 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.422 7.840 -0.814 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.965 6.819 -0.839 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.517 6.168 -1.416 1.00 0.00 H new ATOM 0 HD21 LEU A 85 4.432 8.632 -2.834 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.506 6.999 -3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.706 8.317 -4.428 1.00 0.00 H new ATOM 1298 N PHE A 86 -1.088 7.779 -2.062 1.00 0.00 N ATOM 1299 CA PHE A 86 -1.858 9.001 -1.848 1.00 0.00 C ATOM 1300 C PHE A 86 -0.964 10.089 -1.241 1.00 0.00 C ATOM 1301 O PHE A 86 -0.086 9.790 -0.429 1.00 0.00 O ATOM 1302 CB PHE A 86 -3.059 8.720 -0.925 1.00 0.00 C ATOM 1303 CG PHE A 86 -4.020 7.641 -1.399 1.00 0.00 C ATOM 1304 CD1 PHE A 86 -3.790 6.293 -1.064 1.00 0.00 C ATOM 1305 CD2 PHE A 86 -5.165 7.982 -2.142 1.00 0.00 C ATOM 1306 CE1 PHE A 86 -4.696 5.300 -1.474 1.00 0.00 C ATOM 1307 CE2 PHE A 86 -6.050 6.983 -2.586 1.00 0.00 C ATOM 1308 CZ PHE A 86 -5.816 5.639 -2.252 1.00 0.00 C ATOM 0 H PHE A 86 -1.000 7.219 -1.214 1.00 0.00 H new ATOM 0 HA PHE A 86 -2.233 9.352 -2.809 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -2.680 8.437 0.057 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.618 9.647 -0.795 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.916 6.022 -0.491 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -5.366 9.018 -2.373 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -4.531 4.271 -1.190 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -6.909 7.249 -3.184 1.00 0.00 H new ATOM 0 HZ PHE A 86 -6.494 4.870 -2.592 1.00 0.00 H new ATOM 1318 N LYS A 87 -1.229 11.358 -1.567 1.00 0.00 N ATOM 1319 CA LYS A 87 -0.690 12.534 -0.863 1.00 0.00 C ATOM 1320 C LYS A 87 -1.851 13.437 -0.438 1.00 0.00 C ATOM 1321 O LYS A 87 -2.742 13.707 -1.243 1.00 0.00 O ATOM 1322 CB LYS A 87 0.363 13.280 -1.704 1.00 0.00 C ATOM 1323 CG LYS A 87 1.519 12.371 -2.174 1.00 0.00 C ATOM 1324 CD LYS A 87 2.605 13.138 -2.947 1.00 0.00 C ATOM 1325 CE LYS A 87 3.590 13.858 -2.014 1.00 0.00 C ATOM 1326 NZ LYS A 87 4.441 14.827 -2.756 1.00 0.00 N ATOM 0 H LYS A 87 -1.839 11.606 -2.346 1.00 0.00 H new ATOM 0 HA LYS A 87 -0.162 12.204 0.031 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -0.122 13.720 -2.575 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.771 14.103 -1.117 1.00 0.00 H new ATOM 0 HG2 LYS A 87 1.970 11.887 -1.308 1.00 0.00 H new ATOM 0 HG3 LYS A 87 1.118 11.580 -2.808 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.153 12.443 -3.583 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.132 13.868 -3.605 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.037 14.382 -1.235 1.00 0.00 H new ATOM 0 HE3 LYS A 87 4.223 13.124 -1.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 5.093 15.294 -2.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 4.988 14.323 -3.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 3.838 15.542 -3.210 1.00 0.00 H new ATOM 1340 N ASP A 88 -1.881 13.855 0.829 1.00 0.00 N ATOM 1341 CA ASP A 88 -2.988 14.626 1.434 1.00 0.00 C ATOM 1342 C ASP A 88 -4.388 13.987 1.208 1.00 0.00 C ATOM 1343 O ASP A 88 -5.384 14.675 0.978 1.00 0.00 O ATOM 1344 CB ASP A 88 -2.874 16.101 0.995 1.00 0.00 C ATOM 1345 CG ASP A 88 -3.771 17.059 1.802 1.00 0.00 C ATOM 1346 OD1 ASP A 88 -3.729 17.024 3.054 1.00 0.00 O ATOM 1347 OD2 ASP A 88 -4.467 17.903 1.186 1.00 0.00 O ATOM 0 H ASP A 88 -1.123 13.667 1.484 1.00 0.00 H new ATOM 0 HA ASP A 88 -2.888 14.596 2.519 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -1.836 16.421 1.092 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -3.133 