USER MOD reduce.3.24.130724 H: found=0, std=0, add=721, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 720 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 23 TYR OH : rot 180:sc= -0.25 USER MOD Single : A 1 MET CE :methyl -157:sc= -0.069 (180deg=-0.691) USER MOD Single : A 1 MET N :NH3+ -141:sc= -0.082 (180deg=-1.07) USER MOD Single : A 4 THR OG1 : rot -170:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 13 SER OG : rot 96:sc= 1.22 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN :FLIP amide:sc= -0.625 F(o=-3.4,f=-0.63) USER MOD Single : A 39 GLN : amide:sc= -0.137 K(o=-0.14,f=-1.3!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 83:sc= 0.469 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl 152:sc= -7.15! (180deg=-10.3!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -170:sc= 0.0681 USER MOD Single : A 60 TYR OH : rot -169:sc= 0.0108 USER MOD Single : A 64 SER OG : rot -158:sc= -0.128 USER MOD Single : A 65 SER OG : rot 83:sc= 0.0101 USER MOD Single : A 68 TYR OH : rot 150:sc= -5.87! USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.415) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 22 GLN : amide:sc= -0.151 K(o=-0.15,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.385 2.403 7.260 1.00 0.00 N ATOM 2 CA MET A 1 -4.705 1.041 7.774 1.00 0.00 C ATOM 3 C MET A 1 -3.543 0.084 7.499 1.00 0.00 C ATOM 4 O MET A 1 -2.461 0.497 7.131 1.00 0.00 O ATOM 5 CB MET A 1 -5.951 0.607 7.000 1.00 0.00 C ATOM 6 CG MET A 1 -7.115 1.540 7.341 1.00 0.00 C ATOM 7 SD MET A 1 -8.589 1.019 6.430 1.00 0.00 S ATOM 8 CE MET A 1 -8.073 1.618 4.803 1.00 0.00 C ATOM 0 H1 MET A 1 -4.738 3.118 7.928 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.355 2.503 7.158 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.839 2.540 6.334 1.00 0.00 H new ATOM 0 HA MET A 1 -4.872 1.036 8.851 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.753 0.632 5.928 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.209 -0.421 7.253 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.310 1.519 8.413 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.859 2.568 7.084 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.952 1.779 4.179 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.531 2.557 4.916 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.424 0.879 4.332 1.00 0.00 H new ATOM 18 N ALA A 2 -3.757 -1.191 7.674 1.00 0.00 N ATOM 19 CA ALA A 2 -2.663 -2.172 7.423 1.00 0.00 C ATOM 20 C ALA A 2 -2.759 -2.716 5.995 1.00 0.00 C ATOM 21 O ALA A 2 -3.835 -2.927 5.473 1.00 0.00 O ATOM 22 CB ALA A 2 -2.895 -3.291 8.439 1.00 0.00 C ATOM 0 H ALA A 2 -4.642 -1.596 7.980 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.674 -1.725 7.527 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -2.128 -4.056 8.319 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -2.845 -2.882 9.448 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -3.878 -3.733 8.275 1.00 0.00 H new ATOM 28 N ASP A 3 -1.641 -2.944 5.361 1.00 0.00 N ATOM 29 CA ASP A 3 -1.669 -3.476 3.968 1.00 0.00 C ATOM 30 C ASP A 3 -2.002 -4.970 3.982 1.00 0.00 C ATOM 31 O ASP A 3 -3.020 -5.395 3.473 1.00 0.00 O ATOM 32 CB ASP A 3 -0.258 -3.245 3.426 1.00 0.00 C ATOM 33 CG ASP A 3 -0.184 -1.866 2.768 1.00 0.00 C ATOM 34 OD1 ASP A 3 -0.970 -1.010 3.138 1.00 0.00 O ATOM 35 OD2 ASP A 3 0.658 -1.690 1.901 1.00 0.00 O ATOM 0 H ASP A 3 -0.710 -2.785 5.747 1.00 0.00 H new ATOM 0 HA ASP A 3 -2.425 -2.987 3.353 1.00 0.00 H new ATOM 0 HB2 ASP A 3 0.469 -3.313 4.235 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -0.004 -4.019 2.702 1.00 0.00 H new ATOM 40 N THR A 4 -1.150 -5.771 4.561 1.00 0.00 N ATOM 41 CA THR A 4 -1.418 -7.237 4.608 1.00 0.00 C ATOM 42 C THR A 4 -0.871 -7.832 5.909 1.00 0.00 C ATOM 43 O THR A 4 0.196 -8.413 5.938 1.00 0.00 O ATOM 44 CB THR A 4 -0.676 -7.815 3.400 1.00 0.00 C ATOM 45 OG1 THR A 4 0.529 -7.091 3.198 1.00 0.00 