USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 933 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: C 13 ASN : amide:sc= -0.245 K(o=-0.25,f=0.37) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0.396 USER MOD Set 2.2: C 21 THR OG1 : rot -72:sc= 0.427 USER MOD Set 3.1: A 13 ASN : amide:sc= -0.0695 K(o=-0.069,f=0.54) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0.458 USER MOD Set 4.2: A 21 THR OG1 : rot -70:sc= 0.518 USER MOD Single : A 1 MET CE :methyl -179:sc= -0.489 (180deg=-0.491) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.212 X(o=-0.21,f=0) USER MOD Single : A 35 ASN : amide:sc= 0.203 X(o=0.2,f=-0.15) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.955 X(o=-0.96,f=-1.3) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.862 K(o=0.86,f=0) USER MOD Single : A 52 GLN : amide:sc= -3.73! K(o=-3.7!,f=-1.2) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 176:sc= -0.415 (180deg=-0.544) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : C 29 GLN : amide:sc= -0.452 K(o=-0.45,f=-4.5!) USER MOD Single : C 35 ASN : amide:sc=-0.00897 K(o=-0.009,f=-1.6!) USER MOD Single : C 38 LYS NZ :NH3+ 143:sc= -0.228 (180deg=-1.86!) USER MOD Single : C 43 HIS : no HD1:sc= -1.13 K(o=-1.1,f=-0.47) USER MOD Single : C 48 TYR OH : rot 32:sc= 0.547 USER MOD Single : C 49 GLN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.95! K(o=-3.9!,f=-1.4) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.734 -7.853 -10.062 1.00 0.00 N ATOM 2 CA MET A 1 4.027 -6.861 -9.234 1.00 0.00 C ATOM 3 C MET A 1 2.688 -7.432 -8.778 1.00 0.00 C ATOM 4 O MET A 1 1.871 -7.809 -9.613 1.00 0.00 O ATOM 5 CB MET A 1 3.809 -5.569 -10.025 1.00 0.00 C ATOM 6 CG MET A 1 3.544 -4.392 -9.086 1.00 0.00 C ATOM 7 SD MET A 1 3.374 -2.785 -9.908 1.00 0.00 S ATOM 8 CE MET A 1 1.787 -3.034 -10.741 1.00 0.00 C ATOM 0 H1 MET A 1 5.646 -7.460 -10.371 1.00 0.00 H new ATOM 0 H2 MET A 1 4.899 -8.716 -9.505 1.00 0.00 H new ATOM 0 H3 MET A 1 4.157 -8.084 -10.895 1.00 0.00 H new ATOM 0 HA MET A 1 4.634 -6.632 -8.358 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.686 -5.360 -10.637 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.967 -5.693 -10.706 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.633 -4.594 -8.522 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.359 -4.331 -8.365 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.533 -2.142 -11.314 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.859 -3.889 -11.413 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.011 -3.220 -9.998 1.00 0.00 H new ATOM 20 N LEU A 2 2.454 -7.499 -7.464 1.00 0.00 N ATOM 21 CA LEU A 2 1.186 -7.993 -6.940 1.00 0.00 C ATOM 22 C LEU A 2 0.162 -6.860 -6.999 1.00 0.00 C ATOM 23 O LEU A 2 0.493 -5.719 -6.686 1.00 0.00 O ATOM 24 CB LEU A 2 1.387 -8.467 -5.490 1.00 0.00 C ATOM 25 CG LEU A 2 0.438 -9.579 -5.004 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.224 -9.445 -3.500 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.938 -9.591 -5.655 1.00 0.00 C ATOM 0 H LEU A 2 3.126 -7.218 -6.750 1.00 0.00 H new ATOM 0 HA LEU A 2 0.826 -8.834 -7.533 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.413 -8.820 -5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.275 -7.607 -4.829 1.00 0.00 H new ATOM 0 HG LEU A 2 0.934 -10.508 -5.286 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.447 -10.232 -3.157 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.181 -9.535 -2.987 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -0.215 -8.472 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.528 -10.410 -5.244 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.443 -8.646 -5.456 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.830 -9.726 -6.731 1.00 0.00 H new ATOM 39 N ILE A 3 -1.078 -7.163 -7.390 1.00 0.00 N ATOM 40 CA ILE A 3 -2.177 -6.208 -7.374 1.00 0.00 C ATOM 41 C ILE A 3 -3.260 -6.766 -6.468 1.00 0.00 C ATOM 42 O ILE A 3 -3.546 -7.961 -6.490 1.00 0.00 O ATOM 43 CB ILE A 3 -2.731 -5.954 -8.792 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.833 -5.029 -9.619 1.00 0.00 C ATOM 45 CG2 ILE A 3 -4.086 -5.248 -8.707 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.609 -5.742 -10.176 1.00 0.00 C ATOM 0 H ILE A 3 -1.345 -8.087 -7.729 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.822 -5.247 -7.001 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.796 -6.934 -9.265 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.411 -4.610 -10.443 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.510 -4.193 -8.999 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.469 -5.073 -9.712 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.788 -5.873 -8.155 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.968 -4.294 -8.193 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.009 -5.038 -10.753 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.013 -6.138 -9.354 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.927 -6.561 -10.821 1.00 0.00 H new ATOM 58 N LEU A 4 -3.859 -5.889 -5.669 1.00 0.00 N ATOM 59 CA LEU A 4 -4.924 -6.249 -4.753 1.00 0.00 C ATOM 60 C LEU A 4 -5.988 -5.155 -4.828 1.00 0.00 C ATOM 61 O LEU A 4 -5.751 -4.083 -5.381 1.00 0.00 O ATOM 62 CB LEU A 4 -4.363 -6.378 -3.330 1.00 0.00 C ATOM 63 CG LEU A 4 -3.317 -7.491 -3.145 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.815 -7.476 -1.704 1.00 0.00 C ATOM 65 CD2 LEU A 4 -3.934 -8.867 -3.380 1.00 0.00 C ATOM 0 H LEU A 4 -3.613 -4.900 -5.642 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.364 -7.209 -5.022 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.914 -5.427 -3.044 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.190 -6.559 -2.644 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.513 -7.312 -3.859 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.073 -8.263 -1.569 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.361 -6.509 -1.487 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.651 -7.645 -1.026 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.173 -9.635 -3.243 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.745 -9.028 -2.669 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.326 -8.921 -4.396 1.00 0.00 H new ATOM 77 N THR A 5 -7.168 -5.427 -4.272 1.00 0.00 N ATOM 78 CA THR A 5 -8.277 -4.486 -4.296 1.00 0.00 C ATOM 79 C THR A 5 -8.786 -4.319 -2.877 1.00 0.00 C ATOM 80 O THR A 5 -8.895 -5.293 -2.135 1.00 0.00 O ATOM 81 CB THR A 5 -9.353 -5.021 -5.247 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.786 -5.183 -6.524 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.551 -4.087 -5.393 1.00 0.00 C ATOM 0 H THR A 5 -7.377 -6.304 -3.795 1.00 0.00 H new ATOM 0 HA THR A 5 -7.972 -3.506 -4.663 1.00 0.00 H new ATOM 0 HB THR A 5 -9.708 -5.960 -4.822 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.464 -5.527 -7.142 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.274 -4.527 -6.080 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.019 -3.940 -4.419 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.217 -3.126 -5.784 1.00 0.00 H new ATOM 91 N ARG A 6 -9.098 -3.081 -2.495 1.00 0.00 N ATOM 92 CA ARG A 6 -9.470 -2.733 -1.135 1.00 0.00 C ATOM 93 C ARG A 6 -10.599 -1.718 -1.155 1.00 0.00 C ATOM 94 O ARG A 6 -10.989 -1.233 -2.215 1.00 0.00 O ATOM 95 CB ARG A 6 -8.248 -2.148 -0.409 1.00 0.00 C ATOM 96 CG ARG A 6 -7.214 -3.215 -0.031 1.00 0.00 C ATOM 97 CD ARG A 6 -7.544 -3.884 1.306 1.00 0.00 C ATOM 98 NE ARG A 6 -8.848 -4.550 1.306 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.070 -5.819 0.960 1.00 0.00 C ATOM 100 NH1 ARG A 6 -8.083 -6.612 0.559 1.00 0.00 N ATOM 101 NH2 ARG A 6 -10.307 -6.297 1.019 1.00 0.00 N ATOM 0 H ARG A 6 -9.098 -2.286 -3.134 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.809 -3.625 -0.609 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -7.776 -1.401 -1.047 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -8.579 -1.634 0.493 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.171 -3.972 -0.814 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -6.226 -2.758 0.026 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -6.769 -4.614 1.542 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.526 -3.133 2.096 1.00 0.00 H new ATOM 0 HE ARG A 6 -9.655 -3.997 1.595 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.129 -6.254 0.510 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -8.279 -7.579 0.300 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.072 -5.696 1.326 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.493 -7.265 0.758 1.00 0.00 H new ATOM 115 N LYS A 7 -11.128 -1.402 0.028 1.00 0.00 N ATOM 116 CA LYS A 7 -12.215 -0.455 0.171 1.00 0.00 C ATOM 117 C LYS A 7 -11.913 0.454 1.352 1.00 0.00 C ATOM 118 O LYS A 7 -11.173 0.061 2.254 1.00 0.00 O ATOM 119 CB LYS A 7 -13.537 -1.215 0.352 1.00 0.00 C ATOM 120 CG LYS A 7 -13.614 -2.396 -0.618 1.00 0.00 C ATOM 121 CD LYS A 7 -14.974 -3.088 -0.574 1.00 0.00 C ATOM 122 CE LYS A 7 -14.846 -4.463 -1.223 1.00 0.00 C ATOM 123 NZ LYS A 7 -16.104 -5.220 -1.131 1.00 0.00 N ATOM 0 H LYS A 7 -10.808 -1.801 0.911 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.314 0.163 -0.722 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.619 -1.574 1.378 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.377 -0.541 0.181 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.419 -2.045 -1.631 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.833 -3.116 -0.374 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.314 -3.187 0.457 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -15.719 -2.490 -1.099 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -14.565 -4.348 -2.270 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -14.047 -5.023 -0.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.983 -6.150 -1.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -16.359 -5.350 -0.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -16.861 -4.696 -1.616 1.00 0.00 H new ATOM 137 N VAL A 8 -12.478 1.662 1.347 1.00 0.00 N ATOM 138 CA VAL A 8 -12.220 2.652 2.382 1.00 0.00 C ATOM 139 C VAL A 8 -12.446 2.032 3.759 1.00 0.00 C ATOM 140 O VAL A 8 -13.572 1.665 4.096 1.00 0.00 O ATOM 141 CB VAL A 8 -13.134 3.862 2.164 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.932 4.868 3.296 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.809 4.517 0.824 1.00 0.00 C ATOM 0 H VAL A 8 -13.126 1.977 0.625 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.184 2.985 2.328 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.173 3.533 2.158 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.583 5.728 3.139 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.176 4.398 4.249 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.893 5.197 3.309 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.461 5.377 0.672 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.769 4.845 0.822 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.964 3.797 0.020 1.00 0.00 H new ATOM 153 N GLY A 9 -11.377 1.915 4.551 1.00 0.00 N ATOM 154 CA GLY A 9 -11.468 1.372 5.898 1.00 0.00 C ATOM 155 C GLY A 9 -10.800 0.002 6.026 1.00 0.00 C ATOM 156 O GLY A 9 -10.974 -0.666 7.043 1.00 0.00 O ATOM 0 H GLY A 9 -10.435 2.193 4.275 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.002 2.066 6.598 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.517 1.289 6.182 1.00 0.00 H new ATOM 160 N GLU A 10 -10.039 -0.419 5.011 1.00 0.00 N ATOM 161 CA GLU A 10 -9.373 -1.718 5.010 1.00 0.00 C ATOM 162 C GLU A 10 -7.858 -1.543 4.880 1.00 0.00 C ATOM 163 O GLU A 10 -7.373 -0.422 4.741 1.00 0.00 O ATOM 164 CB GLU A 10 -9.927 -2.586 3.876 1.00 0.00 C ATOM 165 CG GLU A 10 -11.432 -2.821 4.050 1.00 0.00 C ATOM 166 CD GLU A 10 -11.985 -3.753 2.977 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.399 -3.786 1.869 1.00 0.00 O ATOM 168 OE2 GLU A 10 -12.992 -4.434 3.272 1.00 0.00 O ATOM 0 H GLU A 10 -9.870 0.133 4.170 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.570 -2.220 5.957 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.739 -2.102 2.918 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.405 -3.543 3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.622 -3.247 5.035 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.957 -1.866 4.009 1.00 0.00 H new ATOM 175 N SER A 11 -7.111 -2.650 4.927 1.00 0.00 N ATOM 176 CA SER A 11 -5.655 -2.602 4.995 1.00 0.00 C ATOM 177 C SER A 11 -4.988 -3.734 4.213 1.00 0.00 C ATOM 178 O SER A 11 -5.640 -4.673 3.761 1.00 0.00 O ATOM 179 CB SER A 11 -5.218 -2.673 6.461 1.00 0.00 C ATOM 180 OG SER A 11 -5.768 -1.605 7.202 1.00 0.00 O ATOM 0 H SER A 11 -7.498 -3.594 4.919 1.00 0.00 H new ATOM 0 HA SER A 11 -5.338 -1.664 4.538 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.534 -3.622 6.894 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.130 -2.642 6.522 1.00 0.00 H new ATOM 0 HG SER A 11 -5.477 -1.671 8.136 1.00 0.00 H new ATOM 186 N ILE A 12 -3.666 -3.620 4.065 1.00 0.00 N ATOM 187 CA ILE A 12 -2.793 -4.556 3.374 1.00 0.00 C ATOM 188 C ILE A 12 -1.554 -4.701 4.252 1.00 0.00 C ATOM 189 O ILE A 12 -1.299 -3.847 5.099 1.00 0.00 O ATOM 190 CB ILE A 12 -2.428 -4.001 1.984 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.656 -3.801 1.084 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.430 -4.904 1.251 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.349 -5.116 0.720 1.00 0.00 C ATOM 0 H ILE A 12 -3.153 -2.826 4.448 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.271 -5.523 3.216 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.971 -3.030 2.176 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.368 -3.149 1.590 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.351 -3.292 0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.200 -4.476 0.275 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.514 -4.985 1.837 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.865 -5.895 1.119 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.209 -4.910 0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.650 -5.761 0.188 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.683 -5.615 1.630 1.00 0.00 H new ATOM 205 N ASN A 13 -0.773 -5.764 4.069 1.00 0.00 N ATOM 206 