16.178 -0.061 1.00 0.00 H new ATOM 1352 N GLY A 89 -4.454 12.646 1.205 1.00 0.00 N ATOM 1353 CA GLY A 89 -5.671 11.864 0.951 1.00 0.00 C ATOM 1354 C GLY A 89 -6.200 11.891 -0.492 1.00 0.00 C ATOM 1355 O GLY A 89 -7.348 11.511 -0.716 1.00 0.00 O ATOM 0 H GLY A 89 -3.638 12.061 1.385 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.477 10.827 1.227 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.457 12.228 1.612 1.00 0.00 H new ATOM 1359 N GLN A 90 -5.396 12.321 -1.471 1.00 0.00 N ATOM 1360 CA GLN A 90 -5.703 12.247 -2.910 1.00 0.00 C ATOM 1361 C GLN A 90 -4.692 11.332 -3.630 1.00 0.00 C ATOM 1362 O GLN A 90 -3.510 11.361 -3.280 1.00 0.00 O ATOM 1363 CB GLN A 90 -5.706 13.656 -3.528 1.00 0.00 C ATOM 1364 CG GLN A 90 -6.797 14.562 -2.930 1.00 0.00 C ATOM 1365 CD GLN A 90 -6.868 15.949 -3.577 1.00 0.00 C ATOM 1366 OE1 GLN A 90 -6.136 16.304 -4.494 1.00 0.00 O ATOM 1367 NE2 GLN A 90 -7.769 16.798 -3.126 1.00 0.00 N ATOM 0 H GLN A 90 -4.487 12.743 -1.282 1.00 0.00 H new ATOM 0 HA GLN A 90 -6.697 11.817 -3.035 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -4.731 14.118 -3.375 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -5.855 13.576 -4.605 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -7.764 14.071 -3.037 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -6.615 14.678 -1.862 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -8.390 16.526 -2.364 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -7.846 17.727 -3.539 1.00 0.00 H new ATOM 1376 N PRO A 91 -5.102 10.498 -4.608 1.00 0.00 N ATOM 1377 CA PRO A 91 -4.199 9.554 -5.274 1.00 0.00 C ATOM 1378 C PRO A 91 -3.183 10.274 -6.176 1.00 0.00 C ATOM 1379 O PRO A 91 -3.529 11.229 -6.878 1.00 0.00 O ATOM 1380 CB PRO A 91 -5.110 8.605 -6.060 1.00 0.00 C ATOM 1381 CG PRO A 91 -6.346 9.457 -6.351 1.00 0.00 C ATOM 1382 CD PRO A 91 -6.459 10.343 -5.110 1.00 0.00 C ATOM 0 HA PRO A 91 -3.588 9.006 -4.557 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -4.634 8.261 -6.978 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -5.362 7.718 -5.479 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -6.223 10.048 -7.258 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -7.235 8.842 -6.489 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -6.897 11.310 -5.358 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -7.103 9.885 -4.360 1.00 0.00 H new ATOM 1390 N VAL A 92 -1.930 9.802 -6.172 1.00 0.00 N ATOM 1391 CA VAL A 92 -0.798 10.432 -6.882 1.00 0.00 C ATOM 1392 C VAL A 92 -0.023 9.452 -7.773 1.00 0.00 C ATOM 1393 O VAL A 92 0.304 9.812 -8.908 1.00 0.00 O ATOM 1394 CB VAL A 92 0.131 11.157 -5.876 1.00 0.00 C ATOM 1395 CG1 VAL A 92 1.415 11.692 -6.527 1.00 0.00 C ATOM 1396 CG2 VAL A 92 -0.599 12.361 -5.270 1.00 0.00 C ATOM 0 H VAL A 92 -1.665 8.956 -5.667 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.218 11.172 -7.563 1.00 0.00 H new ATOM 0 HB VAL A 92 0.398 10.416 -5.122 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.025 12.189 -5.773 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.976 10.864 -6.959 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.156 12.403 -7.311 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.059 12.867 -4.563 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.880 13.053 -6.064 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.495 12.020 -4.751 1.00 0.00 H new ATOM 1406 N LYS A 93 0.267 8.226 -7.309 1.00 0.00 N ATOM 1407 CA LYS A 93 1.093 7.245 -8.047 1.00 0.00 C ATOM 1408 C LYS A 93 0.639 5.795 -7.829 1.00 0.00 C ATOM 1409 O LYS A 93 0.106 5.467 -6.771 1.00 0.00 O ATOM 1410 CB LYS A 