O ATOM 46 CG2 THR A 4 -1.558 -7.700 2.156 1.00 0.00 C ATOM 0 H THR A 4 -0.280 -5.474 5.003 1.00 0.00 H new ATOM 0 HA THR A 4 -2.484 -7.464 4.578 1.00 0.00 H new ATOM 0 HB THR A 4 -0.444 -8.864 3.582 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.926 -7.350 2.340 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.030 -8.112 1.296 1.00 0.00 H new ATOM 0 HG22 THR A 4 -2.483 -8.255 2.313 1.00 0.00 H new ATOM 0 HG23 THR A 4 -1.791 -6.651 1.971 1.00 0.00 H new ATOM 54 N ASP A 5 -1.594 -7.691 6.986 1.00 0.00 N ATOM 55 CA ASP A 5 -1.115 -8.247 8.284 1.00 0.00 C ATOM 56 C ASP A 5 0.300 -7.742 8.583 1.00 0.00 C ATOM 57 O ASP A 5 0.787 -6.821 7.957 1.00 0.00 O ATOM 58 CB ASP A 5 -1.114 -9.763 8.090 1.00 0.00 C ATOM 59 CG ASP A 5 -2.556 -10.265 7.985 1.00 0.00 C ATOM 60 OD1 ASP A 5 -3.424 -9.643 8.574 1.00 0.00 O ATOM 61 OD2 ASP A 5 -2.767 -11.263 7.316 1.00 0.00 O ATOM 0 H ASP A 5 -2.495 -7.215 7.024 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.744 -7.945 9.121 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -0.560 -10.025 7.188 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.609 -10.247 8.926 1.00 0.00 H new ATOM 66 N THR A 6 0.967 -8.340 9.533 1.00 0.00 N ATOM 67 CA THR A 6 2.349 -7.894 9.867 1.00 0.00 C ATOM 68 C THR A 6 3.371 -8.896 9.324 1.00 0.00 C ATOM 69 O THR A 6 4.490 -8.545 9.004 1.00 0.00 O ATOM 70 CB THR A 6 2.396 -7.852 11.394 1.00 0.00 C ATOM 71 OG1 THR A 6 1.149 -7.388 11.892 1.00 0.00 O ATOM 72 CG2 THR A 6 3.511 -6.906 11.845 1.00 0.00 C ATOM 0 H THR A 6 0.615 -9.117 10.091 1.00 0.00 H new ATOM 0 HA THR A 6 2.588 -6.926 9.428 1.00 0.00 H new ATOM 0 HB THR A 6 2.592 -8.852 11.780 1.00 0.00 H new ATOM 0 HG1 THR A 6 1.177 -7.362 12.871 1.00 0.00 H new ATOM 0 HG21 THR A 6 3.544 -6.876 12.934 1.00 0.00 H new ATOM 0 HG22 THR A 6 4.467 -7.262 11.462 1.00 0.00 H new ATOM 0 HG23 THR A 6 3.316 -5.905 11.460 1.00 0.00 H new ATOM 80 N ALA A 7 2.993 -10.140 9.209 1.00 0.00 N ATOM 81 CA ALA A 7 3.942 -11.161 8.678 1.00 0.00 C ATOM 82 C ALA A 7 4.258 -10.856 7.214 1.00 0.00 C ATOM 83 O ALA A 7 5.397 -10.890 6.792 1.00 0.00 O ATOM 84 CB ALA A 7 3.202 -12.493 8.805 1.00 0.00 C ATOM 0 H ALA A 7 2.070 -10.494 9.459 1.00 0.00 H new ATOM 0 HA ALA A 7 4.890 -11.174 9.216 1.00 0.00 H new ATOM 0 HB1 ALA A 7 3.836 -13.298 8.434 1.00 0.00 H new ATOM 0 HB2 ALA A 7 2.959 -12.676 9.852 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.283 -12.456 8.220 1.00 0.00 H new ATOM 90 N GLU A 8 3.254 -10.549 6.440 1.00 0.00 N ATOM 91 CA GLU A 8 3.486 -10.229 5.003 1.00 0.00 C ATOM 92 C GLU A 8 4.491 -9.082 4.879 1.00 0.00 C ATOM 93 O GLU A 8 5.299 -9.046 3.971 1.00 0.00 O ATOM 94 CB GLU A 8 2.119 -9.808 4.465 1.00 0.00 C ATOM 95 CG GLU A 8 1.959 -10.307 3.028 1.00 0.00 C ATOM 96 CD GLU A 8 1.179 -11.623 3.029 1.00 0.00 C ATOM 97 OE1 GLU A 8 1.643 -12.563 3.654 1.00 0.00 O ATOM 98 OE2 GLU A 8 0.132 -11.669 2.405 1.00 0.00 O ATOM 0 H GLU A 8 2.280 -10.506 6.741 1.00 0.00 H new ATOM 0 HA GLU A 8 3.896 -11.074 4.449 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.328 -10.217 5.093 1.00 0.00 H new ATOM 0 HB3 GLU A 8 2.023 -8.723 4.497 1.00 0.00 H new ATOM 0 HG2 GLU A 8 1.435 -9.562 2.429 1.00 0.00 H new ATOM 0 HG3 GLU A 8 2.938 -10.452 2.571 1.00 0.00 H new ATOM 105 N GLN A 9 4.443 -8.140 5.782 1.00 0.00 N ATOM 106 CA GLN A 9 5.391 -6.990 5.712 1.00 0.00 C ATOM 107 C GLN A 9 6.836 -7.486 5.821 1.00 0.00 C ATOM 108 O GLN A 9 7.704 -7.058 5.085 1.00 0.00 O ATOM 109 CB GLN A 9 5.035 -6.112 6.912 1.00 0.00 C ATOM 110 CG GLN A 9 4.462 -4.781 6.419 1.00 0.00 C ATOM 111 CD GLN A 9 4.000 -3.948 7.618 1.00 0.00 C ATOM 112 OE1 GLN A 9 3.751 -4.479 8.681 1.00 0.00 O ATOM 113 NE2 GLN A 9 3.876 -2.656 7.490 1.00 0.00 N ATOM 0 H GLN A 9 3.789 -8.117 6.565 1.00 0.00 H new ATOM 0 HA GLN A 9 5.313 -6.447 4.770 1.00 0.00 H new ATOM 0 HB2 GLN A 9 4.308 -6.621 7.545 1.00 0.00 H new ATOM 0 HB3 GLN A 9 5.921 -5.935 7.522 1.00 0.00 