CA ASN A 13 0.374 -6.030 4.918 1.00 0.00 C ATOM 207 C ASN A 13 1.597 -6.351 4.072 1.00 0.00 C ATOM 208 O ASN A 13 1.469 -6.918 2.990 1.00 0.00 O ATOM 209 CB ASN A 13 0.030 -7.193 5.845 1.00 0.00 C ATOM 210 CG ASN A 13 -0.894 -6.763 6.968 1.00 0.00 C ATOM 211 OD1 ASN A 13 -2.113 -6.732 6.812 1.00 0.00 O ATOM 212 ND2 ASN A 13 -0.317 -6.426 8.116 1.00 0.00 N ATOM 0 H ASN A 13 -0.920 -6.456 3.334 1.00 0.00 H new ATOM 0 HA ASN A 13 0.610 -5.148 5.514 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.443 -7.989 5.270 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.947 -7.606 6.266 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -0.889 -6.129 8.906 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.698 -6.465 8.207 1.00 0.00 H new ATOM 219 N ILE A 14 2.773 -5.980 4.582 1.00 0.00 N ATOM 220 CA ILE A 14 4.040 -6.119 3.877 1.00 0.00 C ATOM 221 C ILE A 14 5.128 -6.586 4.844 1.00 0.00 C ATOM 222 O ILE A 14 5.102 -6.248 6.030 1.00 0.00 O ATOM 223 CB ILE A 14 4.449 -4.764 3.270 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.347 -4.112 2.419 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.720 -4.918 2.432 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.073 -4.854 1.116 1.00 0.00 C ATOM 0 H ILE A 14 2.869 -5.569 5.511 1.00 0.00 H new ATOM 0 HA ILE A 14 3.922 -6.856 3.082 1.00 0.00 H new ATOM 0 HB ILE A 14 4.630 -4.099 4.115 1.00 0.00 H new ATOM 0 HG12 ILE A 14 2.427 -4.065 3.002 1.00 0.00 H new ATOM 0 HG13 ILE A 14 3.633 -3.085 2.191 1.00 0.00 H new ATOM 0 HG21 ILE A 14 5.997 -3.952 2.010 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.530 -5.283 3.063 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.540 -5.629 1.625 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.285 -4.341 0.564 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.981 -4.879 0.514 1.00 0.00 H new ATOM 0 HD13 ILE A 14 2.756 -5.873 1.337 1.00 0.00 H new ATOM 238 N GLY A 15 6.082 -7.369 4.336 1.00 0.00 N ATOM 239 CA GLY A 15 7.205 -7.852 5.126 1.00 0.00 C ATOM 240 C GLY A 15 6.731 -8.551 6.392 1.00 0.00 C ATOM 241 O GLY A 15 5.814 -9.370 6.350 1.00 0.00 O ATOM 0 H GLY A 15 6.093 -7.683 3.366 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.802 -8.542 4.529 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.853 -7.016 5.390 1.00 0.00 H new ATOM 245 N ASP A 16 7.360 -8.221 7.518 1.00 0.00 N ATOM 246 CA ASP A 16 7.022 -8.786 8.817 1.00 0.00 C ATOM 247 C ASP A 16 6.843 -7.680 9.858 1.00 0.00 C ATOM 248 O ASP A 16 6.651 -7.964 11.039 1.00 0.00 O ATOM 249 CB ASP A 16 8.115 -9.769 9.241 1.00 0.00 C ATOM 250 CG ASP A 16 8.283 -10.904 8.229 1.00 0.00 C ATOM 251 OD1 ASP A 16 7.517 -11.887 8.341 1.00 0.00 O ATOM 252 OD2 ASP A 16 9.170 -10.779 7.359 1.00 0.00 O ATOM 0 H ASP A 16 8.125 -7.547 7.552 1.00 0.00 H new ATOM 0 HA ASP A 16 6.075 -9.321 8.742 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.060 -9.237 9.350 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.869 -10.186 10.218 1.00 0.00 H new ATOM 257 N ASP A 17 6.902 -6.412 9.428 1.00 0.00 N ATOM 258 CA ASP A 17 6.838 -5.268 10.323 1.00 0.00 C ATOM 259 C ASP A 17 6.130 -4.072 9.678 1.00 0.00 C ATOM 260 O ASP A 17 6.213 -2.963 10.207 1.00 0.00 O ATOM 261 CB ASP A 17 8.257 -4.860 10.734 1.00 0.00 C ATOM 262 CG ASP A 17 8.989 -5.965 11.491 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.740 -6.094 12.712 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.793 -6.674 10.843 1.00 0.00 O ATOM 0 H ASP A 17 6.996 -6.159 8.444 1.00 0.00 H new ATOM 0 HA ASP A 17 6.260 -5.564 11.198 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.827 -4.595 9.844 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.208 -3.968 11.358 1.00 0.00 H new ATOM 269 N ILE A 18 5.440 -4.268 8.546 1.00 0.00 N ATOM 270 CA ILE A 18 4.816 -3.161 7.831 1.00 0.00 C ATOM 271 C ILE A 18 3.355 -3.471 7.514 1.00 0.00 C ATOM 272 O ILE A 18 2.997 -4.612 7.219 1.00 0.00 O ATOM 273 CB ILE A 18 5.616 -2.883 6.548 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.074 -2.550 6.897 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.970 -1.744 5.752 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.933 -2.369 5.645 1.00 0.00 C ATOM 0 H ILE A 18 5.304 -5.181 8.112 1.00 0.00 H new ATOM 0 HA ILE A 18 4.826 -2.271 8.460 1.00 0.00 H new ATOM 0 HB ILE A 18 5.607 -3.778 5.925 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.105 -1.638 7.494 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.491 -3.348 7.512 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.548 -1.559 4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.951 -2.021 5.482 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.951 -0.840 6.361 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.957 -2.135 5.937 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.924 -3.289 5.061 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.532 -1.554 5.043 1.00 0.00 H new ATOM 288 N THR A 19 2.509 -2.437 7.575 1.00 0.00 N ATOM 289 CA THR A 19 1.091 -2.523 7.236 1.00 0.00 C ATOM 290 C THR A 19 0.682 -1.220 6.558 1.00 0.00 C ATOM 291 O THR A 19 1.290 -0.181 6.810 1.00 0.00 O ATOM 292 CB THR A 19 0.270 -2.767 8.511 1.00 0.00 C ATOM 293 OG1 THR A 19 0.760 -3.895 9.200 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.213 -2.994 8.218 1.00 0.00 C ATOM 0 H THR A 19 2.799 -1.503 7.866 1.00 0.00 H new ATOM 0 HA THR A 19 0.906 -3.354 6.556 1.00 0.00 H new ATOM 0 HB THR A 19 0.370 -1.867 9.118 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.229 -4.039 10.011 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.747 -3.161 9.153 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.623 -2.117 7.718 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.327 -3.866 7.574 1.00 0.00 H new ATOM 302 N ILE A 20 -0.343 -1.270 5.704 1.00 0.00 N ATOM 303 CA ILE A 20 -0.783 -0.135 4.897 1.00 0.00 C ATOM 304 C ILE A 20 -2.307 -0.048 4.964 1.00 0.00 C ATOM 305 O ILE A 20 -2.967 -1.075 5.112 1.00 0.00 O ATOM 306 CB ILE A 20 -0.326 -0.320 3.441 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.145 -0.744 3.326 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.549 0.977 2.660 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.135 0.327 3.771 1.00 0.00 C ATOM 0 H ILE A 20 -0.897 -2.113 5.553 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.346 0.786 5.282 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.926 -1.126 3.019 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.302 -1.641 3.925 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.356 -1.011 2.291 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.224 0.841 1.629 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.608 1.234 2.676 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.026 1.781 3.119 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.152 -0.049 3.660 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.008 1.218 3.156 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.954 0.579 4.816 1.00 0.00 H new ATOM 321 N THR A 21 -2.877 1.155 4.853 1.00 0.00 N ATOM 322 CA THR A 21 -4.315 1.352 5.005 1.00 0.00 C ATOM 323 C THR A 21 -4.847 2.375 4.004 1.00 0.00 C ATOM 324 O THR A 21 -4.120 3.269 3.574 1.00 0.00 O ATOM 325 CB THR A 21 -4.584 1.823 6.443 1.00 0.00 C ATOM 326 OG1 THR A 21 -4.090 0.864 7.350 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.069 2.025 6.733 1.00 0.00 C ATOM 0 H THR A 21 -2.357 2.011 4.657 1.00 0.00 H new ATOM 0 HA THR A 21 -4.831 0.412 4.808 1.00 0.00 H new ATOM 0 HB THR A 21 -4.081 2.783 6.558 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.650 0.061 7.314 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.197 2.358 7.763 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.473 2.778 6.056 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.599 1.084 6.587 1.00 0.00 H new ATOM 335 N ILE A 22 -6.125 2.236 3.636 1.00 0.00 N ATOM 336 CA ILE A 22 -6.815 3.152 2.737 1.00 0.00 C ATOM 337 C ILE A 22 -7.826 3.950 3.559 1.00 0.00 C ATOM 338 O ILE A 22 -8.936 3.494 3.829 1.00 0.00 O ATOM 339 CB ILE A 22 -7.434 2.382 1.554 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.345 3.261 0.690 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.227 1.156 2.006 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.577 4.425 0.071 1.00 0.00 C ATOM 0 H ILE A 22 -6.714 1.470 3.963 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.124 3.862 2.283 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.582 2.058 0.956 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.792 2.657 -0.100 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.164 3.646 1.298 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.642 0.649 1.135 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.568 0.474 2.543 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.038 1.469 2.664 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.254 5.027 -0.535 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.152 5.043 0.862 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.775 4.038 -0.557 1.00 0.00 H new ATOM 354 N LEU A 23 -7.430 5.164 3.957 1.00 0.00 N ATOM 355 CA LEU A 23 -8.224 5.999 4.844 1.00 0.00 C ATOM 356 C LEU A 23 -9.443 6.575 4.132 1.00 0.00 C ATOM 357 O LEU A 23 -10.443 6.879 4.779 1.00 0.00 O ATOM 358 CB LEU A 23 -7.360 7.147 5.358 1.00 0.00 C ATOM 359 CG LEU A 23 -6.065 6.657 6.012 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.276 7.872 6.475 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.333 5.749 7.209 1.00 0.00 C ATOM 0 H LEU A 23 -6.549 5.589 3.669 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.573 5.379 5.670 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.116 7.813 4.530 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.930 7.732 6.080 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.507 6.076 5.278 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.348 7.546 6.945 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.046 8.505 5.618 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.868 8.437 7.195 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.385 5.426 7.640 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.906 6.295 7.959 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.900 4.876 6.884 1.00 0.00 H new ATOM 373 N GLY A 24 -9.366 6.727 2.804 1.00 0.00 N ATOM 374 CA GLY A 24 -10.493 7.214 2.030 1.00 0.00 C ATOM 375 C GLY A 24 -10.093 7.655 0.628 1.00 0.00 C ATOM 376 O GLY A 24 -8.956 7.456 0.198 1.00 0.00 O ATOM 0 H GLY A 24 -8.534 6.518 2.253 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.247 6.430 1.959 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.953 8.052 2.553 1.00 0.00 H new ATOM 380 N VAL A 25 -11.047 8.261 -0.083 1.00 0.00 N ATOM 381 CA VAL A 25 -10.842 8.736 -1.443 1.00 0.00 C ATOM 382 C VAL A 25 -11.373 10.161 -1.575 1.00 0.00 C ATOM 383 O VAL A 25 -12.165 10.617 -0.748 1.00 0.00 O ATOM 384 CB VAL A 25 -11.546 7.813 -2.447 1.00 0.00 C ATOM 385 CG1 VAL A 25 -11.002 6.387 -2.357 1.00 0.00 C ATOM 386 CG2 VAL A 25 -13.058 7.778 -2.207 1.00 0.00 C ATOM 0 H VAL A 25 -11.986 8.434 0.275 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.774 8.730 -1.662 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.349 8.217 -3.440 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.518 5.754 -3.079 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -9.934 6.390 -2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.165 5.998 -1.352 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.527 7.115 -2.935 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -13.258 7.411 -1.200 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.467 8.783 -2.315 1.00 0.00 H new ATOM 396 N SER A 26 -10.929 10.860 -2.618 1.00 0.00 N ATOM 397 CA SER A 26 -11.291 12.244 -2.881 1.00 0.00 C ATOM 398 C SER A 26 -11.321 12.456 -4.391 1.00 0.00 C ATOM 399 O SER A 26 -10.610 13.307 -4.928 1.00 0.00 O ATOM 400 CB SER A 26 -10.272 13.176 -2.215 1.00 0.00 C ATOM 401 OG SER A 26 -10.373 13.104 -0.811 1.00 0.00 O ATOM 0 H SER A 26 -10.295 10.469 -3.315 1.00 0.00 H new ATOM 0 HA SER A 26 -12.275 12.469 -2.469 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.264 12.902 -2.526 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.440 14.201 -2.544 1.00 0.00 H new ATOM 0 HG SER A 26 -9.714 13.704 -0.404 1.00 0.00 H new ATOM 407 N GLY A 27 -12.158 11.674 -5.079 1.00 0.00 N ATOM 408 CA GLY A 27 -12.227 11.714 -6.532 1.00 0.00 C ATOM 409 C GLY A 27 -10.998 11.032 -7.111 1.00 0.00 C ATOM 410 O GLY A 27 -10.668 9.909 -6.729 1.00 0.00 O ATOM 0 H GLY A 27 -12.796 11.006 -4.647 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.132 11.215 -6.879 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.281 12.747 -6.877 1.00 0.00 H new ATOM 414 N GLN A 28 -10.311 11.710 -8.034 1.00 0.00 N ATOM 415 CA GLN A 28 -9.076 11.215 -8.619 1.00 0.00 C ATOM 416 C GLN A 28 -7.938 11.238 -7.588 1.00 0.00 C ATOM 417 O GLN A 28 -6.861 10.709 -7.858 1.00 0.00 O ATOM 418 CB GLN A 28 -8.748 12.059 -9.854 1.00 0.00 C ATOM 419 CG GLN A 28 -7.520 11.542 -10.605 1.00 0.00 C ATOM 420 CD GLN A 28 -7.369 12.226 -11.957 1.00 0.00 C ATOM 421 OE1 GLN A 28 -7.507 11.591 -12.999 1.00 0.00 O ATOM 422 NE2 GLN A 28 -7.087 13.526 -11.964 1.00 0.00 N ATOM 0 H GLN A 28 -10.602 12.619 -8.393 1.00 0.00 H new ATOM 0 HA GLN A 28 -9.197 10.176 -8.925 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.606 12.063 -10.526 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.576 13.092 -9.550 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.626 11.714 -10.006 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.605 10.465 -10.748 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -6.978 14.029 -11.083 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -6.980 14.020 -12.850 1.00 0.00 H new ATOM 431 N GLN A 29 -8.165 11.840 -6.413 1.00 0.00 N ATOM 432 CA GLN A 29 -7.167 11.843 -5.354 1.00 0.00 C ATOM 433 C GLN A 29 -7.485 10.737 -4.349 1.00 0.00 C ATOM 434 O GLN A 29 -8.602 10.217 -4.313 1.00 0.00 O ATOM 435 CB GLN A 29 -7.130 13.188 -4.625 1.00 0.00 C ATOM 436 CG GLN A 29 -6.873 14.372 -5.555 1.00 0.00 C ATOM 437 CD GLN A 29 -6.709 15.647 -4.743 1.00 0.00 C ATOM 438 OE1 GLN A 29 -7.642 16.432 -4.598 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.515 