93 2.572 7.469 -7.664 1.00 0.00 C ATOM 1411 CG LYS A 93 3.553 6.584 -8.447 1.00 0.00 C ATOM 1412 CD LYS A 93 5.006 7.014 -8.217 1.00 0.00 C ATOM 1413 CE LYS A 93 5.911 6.104 -9.048 1.00 0.00 C ATOM 1414 NZ LYS A 93 7.325 6.519 -8.963 1.00 0.00 N ATOM 0 H LYS A 93 -0.064 7.882 -6.408 1.00 0.00 H new ATOM 0 HA LYS A 93 0.968 7.409 -9.117 1.00 0.00 H new ATOM 0 HB2 LYS A 93 2.827 8.515 -7.832 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.695 7.278 -6.598 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.428 5.544 -8.144 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.321 6.636 -9.511 1.00 0.00 H new ATOM 0 HD2 LYS A 93 5.145 8.055 -8.507 1.00 0.00 H new ATOM 0 HD3 LYS A 93 5.261 6.941 -7.160 1.00 0.00 H new ATOM 0 HE2 LYS A 93 5.812 5.076 -8.700 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.588 6.121 -10.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 7.898 5.934 -9.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 7.411 7.518 -9.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 7.664 6.398 -7.987 1.00 0.00 H new ATOM 1428 N ARG A 94 0.893 4.920 -8.811 1.00 0.00 N ATOM 1429 CA ARG A 94 0.695 3.459 -8.740 1.00 0.00 C ATOM 1430 C ARG A 94 1.963 2.701 -9.159 1.00 0.00 C ATOM 1431 O ARG A 94 2.632 3.095 -10.116 1.00 0.00 O ATOM 1432 CB ARG A 94 -0.522 3.069 -9.599 1.00 0.00 C ATOM 1433 CG ARG A 94 -0.894 1.588 -9.442 1.00 0.00 C ATOM 1434 CD ARG A 94 -2.059 1.197 -10.353 1.00 0.00 C ATOM 1435 NE ARG A 94 -2.313 -0.255 -10.281 1.00 0.00 N ATOM 1436 CZ ARG A 94 -3.347 -0.902 -10.777 1.00 0.00 C ATOM 1437 NH1 ARG A 94 -4.280 -0.301 -11.455 1.00 0.00 N ATOM 1438 NH2 ARG A 94 -3.474 -2.179 -10.570 1.00 0.00 N ATOM 0 H ARG A 94 1.257 5.219 -9.716 1.00 0.00 H new ATOM 0 HA ARG A 94 0.496 3.174 -7.707 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -1.375 3.687 -9.319 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.307 3.278 -10.647 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.027 0.969 -9.674 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -1.161 1.388 -8.404 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -2.956 1.743 -10.060 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -1.835 1.481 -11.381 1.00 0.00 H new ATOM 0 HE ARG A 94 -1.614 -0.817 -9.796 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -4.225 0.704 -11.618 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -5.067 -0.835 -11.824 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.773 -2.679 -10.024 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -4.275 -2.681 -10.954 1.00 0.00 H new ATOM 1452 N ILE A 95 2.275 1.611 -8.456 1.00 0.00 N ATOM 1453 CA ILE A 95 3.373 0.668 -8.748 1.00 0.00 C ATOM 1454 C ILE A 95 2.828 -0.756 -8.647 1.00 0.00 C ATOM 1455 O ILE A 95 2.032 -1.047 -7.757 1.00 0.00 O ATOM 1456 CB ILE A 95 4.567 0.879 -7.775 1.00 0.00 C ATOM 1457 CG1 ILE A 95 5.041 2.348 -7.630 1.00 0.00 C ATOM 1458 CG2 ILE A 95 5.764 -0.004 -8.179 1.00 0.00 C ATOM 1459 CD1 ILE A 95 5.738 2.612 -6.287 1.00 0.00 C ATOM 0 H ILE A 95 1.747 1.342 -7.626 1.00 0.00 H new ATOM 0 HA ILE A 95 3.749 0.846 -9.755 1.00 0.00 H new ATOM 0 HB ILE A 95 4.181 0.585 -6.799 1.00 0.00 H new ATOM 0 HG12 ILE A 95 5.725 2.587 -8.444 1.00 0.00 H new ATOM 0 HG13 ILE A 95 4.184 3.014 -7.728 1.00 0.00 H new ATOM 0 HG21 ILE A 95 6.588 0.160 -7.484 1.00 0.00 H new ATOM 0 HG22 ILE A 95 5.469 -1.053 -8.150 1.00 0.00 H new ATOM 0 HG23 ILE A 95 6.083 0.256 -9.188 1.00 0.00 H new ATOM 0 HD11 ILE A 95 6.050 3.655 -6.238 1.00 0.00 H new ATOM 0 HD12 ILE A 95 5.047 2.401 -5.471 1.00 0.00 H new ATOM 0 HD13 ILE A 95 6.613 1.967 -6.198 1.00 0.00 H new