H new ATOM 0 HG2 GLN A 9 5.217 -4.235 5.853 1.00 0.00 H new ATOM 0 HG3 GLN A 9 3.625 -4.961 5.744 1.00 0.00 H new ATOM 0 HE21 GLN A 9 4.085 -2.210 6.597 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.570 -2.092 8.283 1.00 0.00 H new ATOM 122 N VAL A 10 7.103 -8.386 6.728 1.00 0.00 N ATOM 123 CA VAL A 10 8.494 -8.904 6.872 1.00 0.00 C ATOM 124 C VAL A 10 8.958 -9.529 5.554 1.00 0.00 C ATOM 125 O VAL A 10 10.051 -9.276 5.086 1.00 0.00 O ATOM 126 CB VAL A 10 8.413 -9.965 7.970 1.00 0.00 C ATOM 127 CG1 VAL A 10 9.822 -10.436 8.328 1.00 0.00 C ATOM 128 CG2 VAL A 10 7.745 -9.365 9.209 1.00 0.00 C ATOM 0 H VAL A 10 6.421 -8.784 7.374 1.00 0.00 H new ATOM 0 HA VAL A 10 9.206 -8.117 7.122 1.00 0.00 H new ATOM 0 HB VAL A 10 7.826 -10.812 7.615 1.00 0.00 H new ATOM 0 HG11 VAL A 10 9.765 -11.192 9.111 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.298 -10.863 7.445 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.409 -9.589 8.684 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.687 -10.120 9.993 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.332 -8.518 9.564 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.740 -9.029 8.954 1.00 0.00 H new ATOM 138 N ILE A 11 8.133 -10.340 4.950 1.00 0.00 N ATOM 139 CA ILE A 11 8.523 -10.978 3.660 1.00 0.00 C ATOM 140 C ILE A 11 8.678 -9.906 2.581 1.00 0.00 C ATOM 141 O ILE A 11 9.675 -9.849 1.889 1.00 0.00 O ATOM 142 CB ILE A 11 7.370 -11.923 3.320 1.00 0.00 C ATOM 143 CG1 ILE A 11 7.415 -13.135 4.254 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.505 -12.391 1.870 1.00 0.00 C ATOM 145 CD1 ILE A 11 6.004 -13.698 4.428 1.00 0.00 C ATOM 0 H ILE A 11 7.205 -10.589 5.294 1.00 0.00 H new ATOM 0 HA ILE A 11 9.473 -11.509 3.725 1.00 0.00 H new ATOM 0 HB ILE A 11 6.421 -11.401 3.446 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.075 -13.899 3.844 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.825 -12.846 5.222 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.683 -13.065 1.627 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.475 -11.528 1.205 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.453 -12.914 1.743 1.00 0.00 H new ATOM 0 HD11 ILE A 11 6.036 -14.561 5.093 1.00 0.00 H new ATOM 0 HD12 ILE A 11 5.357 -12.933 4.857 1.00 0.00 H new ATOM 0 HD13 ILE A 11 5.611 -14.002 3.458 1.00 0.00 H new ATOM 157 N ALA A 12 7.706 -9.046 2.441 1.00 0.00 N ATOM 158 CA ALA A 12 7.811 -7.971 1.417 1.00 0.00 C ATOM 159 C ALA A 12 9.034 -7.107 1.720 1.00 0.00 C ATOM 160 O ALA A 12 9.770 -6.719 0.836 1.00 0.00 O ATOM 161 CB ALA A 12 6.524 -7.158 1.555 1.00 0.00 C ATOM 0 H ALA A 12 6.847 -9.042 2.990 1.00 0.00 H new ATOM 0 HA ALA A 12 7.927 -8.360 0.405 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.528 -6.344 0.830 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.665 -7.803 1.371 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.460 -6.746 2.562 1.00 0.00 H new ATOM 167 N SER A 13 9.262 -6.815 2.972 1.00 0.00 N ATOM 168 CA SER A 13 10.446 -5.994 3.340 1.00 0.00 C ATOM 169 C SER A 13 11.720 -6.786 3.047 1.00 0.00 C ATOM 170 O SER A 13 12.690 -6.258 2.543 1.00 0.00 O ATOM 171 CB SER A 13 10.303 -5.732 4.839 1.00 0.00 C ATOM 172 OG SER A 13 9.125 -4.974 5.073 1.00 0.00 O ATOM 0 H SER A 13 8.678 -7.111 3.754 1.00 0.00 H new ATOM 0 HA SER A 13 10.504 -5.062 2.778 1.00 0.00 H new ATOM 0 HB2 SER A 13 10.256 -6.676 5.382 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.175 -5.194 5.211 1.00 0.00 H new ATOM 0 HG SER A 13 8.391 -5.577 5.315 1.00 0.00 H new ATOM 178 N PHE A 14 11.718 -8.057 3.351 1.00 0.00 N ATOM 179 CA PHE A 14 12.925 -8.886 3.078 1.00 0.00 C ATOM 180 C PHE A 14 13.115 -9.032 1.569 1.00 0.00 C ATOM 181 O PHE A 14 14.213 -8.917 1.059 1.00 0.00 O ATOM 182 CB PHE A 14 12.633 -10.242 3.720 1.00 0.00 C ATOM 183 CG PHE A 14 13.351 -10.333 5.046 1.00 0.00 C ATOM 184 CD1 PHE A 14 14.749 -10.376 5.082 1.00 0.00 C ATOM 185 CD2 PHE