15.862 -4.198 1.00 0.00 N ATOM 0 H GLN A 29 -9.030 12.327 -6.180 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.192 11.671 -5.810 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.078 13.340 -4.108 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.352 13.159 -3.862 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.976 14.191 -6.148 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.701 14.481 -6.255 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.762 15.189 -4.339 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.353 16.700 -3.639 1.00 0.00 H new ATOM 448 N VAL A 30 -6.494 10.380 -3.529 1.00 0.00 N ATOM 449 CA VAL A 30 -6.579 9.263 -2.596 1.00 0.00 C ATOM 450 C VAL A 30 -5.835 9.592 -1.306 1.00 0.00 C ATOM 451 O VAL A 30 -4.808 10.270 -1.339 1.00 0.00 O ATOM 452 CB VAL A 30 -5.975 8.027 -3.275 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.882 6.843 -2.319 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.828 7.592 -4.469 1.00 0.00 C ATOM 0 H VAL A 30 -5.599 10.868 -3.497 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.619 9.068 -2.334 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.975 8.314 -3.600 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.449 5.989 -2.839 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.251 7.109 -1.471 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.879 6.584 -1.963 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.381 6.714 -4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.834 7.349 -4.128 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.877 8.403 -5.196 1.00 0.00 H new ATOM 464 N ARG A 31 -6.353 9.104 -0.172 1.00 0.00 N ATOM 465 CA ARG A 31 -5.768 9.297 1.150 1.00 0.00 C ATOM 466 C ARG A 31 -5.440 7.927 1.734 1.00 0.00 C ATOM 467 O ARG A 31 -6.330 7.112 1.959 1.00 0.00 O ATOM 468 CB ARG A 31 -6.766 10.044 2.046 1.00 0.00 C ATOM 469 CG ARG A 31 -6.336 11.485 2.330 1.00 0.00 C ATOM 470 CD ARG A 31 -5.204 11.542 3.364 1.00 0.00 C ATOM 471 NE ARG A 31 -4.784 12.926 3.623 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.483 13.810 4.346 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.632 13.477 4.928 1.00 0.00 N ATOM 474 NH2 ARG A 31 -5.033 15.053 4.500 1.00 0.00 N ATOM 0 H ARG A 31 -7.210 8.552 -0.154 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.856 9.890 1.084 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.746 10.048 1.568 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.874 9.508 2.989 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -6.008 11.957 1.404 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.191 12.056 2.693 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.535 11.081 4.294 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.353 10.963 3.006 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.898 13.235 3.224 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.999 12.530 4.828 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -7.146 14.168 5.474 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.154 15.334 4.067 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.568 15.724 5.051 1.00 0.00 H new ATOM 488 N ILE A 32 -4.151 7.686 1.972 1.00 0.00 N ATOM 489 CA ILE A 32 -3.642 6.395 2.422 1.00 0.00 C ATOM 490 C ILE A 32 -2.615 6.602 3.526 1.00 0.00 C ATOM 491 O ILE A 32 -2.031 7.680 3.644 1.00 0.00 O ATOM 492 CB ILE A 32 -3.010 5.639 1.249 1.00 0.00 C ATOM 493 CG1 ILE A 32 -2.140 6.584 0.406 1.00 0.00 C ATOM 494 CG2 ILE A 32 -4.108 5.000 0.400 1.00 0.00 C ATOM 495 CD1 ILE A 32 -1.409 5.837 -0.708 1.00 0.00 C ATOM 0 H ILE A 32 -3.424 8.392 1.856 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.470 5.804 2.813 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.365 4.850 1.636 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.766 7.364 -0.029 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.413 7.080 1.049 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.657 4.463 -0.434 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.682 4.304 1.012 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.769 5.777 0.016 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.805 6.540 -1.282 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.763 5.075 -0.272 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -2.137 5.363 -1.366 1.00 0.00 H new ATOM 507 N GLY A 33 -2.397 5.566 4.334 1.00 0.00 N ATOM 508 CA GLY A 33 -1.463 5.638 5.444 1.00 0.00 C ATOM 509 C GLY A 33 -0.558 4.416 5.485 1.00 0.00 C ATOM 510 O GLY A 33 -0.832 3.404 4.841 1.00 0.00 O ATOM 0 H GLY A 33 -2.861 4.663 4.235 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.857 6.539 5.354 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.014 5.717 6.381 1.00 0.00 H new ATOM 514 N ILE A 34 0.527 4.521 6.254 1.00 0.00 N ATOM 515 CA ILE A 34 1.540 3.489 6.363 1.00 0.00 C ATOM 516 C ILE A 34 1.862 3.285 7.841 1.00 0.00 C ATOM 517 O ILE A 34 1.889 4.237 8.624 1.00 0.00 O ATOM 518 CB ILE A 34 2.810 3.911 5.607 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.584 4.034 4.094 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.916 2.877 5.822 1.00 0.00 C ATOM 521 CD1 ILE A 34 2.128 5.433 3.680 1.00 0.00 C ATOM 0 H ILE A 34 0.723 5.343 6.825 1.00 0.00 H new ATOM 0 HA ILE A 34 1.171 2.561 5.926 1.00 0.00 H new ATOM 0 HB ILE A 34 3.091 4.887 6.003 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.508 3.787 3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.837 3.305 3.781 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.812 3.185 5.282 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.141 2.801 6.886 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.584 1.907 5.451 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.983 5.464 2.600 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.189 5.672 4.179 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.886 6.162 3.965 1.00 0.00 H new ATOM 533 N ASN A 35 2.107 2.028 8.210 1.00 0.00 N ATOM 534 CA ASN A 35 2.362 1.612 9.575 1.00 0.00 C ATOM 535 C ASN A 35 3.664 0.825 9.616 1.00 0.00 C ATOM 536 O ASN A 35 3.662 -0.403 9.725 1.00 0.00 O ATOM 537 CB ASN A 35 1.193 0.778 10.098 1.00 0.00 C ATOM 538 CG ASN A 35 -0.122 1.539 10.095 1.00 0.00 C ATOM 539 OD1 ASN A 35 -0.686 1.813 9.040 1.00 0.00 O ATOM 540 ND2 ASN A 35 -0.621 1.884 11.277 1.00 0.00 N ATOM 0 H ASN A 35 2.133 1.256 7.544 1.00 0.00 H new ATOM 0 HA ASN A 35 2.458 2.486 10.220 1.00 0.00 H new ATOM 0 HB2 ASN A 35 1.090 -0.118 9.486 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.414 0.448 11.113 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -1.502 2.395 11.329 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.123 1.638 12.132 1.00 0.00 H new ATOM 547 N ALA A 36 4.782 1.550 9.528 1.00 0.00 N ATOM 548 CA ALA A 36 6.117 0.979 9.621 1.00 0.00 C ATOM 549 C ALA A 36 6.912 1.758 10.659 1.00 0.00 C ATOM 550 O ALA A 36 6.601 2.919 10.928 1.00 0.00 O ATOM 551 CB ALA A 36 6.788 1.077 8.252 1.00 0.00 C ATOM 0 H ALA A 36 4.780 2.560 9.389 1.00 0.00 H new ATOM 0 HA ALA A 36 6.069 -0.068 9.921 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.790 0.652 8.307 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.200 0.526 7.518 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.853 2.123 7.953 1.00 0.00 H new ATOM 557 N PRO A 37 7.942 1.142 11.252 1.00 0.00 N ATOM 558 CA PRO A 37 8.797 1.804 12.213 1.00 0.00 C ATOM 559 C PRO A 37 9.726 2.741 11.452 1.00 0.00 C ATOM 560 O PRO A 37 10.016 2.506 10.278 1.00 0.00 O ATOM 561 CB PRO A 37 9.575 0.678 12.885 1.00 0.00 C ATOM 562 CG PRO A 37 9.692 -0.369 11.780 1.00 0.00 C ATOM 563 CD PRO A 37 8.366 -0.227 11.036 1.00 0.00 C ATOM 0 HA PRO A 37 8.257 2.397 12.951 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.554 1.013 13.228 1.00 0.00 H new ATOM 0 HB3 PRO A 37 9.048 0.288 13.756 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.544 -0.175 11.128 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.822 -1.372 12.186 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.489 -0.436 9.973 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.626 -0.931 11.416 1.00 0.00 H new ATOM 571 N LYS A 38 10.204 3.805 12.100 1.00 0.00 N ATOM 572 CA LYS A 38 11.126 4.733 11.452 1.00 0.00 C ATOM 573 C LYS A 38 12.498 4.100 11.240 1.00 0.00 C ATOM 574 O LYS A 38 13.406 4.745 10.715 1.00 0.00 O ATOM 575 CB LYS A 38 11.158 6.059 12.208 1.00 0.00 C ATOM 576 CG LYS A 38 9.822 6.734 11.886 1.00 0.00 C ATOM 577 CD LYS A 38 9.711 8.171 12.387 1.00 0.00 C ATOM 578 CE LYS A 38 9.601 8.204 13.909 1.00 0.00 C ATOM 579 NZ LYS A 38 9.347 9.574 14.393 1.00 0.00 N ATOM 0 H LYS A 38 9.969 4.042 13.064 1.00 0.00 H new ATOM 0 HA LYS A 38 10.764 4.961 10.449 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.270 5.899 13.280 1.00 0.00 H new ATOM 0 HB3 LYS A 38 11.998 6.675 11.888 1.00 0.00 H new ATOM 0 HG2 LYS A 38 9.674 6.725 10.806 1.00 0.00 H new ATOM 0 HG3 LYS A 38 9.016 6.145 12.323 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.583 8.741 12.068 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.838 8.650 11.944 1.00 0.00 H new ATOM 0 HE2 LYS A 38 8.795 7.545 14.233 1.00 0.00 H new ATOM 0 HE3 LYS A 38 10.521 7.823 14.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.277 9.568 15.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.129 10.195 14.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.456 9.926 13.988 1.00 0.00 H new ATOM 593 N ASP A 39 12.643 2.837 11.646 1.00 0.00 N ATOM 594 CA ASP A 39 13.807 2.027 11.325 1.00 0.00 C ATOM 595 C ASP A 39 13.795 1.689 9.830 1.00 0.00 C ATOM 596 O ASP A 39 14.802 1.240 9.292 1.00 0.00 O ATOM 597 CB ASP A 39 13.804 0.759 12.173 1.00 0.00 C ATOM 598 CG ASP A 39 13.982 1.095 13.652 1.00 0.00 C ATOM 599 OD1 ASP A 39 15.146 1.300 14.061 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.951 1.143 14.359 1.00 0.00 O ATOM 0 H ASP A 39 11.948 2.349 12.211 1.00 0.00 H new ATOM 0 HA ASP A 39 14.718 2.583 11.548 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.867 0.221 12.028 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.606 0.096 11.847 1.00 0.00 H new ATOM 605 N VAL A 40 12.655 1.909 9.162 1.00 0.00 N ATOM 606 CA VAL A 40 12.536 1.798 7.719 1.00 0.00 C ATOM 607 C VAL A 40 11.860 3.055 7.177 1.00 0.00 C ATOM 608 O VAL A 40 10.977 3.632 7.809 1.00 0.00 O ATOM 609 CB VAL A 40 11.783 0.525 7.314 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.461 -0.706 7.916 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.324 0.550 7.760 1.00 0.00 C ATOM 0 H VAL A 40 11.784 2.172 9.623 1.00 0.00 H new ATOM 0 HA VAL A 40 13.531 1.717 7.281 1.00 0.00 H new ATOM 0 HB VAL A 40 11.808 0.478 6.225 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.916 -1.603 7.620 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.487 -0.769 7.554 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.464 -0.625 9.003 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.833 -0.373 7.450 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.277 0.639 8.845 1.00 0.00 H new ATOM 0 HG23 VAL A 40 9.819 1.401 7.303 1.00 0.00 H new ATOM 621 N ALA A 41 12.285 3.478 5.987 1.00 0.00 N ATOM 622 CA ALA A 41 11.832 4.724 5.394 1.00 0.00 C ATOM 623 C ALA A 41 10.514 4.558 4.642 1.00 0.00 C ATOM 624 O ALA A 41 10.201 3.479 4.149 1.00 0.00 O ATOM 625 CB ALA A 41 12.919 5.216 4.440 1.00 0.00 C ATOM 0 H ALA A 41 12.952 2.963 5.412 1.00 0.00 H new ATOM 0 HA ALA A 41 11.652 5.447 6.189 1.00 0.00 H new ATOM 0 HB1 ALA A 41 12.603 6.152 3.980 1.00 0.00 H new ATOM 0 HB2 ALA A 41 13.844 5.378 4.994 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.087 4.469 3.664 1.00 0.00 H new ATOM 631 N VAL A 42 9.749 5.647 4.563 1.00 0.00 N ATOM 632 CA VAL A 42 8.578 5.763 3.702 1.00 0.00 C ATOM 633 C VAL A 42 8.474 7.220 3.270 1.00 0.00 C ATOM 634 O VAL A 42 8.458 8.129 4.102 1.00 0.00 O ATOM 635 CB VAL A 42 7.289 5.267 4.378 1.00 0.00 C ATOM 636 CG1 VAL A 42 7.183 5.676 5.836 1.00 0.00 C ATOM 637 CG2 VAL A 42 6.048 5.823 3.682 1.00 0.00 C ATOM 0 H VAL A 42 9.932 6.489 5.108 1.00 0.00 H new ATOM 0 HA VAL A 42 8.699 5.117 2.832 1.00 0.00 H new ATOM 0 HB VAL A 42 7.339 4.181 4.304 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.251 5.295 6.254 1.00 0.00 H new ATOM 0 HG12 VAL A 42 8.025 5.264 6.392 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.196 6.763 5.911 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.153 5.454 4.184 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.064 6.912 3.724 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.039 5.500 2.641 1.00 0.00 H new ATOM 647 N HIS A 43 8.405 7.410 1.949 1.00 0.00 N ATOM 648 CA HIS A 43 8.353 8.715 1.298 1.00 0.00 C ATOM 649 C HIS A 43 7.547 8.641 0.004 1.00 0.00 C ATOM 650 O HIS A 43 7.248 7.552 -0.490 1.00 0.00 O ATOM 651 CB HIS A 43 9.764 9.182 0.938 1.00 0.00 C ATOM 652 CG HIS A 43 10.718 9.295 2.094 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.043 10.481 2.756 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.409 8.259 2.654 1.00 0.00 C ATOM 655 CE1 HIS A 43 11.920 10.126 3.712 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.154 8.802 3.676 1.00 0.00 N ATOM 0 H HIS A 43 8.383 6.635 1.287 1.00 0.00 H new ATOM 0 HA HIS A 43 7.883 9.411 1.993 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.183 8.489 0.209 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.694 10.154 0.450 1.00 0.00 H new ATOM 0 HD2 HIS A 43 11.377 7.222 2.355 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.374 10.811 4.413 1.00 0.00 H new ATOM 0 HE2 HIS A 43 12.777 8.288 4.299 1.00 0.00 H new ATOM 664 N ARG A 44 7.195 9.807 -0.547 1.00 0.00 N ATOM 665 CA ARG A 44 6.530 9.890 -1.843 1.00 0.00 C ATOM 666 C ARG A 44 7.532 9.549 -2.950 1.00 0.00 C ATOM 667 O ARG A 44 8.741 9.577 -2.723 1.00 0.00 O ATOM 668 CB ARG A 44 5.961 11.298 -2.022 1.00 0.00 C ATOM 669 CG ARG A 44 7.068 12.305 -2.341 1.00 0.00 C ATOM 670 CD ARG A 44 6.528 13.728 -2.364 1.00 0.00 C ATOM 671 NE ARG A 44 6.370 14.249 -1.007 1.00 0.00 N ATOM 672 CZ ARG A 44 6.484 15.541 -0.678 1.00 0.00 C ATOM 673 NH1 ARG A 44 6.688 16.467 -1.612 1.00 0.00 N ATOM 674 NH2 ARG A 44 6.395 15.910 0.593 1.00 0.00 N ATOM 0 H ARG A 44 7.363 10.712 -0.107 1.00 0.00 H new ATOM 0 HA ARG A 44 5.708 9.176 -1.897 