ATOM 1471 N VAL A 96 3.222 -1.648 -9.557 1.00 0.00 N ATOM 1472 CA VAL A 96 2.641 -2.987 -9.683 1.00 0.00 C ATOM 1473 C VAL A 96 3.697 -4.091 -9.768 1.00 0.00 C ATOM 1474 O VAL A 96 4.825 -3.863 -10.218 1.00 0.00 O ATOM 1475 CB VAL A 96 1.657 -3.034 -10.859 1.00 0.00 C ATOM 1476 CG1 VAL A 96 0.537 -1.995 -10.729 1.00 0.00 C ATOM 1477 CG2 VAL A 96 2.314 -2.872 -12.237 1.00 0.00 C ATOM 0 H VAL A 96 3.961 -1.460 -10.235 1.00 0.00 H new ATOM 0 HA VAL A 96 2.087 -3.188 -8.766 1.00 0.00 H new ATOM 0 HB VAL A 96 1.239 -4.039 -10.802 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.131 -2.071 -11.587 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.025 -2.179 -9.814 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.970 -0.995 -10.694 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.549 -2.917 -13.012 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.824 -1.910 -12.286 1.00 0.00 H new ATOM 0 HG23 VAL A 96 3.036 -3.674 -12.392 1.00 0.00 H new ATOM 1487 N GLY A 97 3.346 -5.294 -9.311 1.00 0.00 N ATOM 1488 CA GLY A 97 4.279 -6.418 -9.170 1.00 0.00 C ATOM 1489 C GLY A 97 5.272 -6.245 -8.011 1.00 0.00 C ATOM 1490 O GLY A 97 5.365 -5.181 -7.396 1.00 0.00 O ATOM 0 H GLY A 97 2.394 -5.520 -9.024 1.00 0.00 H new ATOM 0 HA2 GLY A 97 3.711 -7.335 -9.018 1.00 0.00 H new ATOM 0 HA3 GLY A 97 4.835 -6.538 -10.100 1.00 0.00 H new ATOM 1494 N ALA A 98 6.041 -7.295 -7.716 1.00 0.00 N ATOM 1495 CA ALA A 98 7.096 -7.242 -6.701 1.00 0.00 C ATOM 1496 C ALA A 98 8.318 -6.424 -7.171 1.00 0.00 C ATOM 1497 O ALA A 98 8.597 -6.318 -8.371 1.00 0.00 O ATOM 1498 CB ALA A 98 7.477 -8.672 -6.298 1.00 0.00 C ATOM 0 H ALA A 98 5.951 -8.203 -8.172 1.00 0.00 H new ATOM 0 HA ALA A 98 6.714 -6.719 -5.824 1.00 0.00 H new ATOM 0 HB1 ALA A 98 8.262 -8.640 -5.543 1.00 0.00 H new ATOM 0 HB2 ALA A 98 6.603 -9.181 -5.892 1.00 0.00 H new ATOM 0 HB3 ALA A 98 7.837 -9.213 -7.173 1.00 0.00 H new ATOM 1504 N LYS A 99 9.053 -5.852 -6.210 1.00 0.00 N ATOM 1505 CA LYS A 99 10.407 -5.290 -6.362 1.00 0.00 C ATOM 1506 C LYS A 99 11.272 -5.680 -5.155 1.00 0.00 C ATOM 1507 O LYS A 99 10.736 -5.952 -4.079 1.00 0.00 O ATOM 1508 CB LYS A 99 10.373 -3.756 -6.514 1.00 0.00 C ATOM 1509 CG LYS A 99 9.944 -3.284 -7.908 1.00 0.00 C ATOM 1510 CD LYS A 99 8.451 -2.940 -7.999 1.00 0.00 C ATOM 1511 CE LYS A 99 8.057 -2.810 -9.473 1.00 0.00 C ATOM 1512 NZ LYS A 99 7.675 -4.117 -10.068 1.00 0.00 N ATOM 0 H LYS A 99 8.705 -5.762 -5.255 1.00 0.00 H new ATOM 0 HA LYS A 99 10.841 -5.704 -7.272 1.00 0.00 H new ATOM 0 HB2 LYS A 99 9.689 -3.341 -5.773 1.00 0.00 H new ATOM 0 HB3 LYS A 99 11.363 -3.356 -6.293 1.00 0.00 H new ATOM 0 HG2 LYS A 99 10.529 -2.407 -8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 99 10.175 -4.063 -8.635 1.00 0.00 H new ATOM 0 HD2 LYS A 99 7.856 -3.716 -7.518 1.00 0.00 H new ATOM 0 HD3 LYS A 99 8.247 -2.008 -7.471 1.00 0.00 H new ATOM 0 HE2 LYS A 99 7.224 -2.113 -9.565 1.00 0.00 H new ATOM 0 HE3 LYS A 99 8.890 -2.386 -10.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 8.111 -4.212 -11.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 8.006 -4.888 -9.