A 14 12.618 -10.373 6.237 1.00 0.00 C ATOM 186 CE1 PHE A 14 15.415 -10.460 6.311 1.00 0.00 C ATOM 187 CE2 PHE A 14 13.284 -10.457 7.466 1.00 0.00 C ATOM 188 CZ PHE A 14 14.683 -10.500 7.503 1.00 0.00 C ATOM 0 H PHE A 14 10.935 -8.554 3.775 1.00 0.00 H new ATOM 0 HA PHE A 14 13.837 -8.443 3.478 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.560 -10.364 3.866 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.959 -11.047 3.061 1.00 0.00 H new ATOM 0 HD1 PHE A 14 15.314 -10.344 4.162 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.539 -10.339 6.209 1.00 0.00 H new ATOM 0 HE1 PHE A 14 16.494 -10.494 6.339 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.718 -10.489 8.386 1.00 0.00 H new ATOM 0 HZ PHE A 14 15.197 -10.564 8.451 1.00 0.00 H new ATOM 198 N ARG A 15 12.055 -9.270 0.846 1.00 0.00 N ATOM 199 CA ARG A 15 12.187 -9.403 -0.632 1.00 0.00 C ATOM 200 C ARG A 15 12.907 -8.173 -1.183 1.00 0.00 C ATOM 201 O ARG A 15 13.763 -8.272 -2.041 1.00 0.00 O ATOM 202 CB ARG A 15 10.753 -9.475 -1.160 1.00 0.00 C ATOM 203 CG ARG A 15 10.761 -10.029 -2.586 1.00 0.00 C ATOM 204 CD ARG A 15 9.638 -11.058 -2.743 1.00 0.00 C ATOM 205 NE ARG A 15 8.406 -10.250 -2.959 1.00 0.00 N ATOM 206 CZ ARG A 15 7.256 -10.843 -3.140 1.00 0.00 C ATOM 207 NH1 ARG A 15 7.179 -12.147 -3.133 1.00 0.00 N ATOM 208 NH2 ARG A 15 6.179 -10.129 -3.328 1.00 0.00 N ATOM 0 H ARG A 15 11.109 -9.378 1.212 1.00 0.00 H new ATOM 0 HA ARG A 15 12.762 -10.280 -0.929 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.148 -10.112 -0.515 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.299 -8.484 -1.146 1.00 0.00 H new ATOM 0 HG2 ARG A 15 10.628 -9.219 -3.303 1.00 0.00 H new ATOM 0 HG3 ARG A 15 11.724 -10.491 -2.802 1.00 0.00 H new ATOM 0 HD2 ARG A 15 9.827 -11.724 -3.585 1.00 0.00 H new ATOM 0 HD3 ARG A 15 9.549 -11.684 -1.855 1.00 0.00 H new ATOM 0 HE ARG A 15 8.460 -9.231 -2.966 1.00 0.00 H new ATOM 0 HH11 ARG A 15 8.019 -12.707 -2.986 1.00 0.00 H new ATOM 0 HH12 ARG A 15 6.279 -12.606 -3.275 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.237 -9.111 -3.333 1.00 0.00 H new ATOM 0 HH22 ARG A 15 5.280 -10.590 -3.470 1.00 0.00 H new ATOM 222 N ILE A 16 12.576 -7.013 -0.681 1.00 0.00 N ATOM 223 CA ILE A 16 13.252 -5.775 -1.159 1.00 0.00 C ATOM 224 C ILE A 16 14.756 -5.880 -0.896 1.00 0.00 C ATOM 225 O ILE A 16 15.568 -5.571 -1.745 1.00 0.00 O ATOM 226 CB ILE A 16 12.638 -4.642 -0.335 1.00 0.00 C ATOM 227 CG1 ILE A 16 11.239 -4.322 -0.869 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.519 -3.396 -0.443 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.470 -3.501 0.169 1.00 0.00 C ATOM 0 H ILE A 16 11.867 -6.871 0.039 1.00 0.00 H new ATOM 0 HA ILE A 16 13.120 -5.610 -2.228 1.00 0.00 H new ATOM 0 HB ILE A 16 12.569 -4.950 0.708 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.314 -3.767 -1.804 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.702 -5.245 -1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.081 -2.589 0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.516 -3.621 -0.064 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.589 -3.089 -1.487 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.474 -3.274 -0.212 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.383 -4.072 1.093 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.004 -2.571 0.366 1.00 0.00 H new ATOM 241 N LEU A 17 15.133 -6.325 0.274 1.00 0.00 N ATOM 242 CA LEU A 17 16.584 -6.461 0.588 1.00 0.00 C ATOM 243 C LEU A 17 17.210 -7.523 -0.317 1.00 0.00 C ATOM 244 O LEU A 17 18.302 -7.360 -0.824 1.00 0.00 O ATOM 245 CB LEU A 17 16.641 -6.910 2.049 1.00 0.00 C ATOM 246 CG LEU A 17 15.827 -5.949 2.915 1.00 0.00 C ATOM 247 CD1 LEU A 17 16.128 -6.216 4.391 1.00 0.00 C ATOM 248 CD2 LEU A 17 16.207 -4.507 2.570 1.00 0.00 C ATOM 0 H LEU A 17 14.499 -6.600 1.024 1.00 0.00 H new ATOM 0 HA LEU A 17 17.130 -5.531 0.430 1.00 0.00 H new ATOM 0 HB2 