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.225 11.296 -2.826 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.441 11.601 -1.114 1.00 0.00 H new ATOM 0 HG2 ARG A 44 7.861 12.226 -1.597 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.513 12.066 -3.307 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.206 14.369 -2.927 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.568 13.748 -2.880 1.00 0.00 H new ATOM 0 HE ARG A 44 6.159 13.584 -0.263 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.759 16.195 -2.593 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.773 17.448 -1.347 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.240 15.209 1.318 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.482 16.894 0.846 1.00 0.00 H new ATOM 688 N GLU A 45 7.047 9.224 -4.148 1.00 0.00 N ATOM 689 CA GLU A 45 7.932 8.820 -5.235 1.00 0.00 C ATOM 690 C GLU A 45 8.657 10.014 -5.865 1.00 0.00 C ATOM 691 O GLU A 45 9.689 9.829 -6.505 1.00 0.00 O ATOM 692 CB GLU A 45 7.156 7.990 -6.263 1.00 0.00 C ATOM 693 CG GLU A 45 6.239 8.810 -7.177 1.00 0.00 C ATOM 694 CD GLU A 45 6.963 9.268 -8.445 1.00 0.00 C ATOM 695 OE1 GLU A 45 7.368 8.378 -9.227 1.00 0.00 O ATOM 696 OE2 GLU A 45 7.107 10.496 -8.623 1.00 0.00 O ATOM 0 H GLU A 45 6.055 9.233 -4.387 1.00 0.00 H new ATOM 0 HA GLU A 45 8.718 8.188 -4.821 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.867 7.441 -6.880 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.555 7.250 -5.735 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.370 8.212 -7.451 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.869 9.680 -6.635 1.00 0.00 H new ATOM 703 N GLU A 46 8.132 11.231 -5.694 1.00 0.00 N ATOM 704 CA GLU A 46 8.760 12.446 -6.199 1.00 0.00 C ATOM 705 C GLU A 46 10.015 12.813 -5.410 1.00 0.00 C ATOM 706 O GLU A 46 10.771 13.687 -5.828 1.00 0.00 O ATOM 707 CB GLU A 46 7.803 13.636 -6.098 1.00 0.00 C ATOM 708 CG GLU A 46 6.469 13.437 -6.815 1.00 0.00 C ATOM 709 CD GLU A 46 5.372 12.971 -5.861 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.548 11.911 -5.227 1.00 0.00 O ATOM 711 OE2 GLU A 46 4.351 13.690 -5.773 1.00 0.00 O ATOM 0 H GLU A 46 7.256 11.397 -5.199 1.00 0.00 H new ATOM 0 HA GLU A 46 9.022 12.240 -7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 46 7.608 13.842 -5.045 1.00 0.00 H new ATOM 0 HB3 GLU A 46 8.295 14.518 -6.509 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.167 14.373 -7.286 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.592 12.704 -7.612 1.00 0.00 H new ATOM 718 N ILE A 47 10.240 12.155 -4.270 1.00 0.00 N ATOM 719 CA ILE A 47 11.322 12.505 -3.362 1.00 0.00 C ATOM 720 C ILE A 47 12.131 11.270 -2.973 1.00 0.00 C ATOM 721 O ILE A 47 13.270 11.407 -2.547 1.00 0.00 O ATOM 722 CB ILE A 47 10.720 13.234 -2.147 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.326 14.651 -2.574 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.658 13.282 -0.945 1.00 0.00 C ATOM 725 CD1 ILE A 47 9.973 15.538 -1.379 1.00 0.00 C ATOM 0 H ILE A 47 9.675 11.366 -3.956 1.00 0.00 H new ATOM 0 HA ILE A 47 12.027 13.177 -3.852 1.00 0.00 H new ATOM 0 HB ILE A 47 9.846 12.670 -1.820 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.148 15.103 -3.129 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.473 14.601 -3.251 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.171 13.809 -0.125 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.899 12.266 -0.631 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.574 13.804 -1.219 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.700 16.533 -1.732 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.133 15.102 -0.838 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.834 15.612 -0.714 1.00 0.00 H new ATOM 737 N TYR A 48 11.588 10.061 -3.110 1.00 0.00 N ATOM 738 CA TYR A 48 12.404 8.894 -2.826 1.00 0.00 C ATOM 739 C TYR A 48 13.591 8.857 -3.784 1.00 0.00 C ATOM 740 O TYR A 48 14.697 8.472 -3.403 1.00 0.00 O ATOM 741 CB TYR A 48 11.584 7.619 -2.988 1.00 0.00 C ATOM 742 CG TYR A 48 12.486 6.407 -3.000 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.271 6.108 -1.878 1.00 0.00 C ATOM 744 CD2 TYR A 48 12.551 5.598 -4.142 1.00 0.00 C ATOM 745 CE1 TYR A 48 14.128 5.002 -1.892 1.00 0.00 C ATOM 746 CE2 TYR A 48 13.413 4.491 -4.168 1.00 0.00 C ATOM 747 CZ TYR A 48 14.205 4.189 -3.041 1.00 0.00 C ATOM 748 OH TYR A 48 15.048 3.116 -3.057 1.00 0.00 O ATOM 0 H TYR A 48 10.629 9.872 -3.403 1.00 0.00 H new ATOM 0 HA TYR A 48 12.760 8.957 -1.798 1.00 0.00 H new ATOM 0 HB2 TYR A 48 10.865 7.536 -2.173 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.012 7.663 -3.915 1.00 0.00 H new ATOM 0 HD1 TYR A 48 13.214 6.734 -0.999 1.00 0.00 H new ATOM 0 HD2 TYR A 48 11.938 5.826 -5.002 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.729 4.772 -1.025 1.00 0.00 H new ATOM 0 HE2 TYR A 48 13.470 3.871 -5.050 1.00 0.00 H new ATOM 0 HH TYR A 48 14.981 2.660 -3.922 1.00 0.00 H new ATOM 758 N GLN A 49 13.352 9.265 -5.035 1.00 0.00 N ATOM 759 CA GLN A 49 14.365 9.226 -6.074 1.00 0.00 C ATOM 760 C GLN A 49 15.450 10.275 -5.829 1.00 0.00 C ATOM 761 O GLN A 49 16.538 10.163 -6.388 1.00 0.00 O ATOM 762 CB GLN A 49 13.697 9.462 -7.431 1.00 0.00 C ATOM 763 CG GLN A 49 12.574 8.450 -7.645 1.00 0.00 C ATOM 764 CD GLN A 49 11.944 8.588 -9.023 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.589 8.358 -10.042 1.00 0.00 O ATOM 766 NE2 GLN A 49 10.671 8.966 -9.064 1.00 0.00 N ATOM 0 H GLN A 49 12.451 9.629 -5.347 1.00 0.00 H new ATOM 0 HA GLN A 49 14.844 8.247 -6.062 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.298 10.475 -7.477 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.434 9.373 -8.229 1.00 0.00 H new ATOM 0 HG2 GLN A 49 12.967 7.440 -7.524 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.810 8.588 -6.880 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.165 9.149 -8.197 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.200 9.073 -9.962 1.00 0.00 H new ATOM 775 N ARG A 50 15.163 11.292 -5.005 1.00 0.00 N ATOM 776 CA ARG A 50 16.136 12.332 -4.691 1.00 0.00 C ATOM 777 C ARG A 50 16.877 12.011 -3.396 1.00 0.00 C ATOM 778 O ARG A 50 18.021 12.420 -3.226 1.00 0.00 O ATOM 779 CB ARG A 50 15.447 13.703 -4.653 1.00 0.00 C ATOM 780 CG ARG A 50 14.990 14.131 -3.254 1.00 0.00 C ATOM 781 CD ARG A 50 14.134 15.395 -3.324 1.00 0.00 C ATOM 782 NE ARG A 50 14.896 16.534 -3.846 1.00 0.00 N ATOM 783 CZ ARG A 50 14.385 17.754 -4.045 1.00 0.00 C ATOM 784 NH1 ARG A 50 13.110 18.008 -3.769 1.00 0.00 N ATOM 785 NH2 ARG A 50 15.151 18.728 -4.525 1.00 0.00 N ATOM 0 H ARG A 50 14.260 11.411 -4.546 1.00 0.00 H new ATOM 0 HA ARG A 50 16.890 12.368 -5.478 1.00 0.00 H new ATOM 0 HB2 ARG A 50 16.132 14.454 -5.046 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.582 13.682 -5.316 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.420 13.326 -2.791 1.00 0.00 H new ATOM 0 HG3 ARG A 50 15.860 14.310 -2.622 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.268 15.214 -3.960 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.755 15.634 -2.330 1.00 0.00 H new ATOM 0 HE ARG A 50 15.880 16.386 -4.072 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.511 17.269 -3.402 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.731 18.942 -3.925 1.00 0.00 H new ATOM 0 HH21 ARG A 50 16.131 18.546 -4.743 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.759 19.658 -4.676 1.00 0.00 H new ATOM 799 N ILE A 51 16.227 11.282 -2.482 1.00 0.00 N ATOM 800 CA ILE A 51 16.822 10.844 -1.227 1.00 0.00 C ATOM 801 C ILE A 51 17.922 9.830 -1.499 1.00 0.00 C ATOM 802 O ILE A 51 19.081 10.061 -1.165 1.00 0.00 O ATOM 803 CB ILE A 51 15.727 10.232 -0.345 1.00 0.00 C ATOM 804 CG1 ILE A 51 14.806 11.336 0.178 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.343 9.502 0.852 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.554 10.725 0.796 1.00 0.00 C ATOM 0 H ILE A 51 15.260 10.979 -2.600 1.00 0.00 H new ATOM 0 HA ILE A 51 17.266 11.695 -0.710 1.00 0.00 H new ATOM 0 HB ILE A 51 15.161 9.523 -0.949 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.331 11.937 0.920 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.529 12.006 -0.636 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.550 9.075 1.465 1.00 0.00 H new ATOM 0 HG22 ILE A 51 16.995 8.705 0.496 1.00 0.00 H new ATOM 0 HG23 ILE A 51 16.923 10.206 1.448 1.00 0.00 H new ATOM 0 HD11 ILE A 51 12.905 11.520 1.165 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.023 10.144 0.042 1.00 0.00 H new ATOM 0 HD13 ILE A 51 13.837 10.074 1.623 1.00 0.00 H new ATOM 818 N GLN A 52 17.566 8.699 -2.110 1.00 0.00 N ATOM 819 CA GLN A 52 18.506 7.615 -2.306 1.00 0.00 C ATOM 820 C GLN A 52 19.445 7.890 -3.477 1.00 0.00 C ATOM 821 O GLN A 52 20.172 7.002 -3.921 1.00 0.00 O ATOM 822 CB GLN A 52 17.743 6.285 -2.394 1.00 0.00 C ATOM 823 CG GLN A 52 17.234 5.916 -0.999 1.00 0.00 C ATOM 824 CD GLN A 52 18.348 5.991 0.042 1.00 0.00 C ATOM 825 OE1 GLN A 52 19.379 5.334 -0.086 1.00 0.00 O ATOM 826 NE2 GLN A 52 18.149 6.796 1.081 1.00 0.00 N ATOM 0 H GLN A 52 16.631 8.518 -2.475 1.00 0.00 H new ATOM 0 HA GLN A 52 19.169 7.537 -1.444 1.00 0.00 H new ATOM 0 HB2 GLN A 52 16.908 6.374 -3.089 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.395 5.500 -2.778 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.425 6.589 -0.716 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.819 4.908 -1.017 1.00 0.00 H new ATOM 0 HE21 GLN A 52 17.281 7.327 1.156 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.864 6.883 1.803 1.00 0.00 H new ATOM 835 N ALA A 53 19.432 9.131 -3.980 1.00 0.00 N ATOM 836 CA ALA A 53 20.370 9.566 -4.993 1.00 0.00 C ATOM 837 C ALA A 53 21.783 9.682 -4.411 1.00 0.00 C ATOM 838 O ALA A 53 22.758 9.676 -5.163 1.00 0.00 O ATOM 839 CB ALA A 53 19.925 10.913 -5.561 1.00 0.00 C ATOM 0 H ALA A 53 18.769 9.850 -3.690 1.00 0.00 H new ATOM 0 HA ALA A 53 20.389 8.825 -5.792 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.633 11.238 -6.323 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.935 10.811 -6.005 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.889 11.652 -4.760 1.00 0.00 H new ATOM 845 N GLY A 54 21.900 9.786 -3.082 1.00 0.00 N ATOM 846 CA GLY A 54 23.195 9.862 -2.415 1.00 0.00 C ATOM 847 C GLY A 54 23.189 10.790 -1.201 1.00 0.00 C ATOM 848 O GLY A 54 24.254 11.113 -0.681 1.00 0.00 O ATOM 0 H GLY A 54 21.103 9.819 -2.447 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.494 8.862 -2.100 1.00 0.00 H new ATOM 0 HA3 GLY A 54 23.944 10.209 -3.127 1.00 0.00 H new ATOM 852 N LEU A 55 22.009 11.219 -0.746 1.00 0.00 N ATOM 853 CA LEU A 55 21.857 12.182 0.337 1.00 0.00 C ATOM 854 C LEU A 55 20.739 11.765 1.291 1.00 0.00 C ATOM 855 O LEU A 55 20.232 10.650 1.207 1.00 0.00 O ATOM 856 CB LEU A 55 21.633 13.565 -0.282 1.00 0.00 C ATOM 857 CG LEU A 55 20.458 13.614 -1.264 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.112 13.576 -0.545 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.545 14.914 -2.055 1.00 0.00 C ATOM 0 H LEU A 55 21.120 10.899 -1.129 1.00 0.00 H new ATOM 0 HA LEU A 55 22.760 12.218 0.947 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.459 14.287 0.516 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.541 13.874 -0.799 1.00 0.00 H new ATOM 0 HG LEU A 55 20.521 12.741 -1.914 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.307 13.613 -1.278 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.034 12.655 0.033 1.00 0.00 H new ATOM 0 HD13 LEU A 55 19.033 14.433 0.124 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.716 14.967 -2.760 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.494 15.761 -1.370 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.488 14.945 -2.601 1.00 0.00 H new ATOM 871 N THR A 56 20.346 12.658 2.207 1.00 0.00 N ATOM 872 CA THR A 56 19.273 12.395 3.157 1.00 0.00 C ATOM 873 C THR A 56 18.405 13.641 3.349 1.00 0.00 C ATOM 874 O THR A 56 18.718 14.709 2.824 1.00 0.00 O ATOM 875 CB THR A 56 19.866 11.931 4.493 1.00 0.00 C ATOM 876 OG1 THR A 56 20.749 12.911 4.994 1.00 0.00 O ATOM 877 CG2 THR A 56 20.619 10.611 4.316 1.00 0.00 C ATOM 0 H THR A 56 20.767 13.582 2.306 1.00 0.00 H new ATOM 0 HA THR A 56 18.637 11.603 2.763 1.00 0.00 H new ATOM 0 HB THR A 56 19.049 11.781 5.199 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.123 12.609 5.848 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.033 10.297 5.274 1.00 0.00 H new ATOM 0 HG22 THR A 56 19.933 9.847 3.949 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.428 10.747 3.598 1.00 0.00 H new ATOM 885 N ALA A 57 17.315 13.494 4.107 1.00 0.00 N ATOM 886 CA ALA A 57 16.361 14.561 4.367 1.00 0.00 C ATOM 887 C ALA A 57 17.040 15.816 4.928 1.00 0.00 C ATOM 888 O ALA A 57 18.098 15.721 5.559 1.00 0.00 O ATOM 889 CB ALA A 57 15.318 14.047 5.358 1.00 0.00 C ATOM 0 H ALA A 57 17.072 12.614 4.562 1.00 0.00 H new ATOM 0 HA ALA A 57 15.892 14.844 3.425 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.594 14.835 5.565 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.805 13.185 4.932 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.810 13.754 6.285 1.00 0.00 H new ATOM 895 N PRO A 58 16.441 16.993 4.705 1.00 0.00 N ATOM 896 CA PRO A 58 16.945 18.266 5.194 1.00 0.00 C ATOM 897 C PRO A 58 16.820 18.401 6.707 1.00 0.00 C ATOM 898 O PRO A 58 16.405 17.475 7.409 1.00 0.00 O ATOM 899 CB PRO A 58 16.124 19.336 4.480 1.00 0.00 C ATOM 900 CG PRO A 58 14.806 18.626 4.161 1.00 0.00 C ATOM 901 CD PRO A 58 15.218 17.174 3.946 1.00 0.00 C ATOM 0 HA PRO A 58 18.011 18.361 4.986 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.966 20.209 5.113 1.00 0.00 H new ATOM 0 HB3 PRO A 58 16.621 19.685 3.575 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.092 18.722 4.979 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.332 19.043 3.273 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.440 16.492 4.290 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.380 16.966 2.888 1.00 0.00 H new ATOM 909 N ASP A 59 17.189 19.582 7.204 1.00 0.00 N ATOM 910 CA ASP A 59 17.266 19.874 8.622 1.00 0.00 C ATOM 911 C ASP A 59 16.937 21.349 8.871 1.00 0.00 C ATOM 912 O ASP A 59 16.913 22.149 7.938 1.00 0.00 O ATOM 913 CB ASP A 59 18.695 19.547 9.063 1.00 0.00 C ATOM 914 CG ASP