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 6.640 -4.167 -10.160 1.00 0.00 H new ATOM 1526 N GLY A 100 12.598 -5.640 -5.298 1.00 0.00 N ATOM 1527 CA GLY A 100 13.512 -5.566 -4.157 1.00 0.00 C ATOM 1528 C GLY A 100 13.553 -4.141 -3.601 1.00 0.00 C ATOM 1529 O GLY A 100 13.183 -3.190 -4.294 1.00 0.00 O ATOM 0 H GLY A 100 13.067 -5.658 -6.204 1.00 0.00 H new ATOM 0 HA2 GLY A 100 13.190 -6.258 -3.379 1.00 0.00 H new ATOM 0 HA3 GLY A 100 14.512 -5.873 -4.463 1.00 0.00 H new ATOM 1533 N LYS A 101 14.022 -3.973 -2.362 1.00 0.00 N ATOM 1534 CA LYS A 101 14.070 -2.675 -1.654 1.00 0.00 C ATOM 1535 C LYS A 101 14.717 -1.543 -2.442 1.00 0.00 C ATOM 1536 O LYS A 101 14.266 -0.408 -2.341 1.00 0.00 O ATOM 1537 CB LYS A 101 14.798 -2.858 -0.316 1.00 0.00 C ATOM 1538 CG LYS A 101 14.516 -1.691 0.647 1.00 0.00 C ATOM 1539 CD LYS A 101 15.195 -1.930 1.995 1.00 0.00 C ATOM 1540 CE LYS A 101 14.800 -0.838 2.995 1.00 0.00 C ATOM 1541 NZ LYS A 101 15.542 -1.034 4.262 1.00 0.00 N ATOM 0 H LYS A 101 14.388 -4.745 -1.805 1.00 0.00 H new ATOM 0 HA LYS A 101 13.034 -2.372 -1.506 1.00 0.00 H new ATOM 0 HB2 LYS A 101 14.484 -3.795 0.145 1.00 0.00 H new ATOM 0 HB3 LYS A 101 15.871 -2.934 -0.492 1.00 0.00 H new ATOM 0 HG2 LYS A 101 14.876 -0.759 0.212 1.00 0.00 H new ATOM 0 HG3 LYS A 101 13.441 -1.582 0.790 1.00 0.00 H new ATOM 0 HD2 LYS A 101 14.911 -2.908 2.384 1.00 0.00 H new ATOM 0 HD3 LYS A 101 16.277 -1.940 1.867 1.00 0.00 H new ATOM 0 HE2 LYS A 101 15.021 0.146 2.581 1.00 0.00 H new ATOM 0 HE3 LYS A 101 13.727 -0.872 3.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 15.188 -0.368 4.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 15.404 -2.009 4.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 16.555 -0.863 4.101 1.00 0.00 H new ATOM 1555 N ALA A 102 15.720 -1.851 -3.253 1.00 0.00 N ATOM 1556 CA ALA A 102 16.403 -0.850 -4.077 1.00 0.00 C ATOM 1557 C ALA A 102 15.453 -0.206 -5.109 1.00 0.00 C ATOM 1558 O ALA A 102 15.355 1.019 -5.187 1.00 0.00 O ATOM 1559 CB ALA A 102 17.625 -1.503 -4.735 1.00 0.00 C ATOM 0 H ALA A 102 16.086 -2.797 -3.362 1.00 0.00 H new ATOM 0 HA ALA A 102 16.741 -0.030 -3.443 1.00 0.00 H new ATOM 0 HB1 ALA A 102 18.142 -0.768 -5.352 1.00 0.00 H new ATOM 0 HB2 ALA A 102 18.301 -1.870 -3.963 1.00 0.00 H new ATOM 0 HB3 ALA A 102 17.301 -2.336 -5.359 1.00 0.00 H new ATOM 1565 N ALA A 103 14.704 -1.021 -5.859 1.00 0.00 N ATOM 1566 CA ALA A 103 13.725 -0.555 -6.844 1.00 0.00 C ATOM 1567 C ALA A 103 12.398 -0.091 -6.206 1.00 0.00 C ATOM 1568 O ALA A 103 11.815 0.886 -6.676 1.00 0.00 O ATOM 1569 CB ALA A 103 13.530 -1.662 -7.886 1.00 0.00 C ATOM 0 H ALA A 103 14.762 -2.037 -5.797 1.00 0.00 H new ATOM 0 HA ALA A 103 14.110 0.339 -7.334 1.00 0.00 H new ATOM 0 HB1 ALA A 103 12.804 -1.337 -8.631 1.00 0.00 H new ATOM 0 HB2 ALA A 103 14.481 -1.873 -8.375 1.00 0.00 H new ATOM 0 HB3 ALA A 103 13.166 -2.564 -7.395 1.00 0.00 H new ATOM 1575 N LEU A 104 11.935 -0.723 -5.115 1.00 0.00 N ATOM 1576 CA LEU A 104 10.736 -0.287 -4.391 1.00 0.00 C ATOM 1577 C LEU A 104 10.981 1.089 -3.745 1.00 0.00 C ATOM 1578 O LEU A 104 10.193 2.013 -3.962 1.00 0.00 O ATOM 1579 CB LEU A 104 10.360 -1.383 -3.367 1.00 0.00 C ATOM 1580 CG LEU A 104 8.904 -1.436 -2.858 1.00 0.00 C ATOM 1581 CD1 LEU A 104 8.456 -0.139 -2.197 1.00 0.00 C ATOM 1582 CD2 LEU A 104 7.899 -1.801 -3.949 1.00 0.00 C ATOM 0 H LEU A 104 12.382 -1.547 -4.713 1.00 0.00 H new ATOM 0 HA LEU A 104 9.892 -0.158 -5.068 1.00 0.00 H new ATOM 0 HB2 LEU A 104 10.592 -2.350 -3.814 1.00 0.00 H new ATOM 0 HB3 LEU A 104 11.012 -1.267 -2.501 1.00 0.00 H new ATOM 0 HG LEU A 104 8.915 -2.229 -2.110 1.00 0.00 H new ATOM 0 HD11 LEU A 104 7.424 -0.240 -1.861 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.097 0.074 -1.342 1.00 0.00 H new ATOM 0 HD13 LEU A 104 8.525 0.678 -2.915 1.00 0.00 H new ATOM 0 HD21 LEU A 104 6.894 -1.821 -3.526 1.00 0.00 H new ATOM 0 HD22 LEU A 104 7.942 -1.059 -4.746 1.00 0.00 H new ATOM 0 HD23 LEU A 104 8.142 -2.783 -4.354 1.00 0.00 H new ATOM 1594 N LEU A 105 12.115 1.279 -3.049 1.00 0.00 N ATOM 1595 CA LEU A 105 12.501 2.604 -2.564 1.00 0.00 C ATOM 1596 C LEU A 105 12.732 3.548 -3.730 1.00 0.00 C ATOM 1597 O LEU A 105 12.228 4.638 -3.623 1.00 0.00 O ATOM 1598 CB LEU A 105 13.692 2.599 -1.585 1.00 0.00 C ATOM 1599 CG LEU A 105 14.039 3.960 -0.904 1.00 0.00 C ATOM 1600 CD1 LEU A 105 15.037 4.782 -1.723 1.00 0.00 C ATOM 1601 CD2 LEU A 105 12.853 4.811 -0.438 1.00 0.00 C ATOM 0 H LEU A 105 12.772 0.535 -2.814 1.00 0.00 H new ATOM 0 HA LEU A 105 11.661 2.969 -1.973 1.00 0.00 H new ATOM 0 HB2 LEU A 105 13.487 1.868 -0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 105 14.574 2.252 -2.123 1.00 0.00 H new ATOM 0 HG LEU A 105 14.518 3.653 0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 105 15.246 5.719 -1.207 1.00 0.00 H new ATOM 0 HD12 LEU A 105 15.962 4.218 -1.841 1.00 0.00 H new ATOM 0 HD13 LEU A 105 14.614 4.995 -2.705 1.00 0.00 H new ATOM 0 HD21 LEU A 105 13.221 5.730 0.018 1.00 0.00 H new ATOM 0 HD22 LEU A 105 12.224 5.057 -1.293 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.269 4.252 0.293 1.00 0.00 H new ATOM 1613 N ARG A 106 13.374 3.209 -4.856 1.00 0.00 N ATOM 1614 CA ARG A 106 13.508 4.154 -5.996 1.00 0.00 C ATOM 1615 C ARG A 106 12.146 4.718 -6.442 1.00 0.00 C ATOM 1616 O ARG A 106 11.944 5.942 -6.498 1.00 0.00 O ATOM 1617 CB ARG A 106 14.288 3.443 -7.120 1.00 0.00 C ATOM 1618 CG ARG A 106 14.294 4.063 -8.528 1.00 0.00 C ATOM 1619 CD ARG A 106 14.547 5.571 -8.626 1.00 0.00 C ATOM 1620 NE ARG A 106 15.691 6.030 -7.809 1.00 0.00 N ATOM 1621 CZ ARG A 106 15.672 6.946 -6.855 1.00 0.00 C ATOM 1622 NH1 ARG A 106 14.590 7.590 -6.524 1.00 0.00 N ATOM 1623 NH2 ARG A 106 16.747 7.225 -6.178 1.00 0.00 N ATOM 0 H ARG A 106 13.808 2.299 -5.011 1.00 0.00 H new ATOM 0 HA ARG A 106 14.073 5.035 -5.692 1.00 0.00 H new ATOM 0 HB2 ARG A 106 15.325 3.352 -6.795 1.00 0.00 H new ATOM 0 HB3 ARG A 106 13.892 2.431 -7.207 1.00 0.00 H new ATOM 0 HG2 ARG A 106 15.055 3.553 -9.119 1.00 0.00 H new ATOM 0 HG3 ARG A 106 13.332 3.850 -8.995 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.726 5.835 -9.668 1.00 0.00 H new ATOM 0 HD3 ARG A 106 13.649 6.103 -8.312 1.00 0.00 H new ATOM 0 HE ARG A 106 16.592 5.593 -8.002 1.00 0.00 H new ATOM 0 HH11 ARG A 106 13.713 7.395 -7.007 1.00 0.00 H new ATOM 0 HH12 ARG A 106 14.619 8.289 -5.782 1.00 0.00 H new ATOM 0 HH21 ARG A 106 17.619 6.735 -6.380 1.00 0.00 H new ATOM 0 HH22 ARG A 106 16.718 7.934 -5.445 1.00 0.00 H new ATOM 1637 N GLU A 107 11.184 3.827 -6.664 1.00 0.00 N ATOM 1638 CA GLU A 107 9.835 4.193 -7.097 1.00 0.00 C ATOM 1639 C GLU A 107 9.026 4.960 -6.035 1.00 0.00 C ATOM 1640 O GLU A 107 8.241 5.833 -6.409 1.00 0.00 O ATOM 1641 CB GLU A 107 9.093 2.946 -7.592 1.00 0.00 C ATOM 1642 CG GLU A 107 9.624 2.427 -8.939 1.00 0.00 C ATOM 1643 CD GLU A 107 9.535 3.443 -10.101 1.00 0.00 C ATOM 1644 OE1 GLU A 107 8.712 4.390 -10.046 1.00 0.00 O ATOM 1645 OE2 GLU A 107 10.301 3.297 -11.084 1.00 0.00 O ATOM 0 H GLU A 107 11.318 2.822 -6.548 1.00 0.00 H new ATOM 0 HA GLU A 107 9.944 4.897 -7.922 1.00 0.00 H new ATOM 0 HB2 GLU A 107 9.180 2.157 -6.845 1.00 0.00 H new ATOM 0 HB3 GLU A 107 8.032 3.176 -7.690 1.00 0.00 H new ATOM 0 HG2 GLU A 107 10.665 2.129 -8.814 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.067 1.531 -9.213 1.00 0.00 H new ATOM 1652 N LEU A 108 9.247 4.729 -4.735 1.00 0.00 N ATOM 1653 CA LEU A 108 8.692 5.578 -3.666 1.00 0.00 C ATOM 1654 C LEU A 108 9.526 6.837 -3.388 1.00 0.00 C ATOM 1655 O LEU A 108 8.978 7.828 -2.930 1.00 0.00 O ATOM 1656 CB LEU A 108 8.504 4.760 -2.377 1.00 0.00 C ATOM 1657 CG LEU A 108 7.464 3.634 -2.494 1.00 0.00 C ATOM 1658 CD1 LEU A 108 7.355 2.899 -1.157 1.00 0.00 C ATOM 1659 CD2 LEU A 108 6.067 4.144 -2.857 1.00 0.00 C