LEU A 17 16.248 -7.922 2.144 1.00 0.00 H new ATOM 0 HB3 LEU A 17 17.675 -6.936 2.391 1.00 0.00 H new ATOM 0 HG LEU A 17 14.764 -6.100 2.727 1.00 0.00 H new ATOM 0 HD11 LEU A 17 15.548 -5.531 5.010 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.860 -7.243 4.637 1.00 0.00 H new ATOM 0 HD13 LEU A 17 17.191 -6.064 4.579 1.00 0.00 H new ATOM 0 HD21 LEU A 17 15.627 -3.820 3.187 1.00 0.00 H new ATOM 0 HD22 LEU A 17 17.270 -4.356 2.759 1.00 0.00 H new ATOM 0 HD23 LEU A 17 15.995 -4.317 1.518 1.00 0.00 H new ATOM 260 N ALA A 18 16.521 -8.613 -0.525 1.00 0.00 N ATOM 261 CA ALA A 18 17.070 -9.687 -1.401 1.00 0.00 C ATOM 262 C ALA A 18 17.006 -9.253 -2.867 1.00 0.00 C ATOM 263 O ALA A 18 17.426 -9.968 -3.755 1.00 0.00 O ATOM 264 CB ALA A 18 16.168 -10.897 -1.158 1.00 0.00 C ATOM 0 H ALA A 18 15.602 -8.806 -0.126 1.00 0.00 H new ATOM 0 HA ALA A 18 18.114 -9.909 -1.180 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.508 -11.733 -1.769 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.210 -11.177 -0.105 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.142 -10.645 -1.426 1.00 0.00 H new ATOM 270 N SER A 19 16.483 -8.085 -3.129 1.00 0.00 N ATOM 271 CA SER A 19 16.391 -7.603 -4.538 1.00 0.00 C ATOM 272 C SER A 19 15.382 -8.446 -5.322 1.00 0.00 C ATOM 273 O SER A 19 15.732 -9.144 -6.252 1.00 0.00 O ATOM 274 CB SER A 19 17.797 -7.774 -5.111 1.00 0.00 C ATOM 275 OG SER A 19 18.007 -6.812 -6.137 1.00 0.00 O ATOM 0 H SER A 19 16.115 -7.443 -2.427 1.00 0.00 H new ATOM 0 HA SER A 19 16.052 -6.569 -4.598 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.540 -7.651 -4.323 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.919 -8.781 -5.510 1.00 0.00 H new ATOM 0 HG SER A 19 18.909 -6.918 -6.505 1.00 0.00 H new ATOM 281 N ASP A 20 14.132 -8.384 -4.951 1.00 0.00 N ATOM 282 CA ASP A 20 13.099 -9.180 -5.674 1.00 0.00 C ATOM 283 C ASP A 20 13.543 -10.640 -5.796 1.00 0.00 C ATOM 284 O ASP A 20 13.656 -11.176 -6.881 1.00 0.00 O ATOM 285 CB ASP A 20 12.997 -8.532 -7.056 1.00 0.00 C ATOM 286 CG ASP A 20 12.438 -7.115 -6.915 1.00 0.00 C ATOM 287 OD1 ASP A 20 11.723 -6.873 -5.957 1.00 0.00 O ATOM 288 OD2 ASP A 20 12.735 -6.295 -7.769 1.00 0.00 O ATOM 0 H ASP A 20 13.781 -7.817 -4.179 1.00 0.00 H new ATOM 0 HA ASP A 20 12.141 -9.184 -5.153 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.979 -8.502 -7.529 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.351 -9.127 -7.702 1.00 0.00 H new ATOM 293 N LYS A 21 13.793 -11.287 -4.691 1.00 0.00 N ATOM 294 CA LYS A 21 14.226 -12.712 -4.742 1.00 0.00 C ATOM 295 C LYS A 21 13.569 -13.501 -3.610 1.00 0.00 C ATOM 296 O LYS A 21 13.400 -12.999 -2.516 1.00 0.00 O ATOM 297 CB LYS A 21 15.745 -12.670 -4.564 1.00 0.00 C ATOM 298 CG LYS A 21 16.399 -12.210 -5.868 1.00 0.00 C ATOM 299 CD LYS A 21 17.758 -12.896 -6.030 1.00 0.00 C ATOM 300 CE LYS A 21 18.284 -12.657 -7.447 1.00 0.00 C ATOM 301 NZ LYS A 21 19.758 -12.842 -7.345 1.00 0.00 N ATOM 0 H LYS A 21 13.716 -10.890 -3.754 1.00 0.00 H new ATOM 0 HA LYS A 21 13.941 -13.201 -5.674 1.00 0.00 H new ATOM 0 HB2 LYS A 21 16.008 -11.991 -3.753 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.117 -13.656 -4.287 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.755 -12.451 -6.714 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.525 -11.127 -5.861 1.00 0.00 H new ATOM 0 HD2 LYS A 21 18.464 -12.505 -5.298 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.662 -13.965 -5.842 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.846 -13.360 -8.155 1.00 0.00 H new ATOM 0 HE3 LYS A 21 18.035 -11.655 -7.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 20.192 -12.694 -8.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 20.148 -12.155 -6.