A 59 18.948 19.911 10.524 1.00 0.00 C ATOM 915 OD1 ASP A 59 18.552 19.104 11.395 1.00 0.00 O ATOM 916 OD2 ASP A 59 19.535 20.990 10.759 1.00 0.00 O ATOM 0 H ASP A 59 17.446 20.373 6.614 1.00 0.00 H new ATOM 0 HA ASP A 59 16.548 19.283 9.191 1.00 0.00 H new ATOM 0 HB2 ASP A 59 18.883 18.483 8.918 1.00 0.00 H new ATOM 0 HB3 ASP A 59 19.400 20.085 8.429 1.00 0.00 H new ATOM 1635 N MET C 1 1.565 7.007 12.771 1.00 0.00 N ATOM 1636 CA MET C 1 1.211 6.513 11.429 1.00 0.00 C ATOM 1637 C MET C 1 1.434 7.608 10.396 1.00 0.00 C ATOM 1638 O MET C 1 0.946 8.717 10.581 1.00 0.00 O ATOM 1639 CB MET C 1 -0.247 6.052 11.416 1.00 0.00 C ATOM 1640 CG MET C 1 -0.515 5.141 10.217 1.00 0.00 C ATOM 1641 SD MET C 1 -2.198 4.469 10.141 1.00 0.00 S ATOM 1642 CE MET C 1 -3.087 5.964 9.652 1.00 0.00 C ATOM 0 H1 MET C 1 1.410 6.253 13.471 1.00 0.00 H new ATOM 0 H2 MET C 1 2.565 7.291 12.784 1.00 0.00 H new ATOM 0 H3 MET C 1 0.970 7.826 13.007 1.00 0.00 H new ATOM 0 HA MET C 1 1.848 5.665 11.177 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.474 5.521 12.340 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.907 6.918 11.376 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.319 5.700 9.302 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.192 4.312 10.242 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.137 5.725 9.486 1.00 0.00 H new ATOM 0 HE2 MET C 1 -3.005 6.711 10.442 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.656 6.359 8.732 1.00 0.00 H new ATOM 1654 N LEU C 2 2.162 7.320 9.315 1.00 0.00 N ATOM 1655 CA LEU C 2 2.385 8.306 8.264 1.00 0.00 C ATOM 1656 C LEU C 2 1.195 8.273 7.308 1.00 0.00 C ATOM 1657 O LEU C 2 0.729 7.191 6.954 1.00 0.00 O ATOM 1658 CB LEU C 2 3.682 7.966 7.510 1.00 0.00 C ATOM 1659 CG LEU C 2 4.396 9.157 6.838 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.187 8.661 5.638 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.490 10.277 6.351 1.00 0.00 C ATOM 0 H LEU C 2 2.604 6.416 9.148 1.00 0.00 H new ATOM 0 HA LEU C 2 2.482 9.303 8.693 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.375 7.498 8.209 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.452 7.225 6.745 1.00 0.00 H new ATOM 0 HG LEU C 2 5.023 9.579 7.623 1.00 0.00 H new ATOM 0 HD11 LEU C 2 5.692 9.502 5.162 1.00 0.00 H new ATOM 0 HD12 LEU C 2 5.927 7.932 5.967 1.00 0.00 H new ATOM 0 HD13 LEU C 2 4.509 8.193 4.924 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.094 11.062 5.896 1.00 0.00 H new ATOM 0 HD22 LEU C 2 2.790 9.884 5.613 1.00 0.00 H new ATOM 0 HD23 LEU C 2 2.935 10.689 7.194 1.00 0.00 H new ATOM 1673 N ILE C 3 0.705 9.440 6.890 1.00 0.00 N ATOM 1674 CA ILE C 3 -0.346 9.556 5.893 1.00 0.00 C ATOM 1675 C ILE C 3 0.210 10.357 4.732 1.00 0.00 C ATOM 1676 O ILE C 3 0.908 11.349 4.931 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.597 10.251 6.466 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.379 9.323 7.396 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.552 10.649 5.338 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.748 9.219 8.780 1.00 0.00 C ATOM 0 H ILE C 3 1.034 10.339 7.242 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.654 8.561 5.570 1.00 0.00 H new ATOM 0 HB ILE C 3 -1.243 11.124 7.014 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.402 9.688 7.493 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.436 8.330 6.950 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.430 11.138 5.760 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -2.046 11.334 4.658 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.861 9.758 4.792 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.342 8.548 9.401 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.735 8.828 8.689 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.716 10.207 9.240 1.00 0.00 H new ATOM 1692 N LEU C 4 -0.105 9.920 3.514 1.00 0.00 N ATOM 1693 CA LEU C 4 0.321 10.601 2.308 1.00 0.00 C ATOM 1694 C LEU C 4 -0.882 10.684 1.376 1.00 0.00 C ATOM 1695 O LEU C 4 -1.868 9.962 1.547 1.00 0.00 O ATOM 1696 CB LEU C 4 1.487 9.846 1.649 1.00 0.00 C ATOM 1697 CG LEU C 4 2.791 9.822 2.467 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.868 9.098 1.665 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.307 11.236 2.728 1.00 0.00 C ATOM 0 H LEU C 4 -0.663 9.083 3.343 1.00 0.00 H new ATOM 0 HA LEU C 4 0.681 11.604 2.538 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.175 8.819 1.461 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.692 10.300 0.679 1.00 0.00 H new ATOM 0 HG LEU C 4 2.581 9.324 3.413 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.795 9.077 2.238 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.545 8.078 1.460 1.00 0.00 H new ATOM 0 HD13 LEU C 4 4.035 9.622 0.724 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.229 11.186 3.308 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.503 11.733 1.778 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.558 11.799 3.285 1.00 0.00 H new ATOM 1711 N THR C 5 -0.801 11.566 0.383 1.00 0.00 N ATOM 1712 CA THR C 5 -1.876 11.773 -0.572 1.00 0.00 C ATOM 1713 C THR C 5 -1.327 11.501 -1.961 1.00 0.00 C ATOM 1714 O THR C 5 -0.192 11.858 -2.280 1.00 0.00 O ATOM 1715 CB THR C 5 -2.428 13.191 -0.437 1.00 0.00 C ATOM 1716 OG1 THR C 5 -3.002 13.331 0.843 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.504 13.509 -1.476 1.00 0.00 C ATOM 0 H THR C 5 0.015 12.156 0.221 1.00 0.00 H new ATOM 0 HA THR C 5 -2.706 11.093 -0.382 1.00 0.00 H new ATOM 0 HB THR C 5 -1.597 13.879 -0.592 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.359 14.238 0.944 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.859 14.529 -1.331 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.084 13.409 -2.477 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.337 12.815 -1.361 1.00 0.00 H new ATOM 1725 N ARG C 6 -2.155 10.860 -2.790 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.743 10.364 -4.091 1.00 0.00 C ATOM 1727 C ARG C 6 -2.902 10.505 -5.069 1.00 0.00 C ATOM 1728 O ARG C 6 -4.007 10.857 -4.658 1.00 0.00 O ATOM 1729 CB ARG C 6 -1.343 8.895 -3.897 1.00 0.00 C ATOM 1730 CG ARG C 6 -0.497 8.289 -5.023 1.00 0.00 C ATOM 1731 CD ARG C 6 0.936 8.819 -5.022 1.00 0.00 C ATOM 1732 NE ARG C 6 1.028 10.179 -5.553 1.00 0.00 N ATOM 1733 CZ ARG C 6 2.122 10.938 -5.494 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.249 10.470 -4.968 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.083 12.176 -5.971 1.00 0.00 N ATOM 0 H ARG C 6 -3.133 10.673 -2.570 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.902 10.925 -4.499 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -0.789 8.807 -2.962 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -2.250 8.301 -3.787 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -0.481 7.204 -4.918 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -0.963 8.510 -5.983 1.00 0.00 H new ATOM 0 HD2 ARG C 6 1.326 8.802 -4.004 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.566 8.157 -5.616 1.00 0.00 H new ATOM 0 HE ARG C 6 0.199 10.573 -5.998 1.00 0.00 H new ATOM 0 HH11 ARG C 6 3.285 9.518 -4.603 1.00 0.00 H new ATOM 0 HH12 ARG C 6 4.078 11.062 -4.930 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.221 12.539 -6.378 1.00 0.00 H new ATOM 0 HH22 ARG C 6 2.915 12.765 -5.930 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.665 10.237 -6.353 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.718 10.263 -7.360 1.00 0.00 C ATOM 1751 C LYS C 7 -3.544 9.088 -8.312 1.00 0.00 C ATOM 1752 O LYS C 7 -2.453 8.532 -8.424 1.00 0.00 O ATOM 1753 CB LYS C 7 -3.684 11.576 -8.142 1.00 0.00 C ATOM 1754 CG LYS C 7 -3.586 12.807 -7.242 1.00 0.00 C ATOM 1755 CD LYS C 7 -3.863 14.047 -8.087 1.00 0.00 C ATOM 1756 CE LYS C 7 -3.654 15.324 -7.274 1.00 0.00 C ATOM 1757 NZ LYS C 7 -3.969 16.517 -8.080 1.00 0.00 N ATOM 0 H LYS C 7 -1.744 9.998 -6.719 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.683 10.185 -6.859 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.834 11.564 -8.824 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -4.583 11.651 -8.754 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -4.304 12.737 -6.425 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -2.595 12.869 -6.791 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -3.205 14.053 -8.956 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -4.886 14.014 -8.462 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -4.286 15.302 -6.386 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -2.621 15.375 -6.929 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -3.820 17.372 -7.507 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -3.348 16.546 -8.914 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -4.961 16.476 -8.388 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.625 8.718 -8.995 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.620 7.602 -9.928 1.00 0.00 C ATOM 1773 C VAL C 8 -3.475 7.762 -10.930 1.00 0.00 C ATOM 1774 O VAL C 8 -3.458 8.723 -11.696 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.965 7.545 -10.655 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.944 6.440 -11.710 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -7.078 7.264 -9.643 1.00 0.00 C ATOM 0 H VAL C 8 -5.528 9.186 -8.915 1.00 0.00 H new ATOM 0 HA VAL C 8 -4.470 6.670 -9.382 1.00 0.00 H new ATOM 0 HB VAL C 8 -6.147 8.501 -11.145 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.906 6.407 -12.222 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -5.154 6.643 -12.434 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.757 5.480 -11.228 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -8.037 7.223 -10.159 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.890 6.310 -9.151 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -7.101 8.059 -8.897 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.521 6.826 -10.917 1.00 0.00 N ATOM 1788 CA GLY C 9 -1.413 6.831 -11.869 1.00 0.00 C ATOM 1789 C GLY C 9 -0.087 7.243 -11.237 1.00 0.00 C ATOM 1790 O GLY C 9 0.888 7.458 -11.955 1.00 0.00 O ATOM 0 H GLY C 9 -2.497 6.052 -10.253 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -1.309 5.836 -12.303 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -1.647 7.513 -12.687 1.00 0.00 H new ATOM 1794 N GLU C 10 -0.037 7.355 -9.906 1.00 0.00 N ATOM 1795 CA GLU C 10 1.171 7.763 -9.198 1.00 0.00 C ATOM 1796 C GLU C 10 1.583 6.680 -8.197 1.00 0.00 C ATOM 1797 O GLU C 10 0.912 5.655 -8.073 1.00 0.00 O ATOM 1798 CB GLU C 10 0.924 9.094 -8.487 1.00 0.00 C ATOM 1799 CG GLU C 10 0.503 10.198 -9.456 1.00 0.00 C ATOM 1800 CD GLU C 10 0.294 11.522 -8.720 1.00 0.00 C ATOM 1801 OE1 GLU C 10 -0.272 11.486 -7.602 1.00 0.00 O ATOM 1802 OE2 GLU C 10 0.704 12.562 -9.280 1.00 0.00 O ATOM 0 H GLU C 10 -0.831 7.165 -9.295 1.00 0.00 H new ATOM 0 HA GLU C 10 1.984 7.894 -9.912 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.150 8.962 -7.731 1.00 0.00 H new ATOM 0 HB3 GLU C 10 1.831 9.398 -7.964 1.00 0.00 H new ATOM 0 HG2 GLU C 10 1.265 10.322 -10.225 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -0.418 9.910 -9.963 1.00 0.00 H new ATOM 1809 N SER C 11 2.691 6.896 -7.478 1.00 0.00 N ATOM 1810 CA SER C 11 3.272 5.877 -6.616 1.00 0.00 C ATOM 1811 C SER C 11 3.809 6.439 -5.300 1.00 0.00 C ATOM 1812 O SER C 11 3.905 7.653 -5.110 1.00 0.00 O ATOM 1813 CB SER C 11 4.413 5.179 -7.360 1.00 0.00 C ATOM 1814 OG SER C 11 3.916 4.546 -8.522 1.00 0.00 O ATOM 0 H SER C 11 3.202 7.779 -7.481 1.00 0.00 H new ATOM 0 HA SER C 11 2.474 5.177 -6.368 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.179 5.905 -7.631 1.00 0.00 H new ATOM 0 HB3 SER C 11 4.886 4.444 -6.709 1.00 0.00 H new ATOM 0 HG SER C 11 4.652 4.103 -8.993 1.00 0.00 H new ATOM 1820 N ILE C 12 4.153 5.525 -4.390 1.00 0.00 N ATOM 1821 CA ILE C 12 4.726 5.784 -3.074 1.00 0.00 C ATOM 1822 C ILE C 12 5.848 4.764 -2.879 1.00 0.00 C ATOM 1823 O ILE C 12 5.894 3.761 -3.589 1.00 0.00 O ATOM 1824 CB ILE C 12 3.633 5.621 -2.003 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.513 6.660 -2.165 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.201 5.707 -0.582 1.00 0.00 C ATOM 1827 CD1 ILE C 12 2.991 8.097 -1.946 1.00 0.00 C ATOM 0 H ILE C 12 4.031 4.528 -4.565 1.00 0.00 H new ATOM 0 HA ILE C 12 5.119 6.797 -2.990 1.00 0.00 H new ATOM 0 HB ILE C 12 3.215 4.625 -2.152 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.087 6.573 -3.165 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.714 6.437 -1.458 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.394 5.587 0.140 1.00 0.00 H new ATOM 0 HG22 ILE C 12 4.939 4.918 -0.437 1.00 0.00 H new ATOM 0 HG23 ILE C 12 4.675 6.678 -0.438 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.153 8.783 -2.074 1.00 0.00 H new ATOM 0 HD12 ILE C 12 3.391 8.198 -0.937 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.770 8.336 -2.670 1.00 0.00 H new ATOM 1839 N ASN C 13 6.760 4.987 -1.928 1.00 0.00 N ATOM 1840 CA ASN C 13 7.898 4.101 -1.752 1.00 0.00 C ATOM 1841 C ASN C 13 8.170 3.816 -0.273 1.00 0.00 C ATOM 1842 O ASN C 13 7.862 4.635 0.593 1.00 0.00 O ATOM 1843 CB ASN C 13 9.112 4.744 -2.422 1.00 0.00 C ATOM 1844 CG ASN C 13 10.285 3.780 -2.501 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.078 3.680 -1.569 1.00 0.00 O ATOM 1846 ND2 ASN C 13 10.397 3.070 -3.616 1.00 0.00 N ATOM 0 H ASN C 13 6.727 5.770 -1.275 1.00 0.00 H new ATOM 0 HA ASN C 13 7.683 3.138 -2.216 1.00 0.00 H new ATOM 0 HB2 ASN C 13 8.842 5.073 -3.426 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.408 5.633 -1.864 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.166 2.408 -3.724 1.00 0.00 H new ATOM 0 HD22 ASN C 13 9.714 3.186 -4.365 1.00 0.00 H new ATOM 1853 N ILE C 14 8.752 2.645 -0.001 1.00 0.00 N ATOM 1854 CA ILE C 14 9.074 2.194 1.343 1.00 0.00 C ATOM 1855 C ILE C 14 10.409 1.448 1.316 1.00 0.00 C ATOM 1856 O ILE C 14 10.750 0.805 0.322 1.00 0.00 O ATOM 1857 CB ILE C 14 7.957 1.282 1.878 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.591 1.981 1.785 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.243 0.891 3.331 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.444 1.110 2.304 1.00 0.00 C ATOM 0 H ILE C 14 9.015 1.977 -0.726 1.00 0.00 H new ATOM 0 HA ILE C 14 9.158 