ATOM 0 H LEU A 108 9.813 3.952 -4.392 1.00 0.00 H new ATOM 0 HA LEU A 108 7.723 5.928 -4.023 1.00 0.00 H new ATOM 0 HB2 LEU A 108 9.462 4.326 -2.092 1.00 0.00 H new ATOM 0 HB3 LEU A 108 8.206 5.433 -1.573 1.00 0.00 H new ATOM 0 HG LEU A 108 7.809 2.978 -3.293 1.00 0.00 H new ATOM 0 HD11 LEU A 108 6.618 2.101 -1.240 1.00 0.00 H new ATOM 0 HD12 LEU A 108 8.324 2.473 -0.896 1.00 0.00 H new ATOM 0 HD13 LEU A 108 7.046 3.599 -0.381 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.378 3.302 -2.925 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.721 4.835 -2.088 1.00 0.00 H new ATOM 0 HD23 LEU A 108 6.106 4.659 -3.817 1.00 0.00 H new ATOM 1671 N SER A 109 10.820 6.824 -3.698 1.00 0.00 N ATOM 1672 CA SER A 109 11.831 7.888 -3.528 1.00 0.00 C ATOM 1673 C SER A 109 11.617 9.021 -4.536 1.00 0.00 C ATOM 1674 O SER A 109 11.966 10.177 -4.291 1.00 0.00 O ATOM 1675 CB SER A 109 13.255 7.336 -3.616 1.00 0.00 C ATOM 1676 OG SER A 109 14.247 8.345 -3.739 1.00 0.00 O ATOM 0 H SER A 109 11.237 5.992 -4.116 1.00 0.00 H new ATOM 0 HA SER A 109 11.702 8.299 -2.527 1.00 0.00 H new ATOM 0 HB2 SER A 109 13.461 6.741 -2.726 1.00 0.00 H new ATOM 0 HB3 SER A 109 13.324 6.664 -4.471 1.00 0.00 H new ATOM 0 HG SER A 109 14.070 9.058 -3.091 1.00 0.00 H new ATOM 1682 N ASP A 110 10.924 8.706 -5.636 1.00 0.00 N ATOM 1683 CA ASP A 110 10.205 9.701 -6.450 1.00 0.00 C ATOM 1684 C ASP A 110 9.360 10.695 -5.596 1.00 0.00 C ATOM 1685 O ASP A 110 9.168 11.848 -5.991 1.00 0.00 O ATOM 1686 CB ASP A 110 9.327 8.916 -7.435 1.00 0.00 C ATOM 1687 CG ASP A 110 8.787 9.727 -8.625 1.00 0.00 C ATOM 1688 OD1 ASP A 110 9.397 10.742 -9.034 1.00 0.00 O ATOM 1689 OD2 ASP A 110 7.771 9.274 -9.204 1.00 0.00 O ATOM 0 H ASP A 110 10.844 7.753 -5.990 1.00 0.00 H new ATOM 0 HA ASP A 110 10.922 10.331 -6.976 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.905 8.076 -7.821 1.00 0.00 H new ATOM 0 HB3 ASP A 110 8.482 8.497 -6.889 1.00 0.00 H new ATOM 1694 N VAL A 111 8.919 10.283 -4.395 1.00 0.00 N ATOM 1695 CA VAL A 111 8.361 11.117 -3.312 1.00 0.00 C ATOM 1696 C VAL A 111 9.288 11.202 -2.074 1.00 0.00 C ATOM 1697 O VAL A 111 9.601 12.309 -1.636 1.00 0.00 O ATOM 1698 CB VAL A 111 6.953 10.592 -2.962 1.00 0.00 C ATOM 1699 CG1 VAL A 111 6.381 11.184 -1.670 1.00 0.00 C ATOM 1700 CG2 VAL A 111 5.980 10.923 -4.104 1.00 0.00 C ATOM 0 H VAL A 111 8.943 9.297 -4.137 1.00 0.00 H new ATOM 0 HA VAL A 111 8.284 12.145 -3.666 1.00 0.00 H new ATOM 0 HB VAL A 111 7.060 9.517 -2.817 1.00 0.00 H new ATOM 0 HG11 VAL A 111 5.390 10.769 -1.488 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.037 10.937 -0.835 1.00 0.00 H new ATOM 0 HG13 VAL A 111 6.309 12.267 -1.767 1.00 0.00 H new ATOM 0 HG21 VAL A 111 4.986 10.551 -3.855 1.00 0.00 H new ATOM 0 HG22 VAL A 111 5.939 12.003 -4.245 1.00 0.00 H new ATOM 0 HG23 VAL A 111 6.324 10.450 -5.024 1.00 0.00 H new ATOM 1710 N VAL A 112 9.751 10.069 -1.522 1.00 0.00 N ATOM 1711 CA VAL A 112 10.620 9.942 -0.328 1.00 0.00 C ATOM 1712 C VAL A 112 12.020 10.511 -0.608 1.00 0.00 C ATOM 1713 O VAL A 112 12.792 9.895 -1.344 1.00 0.00 O ATOM 1714 CB VAL A 112 10.680 8.465 0.162 1.00 0.00 C ATOM 1715 CG1 VAL A 112 11.644 8.238 1.326 1.00 0.00 C ATOM 1716 CG2 VAL A 112 9.298 7.988 0.621 1.00 0.00 C ATOM 0 H VAL A 112 9.518 9.158 -1.917 1.00 0.00 H new ATOM 0 HA VAL A 112 10.185 10.532 0.479 1.00 0.00 H new ATOM 0 HB VAL A 112 11.037 7.901 -0.700 1.00 0.00 H new ATOM 0 HG11 VAL A 112 11.630 7.186 1.610 1.00 0.00 H new ATOM 0 HG12 VAL A 112 12.653 8.519 1.023 1.00 0.00 H new ATOM 0 HG13 VAL A 112 11.338 8.848 2.176 1.00 0.00 H new ATOM 0 HG21 VAL A 112 9.364 6.954 0.959 1.00 0.00 H new ATOM 0 HG22 VAL A 112 8.950 8.616 1.441 1.00 0.00 H new ATOM 0 HG23 VAL A 112 8.596 8.054 -0.210 1.00 0.00 H new ATOM 1726 N PRO A 113 12.434 11.632 0.020 1.00 0.00 N ATOM 1727 CA PRO A 113 13.783 12.165 -0.182 1.00 0.00 C ATOM 1728 C PRO A 113 14.875 11.299 0.481 1.00 0.00 C ATOM 1729 O PRO A 113 16.066 11.537 0.276 1.00 0.00 O ATOM 1730 CB PRO A 113 13.733 13.587 0.386 1.00 0.00 C ATOM 1731 CG PRO A 113 12.720 13.459 1.525 1.00 0.00 C ATOM 1732 CD PRO A 113 11.703 12.460 0.973 1.00 0.00 C ATOM 0 HA PRO A 113 14.060 12.162 -1.236 1.00 0.00 H new ATOM 0 HB2 PRO A 113 14.708 13.913 0.747 1.00 0.00 H new ATOM 0 HB3 PRO A 113 13.411 14.311 -0.363 1.00 0.00 H new ATOM 0 HG2 PRO A 113 13.186 13.095 2.441 1.00 0.00 H new ATOM 0 HG3 PRO A 113 12.257 14.417 1.762 1.00 0.00 H new ATOM 0 HD2 PRO A 113 11.278 11.853 1.772 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.873 12.974 0.488 1.00 0.00 H new ATOM 1740 N ASN A 114 14.442 10.262 1.213 1.00 0.00 N ATOM 1741 CA ASN A 114 15.219 9.164 1.794 1.00 0.00 C ATOM 1742 C ASN A 114 16.166 9.547 2.946 1.00 0.00 C ATOM 1743 O ASN A 114 16.711 10.651 3.018 1.00 0.00 O ATOM 1744 CB ASN A 114 15.900 8.359 0.663 1.00 0.00 C ATOM 1745 CG ASN A 114 16.357 6.982 1.108 1.00 0.00 C ATOM 1746 OD1 ASN A 114 15.583 6.196 1.634 1.00 0.00 O ATOM 1747 ND2 ASN A 114 17.615 6.647 0.966 1.00 0.00 N ATOM 0 H ASN A 114 13.450 10.164 1.431 1.00 0.00 H new ATOM 0 HA ASN A 114 14.508 8.517 2.308 1.00 0.00 H new ATOM 0 HB2 ASN A 114 15.205 8.254 -0.170 1.00 0.00 H new ATOM 0 HB3 ASN A 114 16.759 8.919 0.292 1.00 0.00 H new ATOM 0 HD21 ASN A 114 17.941 5.737 1.293 1.00 0.00 H new ATOM 0 HD22 ASN A 114 18.269 7.296 0.528 1.00 0.00 H new ATOM 1754 N LEU A 115 16.384 8.578 3.840 1.00 0.00 N ATOM 1755 CA LEU A 115 17.326 8.667 4.967 1.00 0.00 C ATOM 1756 C LEU A 115 18.428 7.582 4.870 1.00 0.00 C ATOM 1757 O LEU A 115 18.353 6.553 5.543 1.00 0.00 O ATOM 1758 CB LEU A 115 16.544 8.623 6.298 1.00 0.00 C ATOM 1759 CG LEU A 115 15.546 9.776 6.522 1.00 0.00 C ATOM 1760 CD1 LEU A 115 14.770 9.534 7.818 1.00 0.00 C ATOM 1761 CD2 LEU A 115 16.234 11.139 6.631 1.00 0.00 C ATOM 0 H LEU A 115 15.897 7.683 3.801 1.00 0.00 H new ATOM 0 HA LEU A 115 17.852 9.621 4.927 1.00 0.00 H new ATOM 0 HB2 LEU A 115 15.999 7.680 6.348 1.00 0.00 H new ATOM 0 HB3 LEU A 115 17.260 8.621 7.120 1.00 0.00 H new ATOM 0 HG LEU A 115 14.885 9.794 5.656 1.00 0.00 H new ATOM 0 HD11 LEU A 115 14.064 10.349 7.977 1.00 0.00 H new ATOM 0 HD12 LEU A 115 14.226 8.592 7.746 1.00 0.00 H new ATOM 0 HD13 LEU A 115 15.466 9.488 8.656 1.00 0.00 H new ATOM 0 HD21 LEU A 115 15.484 11.914 6.788 1.00 0.00 H new ATOM 0 HD22 LEU A 115 16.928 11.130 7.472 1.00 0.00 H new ATOM 0 HD23 LEU A 115 16.781 11.345 5.711 1.00 0.00 H new ATOM 1773 N ASN A 116 19.459 7.745 4.028 1.00 0.00 N ATOM 1774 CA ASN A 116 19.659 8.797 3.013 1.00 0.00 C ATOM 1775 C ASN A 116 20.407 8.269 1.773 1.00 0.00 C ATOM 1776 O ASN A 116 19.828 8.354 0.667 1.00 0.00 O ATOM 1777 CB ASN A 116 20.371 10.018 3.640 1.00 0.00 C ATOM 1778 CG ASN A 116 20.450 11.198 2.681 1.00 0.00 C ATOM 1779 OD1 ASN A 116 21.517 11.611 2.244 1.00 0.00 O ATOM 1780 ND2 ASN A 116 19.327 11.784 2.328 1.00 0.00 N ATOM 1781 OXT ASN A 116 21.538 7.749 1.919 1.00 0.00 O ATOM 0 H ASN A 116 20.242 7.091 4.038 1.00 0.00 H new ATOM 0 HA ASN A 116 18.678 9.119 2.663 1.00 0.00 H new ATOM 0 HB2 ASN A 116 19.840 10.321 4.542 1.00 0.00 H new ATOM 0 HB3 ASN A 116 21.378 9.732 3.944 1.00 0.00 H new ATOM 0 HD21 ASN A 116 19.346 12.581 1.691 1.00 0.00 H new ATOM 0 HD22 ASN A 116 18.437 11.442 2.691 1.00 0.00 H new TER 1788 ASN A 116