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 19.965 -13.807 -7.016 1.00 0.00 H new ATOM 315 N PRO A 22 13.221 -14.722 -3.913 1.00 0.00 N ATOM 316 CA PRO A 22 12.578 -15.569 -2.876 1.00 0.00 C ATOM 317 C PRO A 22 13.565 -15.852 -1.741 1.00 0.00 C ATOM 318 O PRO A 22 13.211 -16.413 -0.723 1.00 0.00 O ATOM 319 CB PRO A 22 12.210 -16.862 -3.605 1.00 0.00 C ATOM 320 CG PRO A 22 13.014 -16.853 -4.862 1.00 0.00 C ATOM 321 CD PRO A 22 13.277 -15.414 -5.206 1.00 0.00 C ATOM 0 HA PRO A 22 11.708 -15.091 -2.426 1.00 0.00 H new ATOM 0 HB2 PRO A 22 12.443 -17.736 -2.996 1.00 0.00 H new ATOM 0 HB3 PRO A 22 11.143 -16.900 -3.822 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.950 -17.394 -4.725 1.00 0.00 H new ATOM 0 HG3 PRO A 22 12.474 -17.350 -5.668 1.00 0.00 H new ATOM 0 HD2 PRO A 22 14.249 -15.289 -5.683 1.00 0.00 H new ATOM 0 HD3 PRO A 22 12.530 -15.026 -5.898 1.00 0.00 H new ATOM 329 N TYR A 23 14.803 -15.470 -1.908 1.00 0.00 N ATOM 330 CA TYR A 23 15.809 -15.721 -0.836 1.00 0.00 C ATOM 331 C TYR A 23 16.729 -14.509 -0.670 1.00 0.00 C ATOM 332 O TYR A 23 16.761 -13.622 -1.499 1.00 0.00 O ATOM 333 CB TYR A 23 16.605 -16.935 -1.315 1.00 0.00 C ATOM 334 CG TYR A 23 17.195 -16.648 -2.675 1.00 0.00 C ATOM 335 CD1 TYR A 23 18.323 -15.826 -2.790 1.00 0.00 C ATOM 336 CD2 TYR A 23 16.613 -17.203 -3.821 1.00 0.00 C ATOM 337 CE1 TYR A 23 18.870 -15.561 -4.052 1.00 0.00 C ATOM 338 CE2 TYR A 23 17.160 -16.938 -5.082 1.00 0.00 C ATOM 339 CZ TYR A 23 18.288 -16.116 -5.198 1.00 0.00 C ATOM 340 OH TYR A 23 18.827 -15.855 -6.440 1.00 0.00 O ATOM 0 H TYR A 23 15.160 -14.996 -2.738 1.00 0.00 H new ATOM 0 HA TYR A 23 15.340 -15.895 0.132 1.00 0.00 H new ATOM 0 HB2 TYR A 23 17.399 -17.166 -0.604 1.00 0.00 H new ATOM 0 HB3 TYR A 23 15.958 -17.810 -1.365 1.00 0.00 H new ATOM 0 HD1 TYR A 23 18.771 -15.397 -1.906 1.00 0.00 H new ATOM 0 HD2 TYR A 23 15.742 -17.836 -3.732 1.00 0.00 H new ATOM 0 HE1 TYR A 23 19.741 -14.928 -4.141 1.00 0.00 H new ATOM 0 HE2 TYR A 23 16.712 -17.368 -5.966 1.00 0.00 H new ATOM 0 HH TYR A 23 18.304 -16.318 -7.127 1.00 0.00 H new ATOM 350 N ILE A 24 17.476 -14.467 0.399 1.00 0.00 N ATOM 351 CA ILE A 24 18.396 -13.317 0.628 1.00 0.00 C ATOM 352 C ILE A 24 19.758 -13.828 1.118 1.00 0.00 C ATOM 353 O ILE A 24 19.840 -14.796 1.847 1.00 0.00 O ATOM 354 CB ILE A 24 17.695 -12.471 1.700 1.00 0.00 C ATOM 355 CG1 ILE A 24 18.192 -11.018 1.628 1.00 0.00 C ATOM 356 CG2 ILE A 24 17.968 -13.049 3.092 1.00 0.00 C ATOM 357 CD1 ILE A 24 19.593 -10.898 2.238 1.00 0.00 C ATOM 0 H ILE A 24 17.489 -15.182 1.126 1.00 0.00 H new ATOM 0 HA ILE A 24 18.591 -12.739 -0.275 1.00 0.00 H new ATOM 0 HB ILE A 24 16.621 -12.490 1.517 1.00 0.00 H new ATOM 0 HG12 ILE A 24 18.211 -10.685 0.590 1.00 0.00 H new ATOM 0 HG13 ILE A 24 17.500 -10.364 2.160 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.466 -12.440 3.844 1.00 0.00 H new ATOM 0 HG22 ILE A 24 17.592 -14.071 3.142 1.00 0.00 H new ATOM 0 HG23 ILE A 24 19.041 -13.048 3.282 1.00 0.00 H new ATOM 0 HD11 ILE A 24 19.928 -9.863 2.178 1.00 0.00 H new ATOM 0 HD12 ILE A 24 19.563 -11.210 3.282 1.00 0.00 H new ATOM 0 HD13 ILE A 24 20.285 -11.536 1.688 1.00 0.00 H new ATOM 369 N LEU A 25 20.825 -13.188 0.721 1.00 0.00 N ATOM 370 CA LEU A 25 22.174 -13.643 1.163 1.00 0.00 C ATOM 371 C LEU A 25 22.457 -13.146 2.582 1.00 0.00 C ATOM 372 O LEU A 25 21.970 -12.114 2.999 1.00 0.00 O ATOM 373 CB LEU A 25 23.152 -13.008 0.173 1.00 0.00 C ATOM 374 CG LEU A 25 23.063 -13.730 -1.172 1.00 0.00 C ATOM 375 CD1 LEU A 25 23.187 -12.712 -2.307 1.00 0.00 C ATOM 376 CD2 LEU A 25 24.199 -14.750 -1.277 1.00 0.00 C ATOM 0 H LEU A 25 20.821 -12.371 0.111 1.00 0.00 H new ATOM 0 HA LEU A 25 22.258 -14.730 1.180 1.00 0.00 H new ATOM 0 HB2 LEU A 25 22.920 -11.951 0.045 1.00 0.00 H new ATOM 0 HB3 LEU A 25 24.168 -13.067 0.562 1.00 0.00 H new ATOM 0 HG LEU A 25 22.104 -14.243 -1.247 1.00 0.00 H new ATOM 0 HD11 LEU A 25 23.124 -13.227 -3.266 1.00 0.00 H new ATOM 0 HD12 LEU A 25 22.380 -11.983 -2.232 1.00 0.00 H new ATOM 0 HD13 LEU A 25 24.146 -12.200 -2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 