3.055 2.007 1.00 0.00 H new ATOM 0 HB ILE C 14 7.929 0.382 1.264 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.623 2.909 2.355 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.396 2.251 0.747 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.445 0.245 3.698 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.193 0.360 3.384 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.295 1.789 3.946 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.504 1.655 2.214 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.390 0.193 1.718 1.00 0.00 H new ATOM 0 HD13 ILE C 14 5.621 0.862 3.351 1.00 0.00 H new ATOM 1872 N GLY C 15 11.168 1.535 2.412 1.00 0.00 N ATOM 1873 CA GLY C 15 12.461 0.882 2.514 1.00 0.00 C ATOM 1874 C GLY C 15 13.380 1.315 1.374 1.00 0.00 C ATOM 1875 O GLY C 15 13.444 2.495 1.033 1.00 0.00 O ATOM 0 H GLY C 15 10.899 2.059 3.245 1.00 0.00 H new ATOM 0 HA2 GLY C 15 12.922 1.126 3.471 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.330 -0.200 2.490 1.00 0.00 H new ATOM 1879 N ASP C 16 14.088 0.346 0.793 1.00 0.00 N ATOM 1880 CA ASP C 16 14.975 0.568 -0.342 1.00 0.00 C ATOM 1881 C ASP C 16 14.686 -0.451 -1.450 1.00 0.00 C ATOM 1882 O ASP C 16 15.392 -0.500 -2.453 1.00 0.00 O ATOM 1883 CB ASP C 16 16.429 0.484 0.119 1.00 0.00 C ATOM 1884 CG ASP C 16 16.755 1.547 1.164 1.00 0.00 C ATOM 1885 OD1 ASP C 16 17.003 2.703 0.754 1.00 0.00 O ATOM 1886 OD2 ASP C 16 16.753 1.198 2.367 1.00 0.00 O ATOM 0 H ASP C 16 14.059 -0.625 1.103 1.00 0.00 H new ATOM 0 HA ASP C 16 14.798 1.563 -0.750 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.622 -0.505 0.534 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.090 0.604 -0.739 1.00 0.00 H new ATOM 1891 N ASP C 17 13.642 -1.267 -1.264 1.00 0.00 N ATOM 1892 CA ASP C 17 13.295 -2.342 -2.185 1.00 0.00 C ATOM 1893 C ASP C 17 11.779 -2.518 -2.328 1.00 0.00 C ATOM 1894 O ASP C 17 11.339 -3.523 -2.887 1.00 0.00 O ATOM 1895 CB ASP C 17 13.910 -3.656 -1.688 1.00 0.00 C ATOM 1896 CG ASP C 17 15.435 -3.587 -1.636 1.00 0.00 C ATOM 1897 OD1 ASP C 17 16.058 -3.763 -2.707 1.00 0.00 O ATOM 1898 OD2 ASP C 17 15.967 -3.364 -0.527 1.00 0.00 O ATOM 0 H ASP C 17 13.014 -1.195 -0.464 1.00 0.00 H new ATOM 0 HA ASP C 17 13.692 -2.076 -3.165 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.523 -3.885 -0.695 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.606 -4.471 -2.345 1.00 0.00 H new ATOM 1903 N ILE C 18 10.971 -1.569 -1.838 1.00 0.00 N ATOM 1904 CA ILE C 18 9.520 -1.698 -1.905 1.00 0.00 C ATOM 1905 C ILE C 18 8.906 -0.427 -2.479 1.00 0.00 C ATOM 1906 O ILE C 18 9.301 0.682 -2.128 1.00 0.00 O ATOM 1907 CB ILE C 18 8.968 -1.979 -0.503 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.588 -3.259 0.069 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.439 -2.091 -0.552 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.153 -3.494 1.515 1.00 0.00 C ATOM 0 H ILE C 18 11.300 -0.711 -1.395 1.00 0.00 H new ATOM 0 HA ILE C 18 9.259 -2.529 -2.561 1.00 0.00 H new ATOM 0 HB ILE C 18 9.234 -1.150 0.153 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.295 -4.112 -0.543 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.675 -3.191 0.021 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.057 -2.291 0.449 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.017 -1.156 -0.922 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.155 -2.906 -1.218 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.611 -4.410 1.889 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.469 -2.652 2.131 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.068 -3.588 1.558 1.00 0.00 H new ATOM 1922 N THR C 19 7.925 -0.594 -3.370 1.00 0.00 N ATOM 1923 CA THR C 19 7.226 0.524 -3.993 1.00 0.00 C ATOM 1924 C THR C 19 5.756 0.160 -4.129 1.00 0.00 C ATOM 1925 O THR C 19 5.425 -1.016 -4.257 1.00 0.00 O ATOM 1926 CB THR C 19 7.840 0.831 -5.368 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.248 0.823 -5.299 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.409 2.206 -5.869 1.00 0.00 C ATOM 0 H THR C 19 7.596 -1.509 -3.677 1.00 0.00 H new ATOM 0 HA THR C 19 7.323 1.417 -3.376 1.00 0.00 H new ATOM 0 HB THR C 19 7.488 0.058 -6.051 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.620 1.019 -6.184 1.00 0.00 H new ATOM 0 HG21 THR C 19 7.859 2.396 -6.844 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.323 2.237 -5.958 1.00 0.00 H new ATOM 0 HG23 THR C 19 7.737 2.969 -5.163 1.00 0.00 H new ATOM 1936 N ILE C 20 4.873 1.157 -4.103 1.00 0.00 N ATOM 1937 CA ILE C 20 3.429 0.951 -4.120 1.00 0.00 C ATOM 1938 C ILE C 20 2.815 1.890 -5.155 1.00 0.00 C ATOM 1939 O ILE C 20 3.347 2.972 -5.387 1.00 0.00 O ATOM 1940 CB ILE C 20 2.846 1.233 -2.728 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.641 0.574 -1.591 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.387 0.763 -2.664 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.577 -0.952 -1.608 1.00 0.00 C ATOM 0 H ILE C 20 5.144 2.140 -4.069 1.00 0.00 H new ATOM 0 HA ILE C 20 3.201 -0.082 -4.384 1.00 0.00 H new ATOM 0 HB ILE C 20 2.909 2.311 -2.582 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.683 0.887 -1.658 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.261 0.935 -0.635 1.00 0.00 H new ATOM 0 HG21 ILE C 20 0.982 0.967 -1.673 1.00 0.00 H new ATOM 0 HG22 ILE C 20 0.800 1.295 -3.412 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.341 -0.308 -2.861 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.160 -1.350 -0.778 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.540 -1.274 -1.510 1.00 0.00 H new ATOM 0 HD13 ILE C 20 3.985 -1.323 -2.548 1.00 0.00 H new ATOM 1955 N THR C 21 1.700 1.490 -5.776 1.00 0.00 N ATOM 1956 CA THR C 21 1.089 2.272 -6.846 1.00 0.00 C ATOM 1957 C THR C 21 -0.433 2.243 -6.737 1.00 0.00 C ATOM 1958 O THR C 21 -1.003 1.272 -6.237 1.00 0.00 O ATOM 1959 CB THR C 21 1.539 1.695 -8.195 1.00 0.00 C ATOM 1960 OG1 THR C 21 2.949 1.694 -8.267 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.017 2.504 -9.381 1.00 0.00 C ATOM 0 H THR C 21 1.205 0.627 -5.552 1.00 0.00 H new ATOM 0 HA THR C 21 1.408 3.311 -6.763 1.00 0.00 H new ATOM 0 HB THR C 21 1.133 0.685 -8.253 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.272 2.614 -8.367 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.364 2.053 -10.310 1.00 0.00 H new ATOM 0 HG22 THR C 21 -0.073 2.510 -9.366 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.386 3.527 -9.314 1.00 0.00 H new ATOM 1969 N ILE C 22 -1.088 3.312 -7.202 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.539 3.446 -7.201 1.00 0.00 C ATOM 1971 C ILE C 22 -3.030 3.358 -8.647 1.00 0.00 C ATOM 1972 O ILE C 22 -3.042 4.343 -9.384 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.948 4.736 -6.473 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.443 5.044 -6.614 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -2.157 5.949 -6.955 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -5.298 3.960 -5.962 1.00 0.00 C ATOM 0 H ILE C 22 -0.610 4.122 -7.597 1.00 0.00 H new ATOM 0 HA ILE C 22 -3.018 2.638 -6.648 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.721 4.550 -5.423 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.662 6.008 -6.155 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.701 5.127 -7.670 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.483 6.835 -6.411 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -1.094 5.784 -6.778 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -2.329 6.095 -8.021 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.353 4.209 -6.080 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -5.096 3.001 -6.439 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -5.057 3.895 -4.901 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.438 2.152 -9.046 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.844 1.876 -10.413 1.00 0.00 C ATOM 1990 C LEU C 23 -5.161 2.567 -10.757 1.00 0.00 C ATOM 1991 O LEU C 23 -5.410 2.879 -11.921 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.994 0.367 -10.607 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.731 -0.404 -10.209 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.973 -1.886 -10.457 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -1.513 0.043 -11.007 1.00 0.00 C ATOM 0 H LEU C 23 -3.494 1.344 -8.426 1.00 0.00 H new ATOM 0 HA LEU C 23 -3.074 2.265 -11.079 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.836 0.010 -10.014 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -4.229 0.160 -11.651 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.527 -0.207 -9.157 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -2.084 -2.451 -10.179 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.819 -2.222 -9.857 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -3.190 -2.047 -11.513 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.641 -0.530 -10.692 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.692 -0.124 -12.069 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -1.333 1.104 -10.832 1.00 0.00 H new ATOM 2007 N GLY C 24 -6.006 2.810 -9.751 1.00 0.00 N ATOM 2008 CA GLY C 24 -7.262 3.512 -9.961 1.00 0.00 C ATOM 2009 C GLY C 24 -8.199 3.415 -8.765 1.00 0.00 C ATOM 2010 O GLY C 24 -7.846 2.876 -7.718 1.00 0.00 O ATOM 0 H GLY C 24 -5.837 2.528 -8.785 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -7.056 4.561 -10.171 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.759 3.103 -10.840 1.00 0.00 H new ATOM 2014 N VAL C 25 -9.411 3.946 -8.941 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.434 3.966 -7.910 1.00 0.00 C ATOM 2016 C VAL C 25 -11.755 3.465 -8.485 1.00 0.00 C ATOM 2017 O VAL C 25 -11.936 3.428 -9.704 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.590 5.385 -7.339 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -9.281 5.878 -6.718 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -11.021 6.378 -8.420 1.00 0.00 C ATOM 0 H VAL C 25 -9.707 4.378 -9.817 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.135 3.305 -7.096 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.361 5.330 -6.571 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.422 6.884 -6.323 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -8.987 5.208 -5.910 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.500 5.893 -7.479 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.122 7.371 -7.982 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -10.271 6.404 -9.210 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.978 6.067 -8.839 1.00 0.00 H new ATOM 2030 N SER C 26 -12.679 3.074 -7.608 1.00 0.00 N ATOM 2031 CA SER C 26 -13.970 2.536 -8.000 1.00 0.00 C ATOM 2032 C SER C 26 -14.992 2.856 -6.914 1.00 0.00 C ATOM 2033 O SER C 26 -15.583 1.962 -6.309 1.00 0.00 O ATOM 2034 CB SER C 26 -13.840 1.032 -8.248 1.00 0.00 C ATOM 2035 OG SER C 26 -15.040 0.513 -8.790 1.00 0.00 O ATOM 0 H SER C 26 -12.546 3.124 -6.598 1.00 0.00 H new ATOM 0 HA SER C 26 -14.314 2.992 -8.928 1.00 0.00 H new ATOM 0 HB2 SER C 26 -13.013 0.840 -8.931 1.00 0.00 H new ATOM 0 HB3 SER C 26 -13.606 0.522 -7.313 1.00 0.00 H new ATOM 0 HG SER C 26 -14.940 -0.450 -8.944 1.00 0.00 H new ATOM 2041 N GLY C 27 -15.207 4.151 -6.660 1.00 0.00 N ATOM 2042 CA GLY C 27 -16.121 4.586 -5.618 1.00 0.00 C ATOM 2043 C GLY C 27 -15.489 4.344 -4.255 1.00 0.00 C ATOM 2044 O GLY C 27 -14.343 4.727 -4.023 1.00 0.00 O ATOM 0 H GLY C 27 -14.756 4.912 -7.167 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.352 5.644 -5.741 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -17.063 4.043 -5.696 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.239 3.706 -3.353 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.738 3.356 -2.033 1.00 0.00 C ATOM 2050 C GLN C 28 -14.692 2.235 -2.121 1.00 0.00 C ATOM 2051 O GLN C 28 -14.193 1.774 -1.095 1.00 0.00 O ATOM 2052 CB GLN C 28 -16.925 2.970 -1.148 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.553 2.977 0.336 1.00 0.00 C ATOM 2054 CD GLN C 28 -17.755 2.699 1.231 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -18.901 2.929 0.856 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -17.496 2.193 2.434 1.00 0.00 N ATOM 0 H GLN C 28 -17.204 3.421 -3.521 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.231 4.212 -1.587 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.747 3.664 -1.320 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.281 1.979 -1.429 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.784 2.227 0.520 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.124 3.944 0.597 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -16.532 2.013 2.715 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -18.261 1.985 3.075 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.352 1.788 -3.336 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.339 0.758 -3.528 1.00 0.00 C ATOM 2067 C GLN C 29 -12.128 1.335 -4.258 1.00 0.00 C ATOM 2068 O GLN C 29 -12.206 2.405 -4.862 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.911 -0.448 -4.280 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.266 -0.876 -3.701 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.738 -2.181 -4.324 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -16.079 -3.131 -3.631 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -15.764 -2.238 -5.651 1.00 0.00 N ATOM 0 H GLN C 29 -14.770 2.129 -4.202 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.016 0.409 -2.547 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -14.026 -0.200 -5.335 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -13.210 -1.281 -4.223 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -15.183 -0.994 -2.621 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -16.005 -0.095 -3.880 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -15.474 -1.430 -6.202 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -16.074 -3.090 -6.119 1.00 0.00 H new ATOM 2082 N VAL C 30 -11.005 0.620 -4.191 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.710 1.097 -4.648 1.00 0.00 C ATOM 2084 C VAL C 30 -8.906 -0.061 -5.228 1.00 0.00 C ATOM 2085 O VAL C 30 -9.028 -1.198 -4.770 1.00 0.00 O ATOM 2086 CB VAL C 30 -8.988 1.726 -3.446 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.522 2.008 -3.749 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.651 3.045 -3.060 1.00 0.00 C ATOM 0 H VAL C 30 -10.975 -0.325 -3.809 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.827 1.842 -5.435 1.00 0.00 H new ATOM 0 HB VAL C 30 -9.053 1.008 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.048 2.452 -2.873 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.017 1.076 -4.001 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.450 2.698 -4.590 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.129 3.479 -2.207 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.606 3.735 -3.902 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.693 2.865 -2.794 1.00 0.00 H new ATOM 2098 N ARG C 31 -8.082 0.230 -6.239 1.00 0.00 N ATOM 2099 CA ARG C 31 -7.264 -0.763 -6.937 1.00 0.00 C ATOM 2100 C ARG C 31 -5.812 -0.311 -6.859 1.00 0.00 C ATOM 2101 O ARG C 31 -5.452 0.741 -7.387 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.739 -0.863 -8.392 1.00 0.00 C ATOM 2103 CG ARG C 31 -8.031 -2.300 -8.839 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.784 -3.187 -8.937 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.116 -4.433 -9.634 1.00 0.00 N ATOM 2106 CZ ARG C 31 -6.840 -4.668 -10.923 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -6.210 -3.767 -11.670 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -7.196 -5.818 -11.483 1.00 0.00 N ATOM 0 H ARG C 31 -7.964 1.177 -6.600 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.356 -1.749 -6.481 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.640 -0.262 -8.515 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.979 -0.434 -9.045 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.732 -2.753 -8.138 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.524 -2.274 -9.811 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -5.993 -2.660 -9.471 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.404 -3.407 -7.940 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.587 -5.167 -9.104 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -5.927 -2.876 -11.263 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -6.010 -3.967 -12.650 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -7.681 -6.525 -10.931 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -6.984 -5.994 -12.465 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.976 -1.112 -6.200 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.598 -0.750 -5.902 1.00 0.00 C ATOM 2124 C ILE C 32 -2.667 -1.918 -6.182 1.00 0.00 C ATOM 2125 O ILE C 32 -3.096 -3.067 -6.238 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.467 -0.316 -4.435 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.192 -1.303 -3.509 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -4.005 1.106 -4.273 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -3.963 -0.961 -2.037 1.00 0.00 C ATOM 0 H ILE C 32 -5.241 -2.035 -5.857 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.316 0.084 -6.545 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.415 -0.321 -4.150 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.260 -1.289 -3.725 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -3.840 -2.315 -3.707 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.912 1.414 -3.232 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.433 1.786 -4.905 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -5.054 1.134 -4.567 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.491 -1.680 -1.410 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -2.896 -1.001 -1.816 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.339 0.042 -1.834 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.380 -1.615 -6.355 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.373 -2.619 -6.624 1.00 0.00 C ATOM 2143 C GLY C 33 0.818 -2.433 -5.692 1.00 0.00 C ATOM 2144 O GLY C 33 1.003 -1.366 -5.109 1.00 0.00 O ATOM 0 H GLY C 33 -1.015 -0.664 -6.311 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.797 -3.614 -6.490 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.047 -2.548 -7.662 1.00 0.00 H new ATOM 2148 N ILE C 34 1.617 -3.489 -5.563 1.00 0.00 N ATOM 2149 CA ILE C 34 2.775 -3.533 -4.694 1.00 0.00 C ATOM 2150 C ILE C 34 3.933 -4.090 -5.507 1.00 0.00 C ATOM 2151 O ILE C 34 3.764 -5.058 -6.248 1.00 0.00 O ATOM 2152 CB ILE C 34 2.505 -4.438 -3.483 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.381 -3.904 -2.587 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.777 -4.549 -2.637 1.00 0.00 C ATOM 2155 CD1 ILE C 34 -0.004 -4.392 -3.016 1.00 0.00 C ATOM 0 H ILE C 34 1.467 -4.358 -6.076 1.00 0.00 H new ATOM 0 HA ILE C 34 3.006 -2.535 -4.321 1.00 0.00 H new ATOM 0 HB ILE C 34 2.198 -5.408 -3.873 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.566 -4.211 -1.558 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.398 -2.814 -2.602 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.587 -5.191 -1.777 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.578 -4.977 -3.239 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.072 -3.558 -2.292 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.758 -3.981 -2.345 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -0.207 -4.062 -4.035 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -0.035 -5.481 -2.974 1.00 0.00 H new ATOM 2167 N ASN C 35 5.103 -3.479 -5.361 1.00 0.00 N ATOM 2168 CA ASN C 35 6.281 -3.824 -6.126 1.00 0.00 C ATOM 2169 C ASN C 35 7.440 -4.077 -5.172 1.00 0.00 C ATOM 2170 O ASN C 35 8.351 -3.267 -5.016 1.00 0.00 O ATOM 2171 CB ASN C 35 6.565 -2.723 -7.140 1.00 0.00 C ATOM 2172 CG ASN C 35 7.446 -3.215 -8.282 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.318 -4.060 -8.098 1.00 0.00 O ATOM 2174 ND2 ASN C 35 7.219 -2.683 -9.481 1.00 0.00 N ATOM 0 H ASN C 35 5.255 -2.720 -4.697 1.00 0.00 H new ATOM 0 HA ASN C 35 6.127 -4.743 -6.692 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.624 -2.349 -7.543 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.053 -1.886 -6.640 1.00 0.00 H new ATOM 0 HD21 ASN C 35 7.778 -2.975 -10.283 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.486 -1.983 -9.598 1.00 0.00 H new ATOM 2181 N ALA C 36 7.359 -5.242 -4.532 1.00 0.00 N ATOM 2182 CA ALA C 36 8.366 -5.756 -3.620 1.00 0.00 C ATOM 2183 C ALA C 36 8.846 -7.115 -4.126 1.00 0.00 C ATOM 2184 O ALA C 36 8.122 -7.789 -4.862 1.00 0.00 O ATOM 2185 CB ALA C 36 7.729 -5.907 -2.240 1.00 0.00 C ATOM 0 H ALA C 36 6.563 -5.871 -4.641 1.00 0.00 H new ATOM 0 HA ALA C 36 9.217 -5.078 -3.561 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.469 -6.292 -1.538 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.373 -4.936 -1.895 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.890 -6.600 -2.300 1.00 0.00 H new ATOM 2191 N PRO C 37 10.056 -7.535 -3.750 1.00 0.00 N ATOM 2192 CA PRO C 37 10.582 -8.835 -4.117 1.00 0.00 C ATOM 2193 C PRO C 37 9.892 -9.887 -3.259 1.00 0.00 C ATOM 2194 O PRO C 37 9.436 -9.585 -2.160 1.00 0.00 O ATOM 2195 CB PRO C 37 12.072 -8.761 -3.802 1.00 0.00 C ATOM 2196 CG PRO C 37 12.125 -7.791 -2.624 1.00 0.00 C ATOM 2197 CD PRO C 37 11.006 -6.803 -2.933 1.00 0.00 C ATOM 0 HA PRO C 37 10.417 -9.095 -5.163 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.478 -9.738 -3.539 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.647 -8.395 -4.653 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.960 -8.301 -1.675 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.093 -7.294 -2.555 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.539 -6.441 -2.017 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.388 -5.930 -3.463 1.00 0.00 H new ATOM 2205 N LYS C 38 9.810 -11.127 -3.746 1.00 0.00 N ATOM 2206 CA LYS C 38 9.191 -12.193 -2.973 1.00 0.00 C ATOM 2207 C LYS C 38 10.047 -12.581 -1.767 1.00 0.00 C ATOM 2208 O LYS C 38 9.669 -13.470 -1.004 1.00 0.00 O ATOM 2209 CB LYS C 38 8.826 -13.369 -3.880 1.00 0.00 C ATOM 2210 CG LYS C 38 7.701 -12.870 -4.790 1.00 0.00 C ATOM 2211 CD LYS C 38 6.913 -13.973 -5.494 1.00 0.00 C ATOM 2212 CE LYS C 38 7.663 -14.585 -6.678 1.00 0.00 C ATOM 2213 NZ LYS C 38 8.812 -15.408 -6.255 1.00 0.00 N ATOM 0 H LYS C 38 10.161 -11.411 -4.661 1.00 0.00 H new ATOM 0 HA LYS C 38 8.254 -11.829 -2.552 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.687 -13.691 -4.466 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.500 -14.228 -3.293 1.00 0.00 H new ATOM 0 HG2 LYS C 38 7.010 -12.271 -4.196 1.00 0.00 H new ATOM 0 HG3 LYS C 38 8.128 -12.209 -5.544 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.678 -14.758 -4.776 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.964 -13.567 -5.844 1.00 0.00 H new ATOM 0 HE2 LYS C 38 6.976 -15.198 -7.261 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.013 -13.788 -7.333 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 8.896 -16.235 -6.881 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 9.683 -14.842 -6.310 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 8.668 -15.728 -5.276 1.00 0.00 H new ATOM 2227 N ASP C 39 11.190 -11.916 -1.593 1.00 0.00 N ATOM 2228 CA ASP C 39 11.997 -12.033 -0.388 1.00 0.00 C ATOM 2229 C ASP C 39 11.261 -11.375 0.783 1.00 0.00 C ATOM 2230 O ASP C 39 11.633 -11.581 1.939 1.00 0.00 O ATOM 2231 CB ASP C 39 13.355 -11.370 -0.608 1.00 0.00 C ATOM 2232 CG ASP C 39 14.152 -12.107 -1.683 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.791 -13.123 -1.334 1.00 0.00 O ATOM 2234 OD2 ASP C 39 14.116 -11.648 -2.848 1.00 0.00 O ATOM 0 H ASP C 39 11.579 -11.280 -2.289 1.00 0.00 H new ATOM 0 HA ASP C 39 12.160 -13.086 -0.156 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.213 -10.330 -0.903 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.917 -11.363 0.326 1.00 0.00 H new ATOM 2239 N VAL C 40 10.221 -10.587 0.490 1.00 0.00 N ATOM 2240 CA VAL C 40 9.326 -10.043 1.492 1.00 0.00 C ATOM 2241 C VAL C 40 7.883 -10.305 1.078 1.00 0.00 C ATOM 2242 O VAL C 40 7.541 -10.277 -0.107 1.00 0.00 O ATOM 2243 CB VAL C 40 9.589 -8.548 1.714 1.00 0.00 C ATOM 2244 CG1 VAL C 40 11.056 -8.319 2.071 1.00 0.00 C ATOM 2245 CG2 VAL C 40 9.241 -7.716 0.486 1.00 0.00 C ATOM 0 H VAL C 40 9.983 -10.312 -0.463 1.00 0.00 H new ATOM 0 HA VAL C 40 9.510 -10.540 2.444 1.00 0.00 H new ATOM 0 HB VAL C 40 8.947 -8.229 2.535 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.231 -7.254 2.226 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.298 -8.863 2.984 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.688 -8.676 1.258 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.443 -6.664 0.690 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.845 -8.045 -0.359 1.00 0.00 H new ATOM 0 HG23 VAL C 40 8.185 -7.843 0.248 1.00 0.00 H new ATOM 2255 N ALA C 41 7.024 -10.560 2.067 1.00 0.00 N ATOM 2256 CA ALA C 41 5.650 -10.949 1.825 1.00 0.00 C ATOM 2257 C ALA C 41 4.750 -9.743 1.565 1.00 0.00 C ATOM 2258 O ALA C 41 5.037 -8.634 2.009 1.00 0.00 O ATOM 2259 CB ALA C 41 5.150 -11.718 3.045 1.00 0.00 C ATOM 0 H ALA C 41 7.270 -10.500 3.055 1.00 0.00 H new ATOM 0 HA ALA C 41 5.614 -11.572 0.931 1.00 0.00 H new ATOM 0 HB1 ALA C 41 4.115 -12.021 2.885 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.768 -12.603 3.196 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.209 -11.080 3.927 1.00 0.00 H new ATOM 2265 N VAL C 42 3.655 -9.977 0.839 1.00 0.00 N ATOM 2266 CA VAL C 42 2.573 -9.016 0.686 1.00 0.00 C ATOM 2267 C VAL C 42 1.271 -9.787 0.515 1.00 0.00 C ATOM 2268 O VAL C 42 1.144 -10.622 -0.382 1.00 0.00 O ATOM 2269 CB VAL C 42 2.808 -8.029 -0.472 1.00 0.00 C ATOM 2270 CG1 VAL C 42 3.314 -8.687 -1.746 1.00 0.00 C ATOM 2271 CG2 VAL C 42 1.511 -7.302 -0.827 1.00 0.00 C ATOM 0 H VAL C 42 3.498 -10.851 0.337 1.00 0.00 H new ATOM 0 HA VAL C 42 2.524 -8.396 1.581 1.00 0.00 H new ATOM 0 HB VAL C 42 3.573 -7.344 -0.108 1.00 0.00 H new ATOM 0 HG11 VAL C 42 3.456 -7.928 -2.516 1.00 0.00 H new ATOM 0 HG12 VAL C 42 4.264 -9.183 -1.547 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.586 -9.422 -2.090 1.00 0.00 H new ATOM 0 HG21 VAL C 42 1.696 -6.608 -1.647 1.00 0.00 H new ATOM 0 HG22 VAL C 42 0.757 -8.029 -1.129 1.00 0.00 H new ATOM 0 HG23 VAL C 42 1.154 -6.749 0.042 1.00 0.00 H new ATOM 2281 N HIS C 43 0.314 -9.485 1.399 1.00 0.00 N ATOM 2282 CA HIS C 43 -1.021 -10.084 1.421 1.00 0.00 C ATOM 2283 C HIS C 43 -2.031 -9.079 1.969 1.00 0.00 C ATOM 2284 O HIS C 43 -1.643 -8.044 2.514 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.046 -11.316 2.335 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.046 -12.389 1.993 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.346 -13.582 1.339 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.290 -12.357 2.276 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.818 -14.239 1.241 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.819 -13.528 1.789 1.00 0.00 N ATOM 0 H HIS C 43 0.453 -8.797 2.139 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.275 -10.371 0.401 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -0.870 -10.991 3.361 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.045 -11.750 2.305 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.825 -11.567 2.783 1.00 0.00 H new ATOM 0 HE1 HIS C 43 0.936 -15.210 0.783 1.00 0.00 H new ATOM 0 HE2 HIS C 43 2.799 -13.808 1.835 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.323 -9.382 1.825 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.389 -8.561 2.382 1.00 0.00 C ATOM 2300 C ARG C 44 -4.425 -8.703 3.903 1.00 0.00 C ATOM 2301 O ARG C 44 -3.863 -9.647 4.447 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.725 -8.980 1.771 1.00 0.00 C ATOM 2303 CG ARG C 44 -6.127 -10.365 2.279 1.00 0.00 C ATOM 2304 CD ARG C 44 -7.439 -10.813 1.643 1.00 0.00 C ATOM 2305 NE ARG C 44 -7.213 -11.350 0.302 1.00 0.00 N ATOM 2306 CZ ARG C 44 -7.915 -12.361 -0.213 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.959 -12.878 0.431 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -7.577 -12.869 -1.391 1.00 0.00 N ATOM 0 H ARG C 44 -3.655 -10.203 1.319 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.202 -7.514 2.143 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.495 -8.253 2.028 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.648 -8.992 0.684 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -5.341 -11.084 2.049 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.232 -10.344 3.364 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -7.910 -11.572 2.268 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -8.128 -9.970 1.590 1.00 0.00 H new ATOM 0 HE ARG C 44 -6.480 -10.930 -0.270 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -9.237 -12.501 1.337 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -9.481 -13.651 0.018 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -6.781 -12.487 -1.902 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -8.113 -13.642 -1.786 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.088 -7.774 4.595 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.160 -7.837 6.052 1.00 0.00 C ATOM 2324 C GLU C 45 -6.104 -8.950 6.515 1.00 0.00 C ATOM 2325 O GLU C 45 -5.975 -9.445 7.635 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.579 -6.476 6.622 1.00 0.00 C ATOM 2327 CG GLU C 45 -7.024 -6.081 6.287 1.00 0.00 C ATOM 2328 CD GLU C 45 -8.053 -6.736 7.204 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -7.817 -6.749 8.431 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -9.075 -7.223 6.665 1.00 0.00 O ATOM 0 H GLU C 45 -5.575 -6.982 4.176 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.168 -8.077 6.434 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -5.459 -6.494 7.705 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -4.905 -5.710 6.240 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -7.123 -4.998 6.355 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.239 -6.356 5.255 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.047 -9.346 5.660 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.024 -10.385 5.957 1.00 0.00 C ATOM 2339 C GLU C 46 -7.365 -11.767 6.046 1.00 0.00 C ATOM 2340 O GLU C 46 -7.959 -12.703 6.576 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.081 -10.350 4.843 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.134 -11.451 4.947 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.064 -11.399 3.736 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -10.585 -11.744 2.631 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -12.241 -11.017 3.923 1.00 0.00 O ATOM 0 H GLU C 46 -7.152 -8.945 4.728 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.484 -10.201 6.928 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.581 -9.381 4.861 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.580 -10.432 3.879 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -9.649 -12.426 5.002 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -10.710 -11.329 5.864 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.142 -11.909 5.526 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.474 -13.198 5.440 1.00 0.00 C ATOM 2354 C ILE C 47 -4.052 -13.120 5.985 1.00 0.00 C ATOM 2355 O ILE C 47 -3.508 -14.137 6.405 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.498 -13.664 3.974 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.893 -14.203 3.644 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.439 -14.725 3.669 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.918 -14.891 2.276 1.00 0.00 C ATOM 0 H ILE C 47 -5.594 -11.132 5.156 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.000 -13.927 6.056 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.262 -12.802 3.350 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.203 -14.910 4.414 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.613 -13.384 3.654 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.505 -15.014 2.620 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.448 -14.319 3.872 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.608 -15.599 4.298 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.923 -15.262 2.073 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.632 -14.176 1.504 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.217 -15.725 2.275 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.423 -11.943 6.000 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.065 -11.868 6.508 1.00 0.00 C ATOM 2373 C TYR C 48 -2.037 -12.252 7.984 1.00 0.00 C ATOM 2374 O TYR C 48 -1.078 -12.858 8.458 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.516 -10.460 6.325 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.110 -10.360 6.848 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.966 -10.714 6.023 1.00 0.00 C ATOM 2378 CD2 TYR C 48 0.114 -9.930 8.160 1.00 0.00 C ATOM 2379 CE1 TYR C 48 2.276 -10.647 6.515 1.00 0.00 C ATOM 2380 CE2 TYR C 48 1.417 -9.868 8.663 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.506 -10.206 7.834 1.00 0.00 C ATOM 2382 OH TYR C 48 3.779 -10.113 8.311 1.00 0.00 O ATOM 0 H TYR C 48 -3.820 -11.061 5.677 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.441 -12.566 5.950 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.535 -10.192 5.269 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.154 -9.746 6.846 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.786 -11.038 5.009 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.720 -9.646 8.785 1.00 0.00 H new ATOM 0 HE1 TYR C 48 3.106 -10.932 5.886 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.589 -9.562 9.684 1.00 0.00 H new ATOM 0 HH TYR C 48 4.386 -9.877 7.579 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.096 -11.895 8.711 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.185 -12.167 10.134 1.00 0.00 C ATOM 2394 C GLN C 49 -3.431 -13.650 10.400 1.00 0.00 C ATOM 2395 O GLN C 49 -3.265 -14.106 11.532 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.303 -11.308 10.730 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.024 -9.839 10.403 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.054 -8.909 11.035 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.040 -8.682 12.241 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -5.955 -8.363 10.222 1.00 0.00 N ATOM 0 H GLN C 49 -3.908 -11.412 8.327 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.238 -11.913 10.610 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.268 -11.609 10.322 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -4.354 -11.451 11.809 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.028 -9.571 10.757 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.026 -9.701 9.322 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -5.936 -8.575 9.224 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -6.664 -7.733 10.596 1.00 0.00 H new ATOM 2409 N ARG C 50 -3.826 -14.406 9.367 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.026 -15.843 9.492 1.00 0.00 C ATOM 2411 C ARG C 50 -2.758 -16.594 9.093 1.00 0.00 C ATOM 2412 O ARG C 50 -2.502 -17.677 9.602 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.258 -16.271 8.681 1.00 0.00 C ATOM 2414 CG ARG C 50 -4.928 -16.910 7.330 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.210 -17.152 6.535 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.065 -18.149 7.186 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.233 -18.573 6.696 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.700 -18.099 5.544 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -8.943 -19.479 7.360 1.00 0.00 N ATOM 0 H ARG C 50 -4.012 -14.038 8.434 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.223 -16.100 10.533 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -5.841 -16.978 9.272 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -5.890 -15.399 8.513 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.259 -16.261 6.766 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.403 -17.853 7.484 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.757 -16.215 6.430 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -5.958 -17.488 5.529 1.00 0.00 H new ATOM 0 HE ARG C 50 -6.747 -18.545 8.071 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.165 -17.404 5.024 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.593 -18.431 5.181 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.596 -19.851 8.244 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -9.835 -19.803 6.986 1.00 0.00 H new ATOM 2433 N ILE C 51 -1.961 -16.019 8.184 1.00 0.00 N ATOM 2434 CA ILE C 51 -0.665 -16.565 7.800 1.00 0.00 C ATOM 2435 C ILE C 51 0.290 -16.431 8.974 1.00 0.00 C ATOM 2436 O ILE C 51 0.994 -17.375 9.334 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.139 -15.772 6.596 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.040 -16.026 5.386 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.299 -16.157 6.234 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.735 -15.036 4.270 1.00 0.00 C ATOM 0 H ILE C 51 -2.204 -15.157 7.695 1.00 0.00 H new ATOM 0 HA ILE C 51 -0.753 -17.617 7.530 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.147 -14.717 6.870 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -0.894 -17.044 5.025 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.086 -15.939 5.680 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.628 -15.570 5.376 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.954 -15.958 7.083 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.340 -17.217 5.985 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.387 -15.235 3.419 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.905 -14.021 4.628 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.305 -15.143 3.963 1.00 0.00 H new ATOM 2452 N GLN C 52 0.313 -15.247 9.582 1.00 0.00 N ATOM 2453 CA GLN C 52 1.211 -14.955 10.688 1.00 0.00 C ATOM 2454 C GLN C 52 0.714 -15.581 11.989 1.00 0.00 C ATOM 2455 O GLN C 52 1.299 -15.360 13.048 1.00 0.00 O ATOM 2456 CB GLN C 52 1.407 -13.439 10.787 1.00 0.00 C ATOM 2457 CG GLN C 52 2.098 -12.935 9.518 1.00 0.00 C ATOM 2458 CD GLN C 52 3.365 -13.720 9.211 1.00 0.00 C ATOM 2459 OE1 GLN C 52 4.376 -13.579 9.890 1.00 0.00 O ATOM 2460 NE2 GLN C 52 3.309 -14.556 8.176 1.00 0.00 N ATOM 0 H GLN C 52 -0.290 -14.467 9.320 1.00 0.00 H new ATOM 0 HA GLN C 52 2.185 -15.408 10.501 1.00 0.00 H new ATOM 0 HB2 GLN C 52 0.444 -12.944 10.912 1.00 0.00 H new ATOM 0 HB3 GLN C 52 2.007 -13.195 11.663 1.00 0.00 H new ATOM 0 HG2 GLN C 52 1.411 -13.012 8.676 1.00 0.00 H new ATOM 0 HG3 GLN C 52 2.344 -11.879 9.634 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.447 -14.643 7.637 1.00 0.00 H new ATOM 0 HE22 GLN C 52 4.128 -15.109 7.922 1.00 0.00 H new ATOM 2469 N ALA C 53 -0.365 -16.366 11.920 1.00 0.00 N ATOM 2470 CA ALA C 53 -0.867 -17.076 13.079 1.00 0.00 C ATOM 2471 C ALA C 53 0.050 -18.250 13.439 1.00 0.00 C ATOM 2472 O ALA C 53 -0.043 -18.773 14.550 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.285 -17.568 12.805 1.00 0.00 C ATOM 0 H ALA C 53 -0.903 -16.520 11.067 1.00 0.00 H new ATOM 0 HA ALA C 53 -0.885 -16.393 13.928 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -2.660 -18.102 13.678 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -2.932 -16.716 12.595 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.278 -18.238 11.946 1.00 0.00 H new ATOM 2479 N GLY C 54 0.928 -18.667 12.518 1.00 0.00 N ATOM 2480 CA GLY C 54 1.863 -19.760 12.755 1.00 0.00 C ATOM 2481 C GLY C 54 1.804 -20.809 11.646 1.00 0.00 C ATOM 2482 O GLY C 54 2.247 -21.938 11.845 1.00 0.00 O ATOM 0 H GLY C 54 1.006 -18.252 11.589 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.876 -19.363 12.826 1.00 0.00 H new ATOM 0 HA3 GLY C 54 1.637 -20.230 13.712 1.00 0.00 H new ATOM 2486 N LEU C 55 1.257 -20.448 10.482 1.00 0.00 N ATOM 2487 CA LEU C 55 1.009 -21.377 9.389 1.00 0.00 C ATOM 2488 C LEU C 55 1.309 -20.727 8.040 1.00 0.00 C ATOM 2489 O LEU C 55 1.827 -19.613 7.987 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.448 -21.845 9.493 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.463 -20.690 9.433 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.702 -20.196 8.007 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -2.791 -21.188 9.992 1.00 0.00 C ATOM 0 H LEU C 55 0.973 -19.491 10.275 1.00 0.00 H new ATOM 0 HA LEU C 55 1.672 -22.239 9.463 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.656 -22.545 8.684 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -0.582 -22.389 10.428 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.058 -19.861 10.013 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.426 -19.381 8.021 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -0.763 -19.840 7.583 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.088 -21.014 7.398 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.525 -20.383 9.958 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.146 -22.028 9.394 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -2.653 -21.510 11.024 1.00 0.00 H new ATOM 2505 N THR C 56 0.981 -21.416 6.946 1.00 0.00 N ATOM 2506 CA THR C 56 1.162 -20.885 5.599 1.00 0.00 C ATOM 2507 C THR C 56 -0.019 -21.286 4.719 1.00 0.00 C ATOM 2508 O THR C 56 -0.818 -22.145 5.095 1.00 0.00 O ATOM 2509 CB THR C 56 2.484 -21.374 4.997 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.518 -22.786 4.998 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.666 -20.848 5.813 1.00 0.00 C ATOM 0 H THR C 56 0.584 -22.355 6.971 1.00 0.00 H new ATOM 0 HA THR C 56 1.203 -19.797 5.652 1.00 0.00 H new ATOM 0 HB THR C 56 2.556 -21.003 3.975 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.364 -23.093 4.611 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.598 -21.203 5.374 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.655 -19.758 5.808 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.588 -21.207 6.839 1.00 0.00 H new ATOM 2519 N ALA C 57 -0.136 -20.659 3.546 1.00 0.00 N ATOM 2520 CA ALA C 57 -1.232 -20.912 2.622 1.00 0.00 C ATOM 2521 C ALA C 57 -1.270 -22.379 2.192 1.00 0.00 C ATOM 2522 O ALA C 57 -0.235 -23.050 2.177 1.00 0.00 O ATOM 2523 CB ALA C 57 -1.054 -20.005 1.411 1.00 0.00 C ATOM 0 H ALA C 57 0.530 -19.961 3.214 1.00 0.00 H new ATOM 0 HA ALA C 57 -2.179 -20.699 3.117 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -1.866 -20.178 0.704 1.00 0.00 H new ATOM 0 HB2 ALA C 57 -1.068 -18.963 1.731 1.00 0.00 H new ATOM 0 HB3 ALA C 57 -0.101 -20.224 0.930 1.00 0.00 H new