25 24.137 -15.266 -2.235 1.00 0.00 H new ATOM 0 HD22 LEU A 25 25.157 -14.236 -1.203 1.00 0.00 H new ATOM 0 HD23 LEU A 25 24.112 -15.476 -0.468 1.00 0.00 H new ATOM 388 N ALA A 26 23.239 -13.876 3.328 1.00 0.00 N ATOM 389 CA ALA A 26 23.553 -13.449 4.723 1.00 0.00 C ATOM 390 C ALA A 26 24.396 -12.173 4.711 1.00 0.00 C ATOM 391 O ALA A 26 24.137 -11.241 5.447 1.00 0.00 O ATOM 392 CB ALA A 26 24.347 -14.608 5.325 1.00 0.00 C ATOM 0 H ALA A 26 23.675 -14.750 3.033 1.00 0.00 H new ATOM 0 HA ALA A 26 22.653 -13.229 5.297 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.616 -14.369 6.354 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.739 -15.512 5.309 1.00 0.00 H new ATOM 0 HB3 ALA A 26 25.253 -14.770 4.741 1.00 0.00 H new ATOM 398 N GLU A 27 25.402 -12.119 3.883 1.00 0.00 N ATOM 399 CA GLU A 27 26.251 -10.901 3.830 1.00 0.00 C ATOM 400 C GLU A 27 25.394 -9.690 3.467 1.00 0.00 C ATOM 401 O GLU A 27 25.585 -8.606 3.983 1.00 0.00 O ATOM 402 CB GLU A 27 27.277 -11.191 2.741 1.00 0.00 C ATOM 403 CG GLU A 27 26.606 -11.129 1.369 1.00 0.00 C ATOM 404 CD GLU A 27 27.581 -11.638 0.304 1.00 0.00 C ATOM 405 OE1 GLU A 27 28.516 -12.330 0.669 1.00 0.00 O ATOM 406 OE2 GLU A 27 27.373 -11.326 -0.858 1.00 0.00 O ATOM 0 H GLU A 27 25.671 -12.866 3.242 1.00 0.00 H new ATOM 0 HA GLU A 27 26.729 -10.675 4.783 1.00 0.00 H new ATOM 0 HB2 GLU A 27 28.090 -10.466 2.792 1.00 0.00 H new ATOM 0 HB3 GLU A 27 27.718 -12.176 2.896 1.00 0.00 H new ATOM 0 HG2 GLU A 27 25.700 -11.734 1.367 1.00 0.00 H new ATOM 0 HG3 GLU A 27 26.306 -10.105 1.144 1.00 0.00 H new ATOM 413 N GLU A 28 24.438 -9.866 2.596 1.00 0.00 N ATOM 414 CA GLU A 28 23.563 -8.723 2.225 1.00 0.00 C ATOM 415 C GLU A 28 22.727 -8.326 3.440 1.00 0.00 C ATOM 416 O GLU A 28 22.449 -7.165 3.668 1.00 0.00 O ATOM 417 CB GLU A 28 22.669 -9.240 1.098 1.00 0.00 C ATOM 418 CG GLU A 28 22.408 -8.109 0.101 1.00 0.00 C ATOM 419 CD GLU A 28 21.542 -8.627 -1.049 1.00 0.00 C ATOM 420 OE1 GLU A 28 20.541 -9.266 -0.771 1.00 0.00 O ATOM 421 OE2 GLU A 28 21.894 -8.374 -2.190 1.00 0.00 O ATOM 0 H GLU A 28 24.227 -10.748 2.129 1.00 0.00 H new ATOM 0 HA GLU A 28 24.126 -7.846 1.906 1.00 0.00 H new ATOM 0 HB2 GLU A 28 23.147 -10.080 0.595 1.00 0.00 H new ATOM 0 HB3 GLU A 28 21.727 -9.606 1.505 1.00 0.00 H new ATOM 0 HG2 GLU A 28 21.908 -7.279 0.600 1.00 0.00 H new ATOM 0 HG3 GLU A 28 23.353 -7.726 -0.286 1.00 0.00 H new ATOM 428 N LEU A 29 22.348 -9.290 4.234 1.00 0.00 N ATOM 429 CA LEU A 29 21.555 -8.987 5.452 1.00 0.00 C ATOM 430 C LEU A 29 22.431 -8.195 6.423 1.00 0.00 C ATOM 431 O LEU A 29 21.990 -7.256 7.056 1.00 0.00 O ATOM 432 CB LEU A 29 21.189 -10.368 6.012 1.00 0.00 C ATOM 433 CG LEU A 29 21.044 -10.307 7.531 1.00 0.00 C ATOM 434 CD1 LEU A 29 19.968 -9.287 7.906 1.00 0.00 C ATOM 435 CD2 LEU A 29 20.643 -11.687 8.059 1.00 0.00 C ATOM 0 H LEU A 29 22.556 -10.278 4.088 1.00 0.00 H new ATOM 0 HA LEU A 29 20.664 -8.386 5.268 1.00 0.00 H new ATOM 0 HB2 LEU A 29 20.257 -10.713 5.565 1.00 0.00 H new ATOM 0 HB3 LEU A 29 21.958 -11.092 5.743 1.00 0.00 H new ATOM 0 HG LEU A 29 21.994 -10.007 7.973 1.00 0.00 H new ATOM 0 HD11 LEU A 29 19.867 -9.246 8.991 1.00 0.00 H new ATOM 0 HD12 LEU A 29 20.252 -8.304 7.531 1.00 0.00 H new ATOM 0 HD13 LEU A 29 19.016 -9.583 7.464 1.00 0.00 H new ATOM 0 HD21 LEU A 29 20.539 -11.646 9.143 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.693 -11.985 7.614 1.00 0.00 H new ATOM 0 HD23 LEU A 29 21.411 -12.415 7.796 1.00 0.00 H new ATOM 447 N ARG A 30 23.678 -8.563 6.527 1.00 0.00 N ATOM 448 CA ARG A 30 24.598 -7.825 7.438 1.00 0.00 C ATOM 449 C ARG A 30 24.763 -6.385 6.943 1.00 0.00 C ATOM 450 O ARG A 30 24.904 -5.460 7.718 1.00 0.00 O ATOM 451 CB ARG A 30 25.930 -8.575 7.356 1.00 0.00 C ATOM 452 CG ARG A 30 25.894 -9.787 8.290 1.00 0.00 C ATOM 453 CD ARG A 30 26.728 -10.921 7.686 1.00 0.00 C ATOM 454 NE ARG A 30 27.652 -11.345 8.776 1.00 0.00 N ATOM 455 CZ ARG A 30 28.631 -10.564 9.146 1.00 0.00 C ATOM 456 NH1 ARG A 30 28.801 -9.406 8.570 1.00 0.00 N ATOM 457 NH2 ARG A 30 29.442 -10.943 10.097 1.00 0.00 N ATOM 0 H ARG A 30 24.100 -9.342 6.021 1.00 0.00 H new ATOM 0 HA ARG A 30 24.225 -7.778 8.461 1.00 0.00 H new ATOM 0 HB2 ARG A 30 26.115 -8.898 6.331 1.00 0.00 H new ATOM 0 HB3 ARG A 30 26.750 -7.913 7.634 1.00 0.00 H new ATOM 0 HG2 ARG A 30 26.285 -9.516 9.271 1.00 0.00 H new ATOM 0 HG3 ARG A 30 24.865 -10.116 8.437 1.00 0.00 H new ATOM 0 HD2 ARG A 30 26.095 -11.747 7.362 1.00 0.00 H new ATOM 0 HD3 ARG A 30 27.281 -10.581 6.810 1.00 0.00 H new ATOM 0 HE ARG A 30 27.519 -12.247 9.234 1.00 0.00 H new ATOM 0 HH11 ARG A 30 28.168 -9.108 7.828 1.00 0.00 H new ATOM 0 HH12 ARG A 30 29.567 -8.799 8.862 1.00 0.00 H new ATOM 0 HH21 ARG A 30 29.310 -11.848 10.549 1.00 0.00 H new ATOM 0 HH22 ARG A 30 30.207 -10.334 10.387 1.00 0.00 H new ATOM 471 N ARG A 31 24.748 -6.196 5.651 1.00 0.00 N ATOM 472 CA ARG A 31 24.907 -4.825 5.086 1.00 0.00 C ATOM 473 C ARG A 31 23.563 -4.090 5.050 1.00 0.00 C ATOM 474 O ARG A 31 23.486 -2.904 5.304 1.00 0.00 O ATOM 475 CB ARG A 31 25.422 -5.049 3.665 1.00 0.00 C ATOM 476 CG ARG A 31 25.887 -3.719 3.073 1.00 0.00 C ATOM 477 CD ARG A 31 27.266 -3.369 3.632 1.00 0.00 C ATOM 478 NE ARG A 31 27.143 -1.960 4.097 1.00 0.00 N ATOM 479 CZ ARG A 31 28.213 -1.235 4.278 1.00 0.00 C ATOM 480 NH1 ARG A 31 29.396 -1.745 4.062 1.00 0.00 N ATOM 481 NH2 ARG A 31 28.101 0.002 4.677 1.00 0.00 N ATOM 0 H ARG A 31 24.632 -6.936 4.959 1.00 0.00 H new ATOM 0 HA ARG A 31 25.582 -4.214 5.685 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.246 -5.762 3.674 1.00 0.00 H new ATOM 0 HB3 ARG A 31 24.635 -5.479 3.046 1.00 0.00 H new ATOM 0 HG2 ARG A 31 25.930 -3.787 1.986 1.00 0.00 H new ATOM 0 HG3 ARG A 31 25.174 -2.931 3.315 1.00 0.00 H new ATOM 0 HD2 ARG A 31 27.541 -4.033 4.451 1.00 0.00 H new ATOM 0 HD3 ARG A 31 28.038 -3.468 2.869 1.00 0.00 H new ATOM 0 HE ARG A 31 26.221 -1.561 4.274 1.00 0.00 H new ATOM 0 HH11 ARG A 31 29.485 -2.712 3.751 1.00 0.00 H new ATOM 0 HH12 ARG A 31 30.230 -1.176 4.204 1.00 0.00 H new ATOM 0 HH21 ARG A 31 27.178 0.401 4.847 1.00 0.00 H new ATOM 0 HH22 ARG A 31 28.936 0.570 4.819 1.00 0.00 H new ATOM 495 N GLU A 32 22.506 -4.781 4.718 1.00 0.00 N ATOM 496 CA GLU A 32 21.172 -4.113 4.646 1.00 0.00 C ATOM 497 C GLU A 32 20.603 -3.872 6.048 1.00 0.00 C ATOM 498 O GLU A 32 19.775 -3.005 6.248 1.00 0.00 O ATOM 499 CB GLU A 32 20.286 -5.089 3.873 1.00 0.00 C ATOM 500 CG GLU A 32 20.765 -5.174 2.424 1.00 0.00 C ATOM 501 CD GLU A 32 19.616 -4.803 1.484 1.00 0.00 C ATOM 502 OE1 GLU A 32 19.043 -3.742 1.671 1.00 0.00 O ATOM 503 OE2 GLU A 32 19.329 -5.586 0.594 1.00 0.00 O ATOM 0 H GLU A 32 22.507 -5.776 4.494 1.00 0.00 H new ATOM 0 HA GLU A 32 21.233 -3.137 4.165 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.321 -6.075 4.337 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.248 -4.758 3.905 1.00 0.00 H new ATOM 0 HG2 GLU A 32 21.608 -4.501 2.268 1.00 0.00 H new ATOM 0 HG3 GLU A 32 21.117 -6.182 2.205 1.00 0.00 H new ATOM 510 N LEU A 33 21.032 -4.630 7.019 1.00 0.00 N ATOM 511 CA LEU A 33 20.505 -4.435 8.397 1.00 0.00 C ATOM 512 C LEU A 33 21.660 -4.280 9.388 1.00 0.00 C ATOM 513 O LEU A 33 22.761 -4.726 9.133 1.00 0.00 O ATOM 514 CB LEU A 33 19.710 -5.705 8.691 1.00 0.00 C ATOM 515 CG LEU A 33 18.215 -5.422 8.533 1.00 0.00 C ATOM 516 CD1 LEU A 33 17.441 -6.742 8.531 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.733 -4.552 9.697 1.00 0.00 C ATOM 0 H LEU A 33 21.723 -5.374 6.918 1.00 0.00 H new ATOM 0 HA LEU A 33 19.892 -3.538 8.486 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.013 -6.502 8.012 1.00 0.00 H new ATOM 0 HB3 LEU A 33 19.920 -6.052 9.703 1.00 0.00 H new ATOM 0 HG LEU A 33 18.044 -4.899 7.592 1.00 0.00 H new ATOM 0 HD11 LEU A 33 16.376 -6.539 8.418 1.00 0.00 H new ATOM 0 HD12 LEU A 33 17.782 -7.362 7.702 1.00 0.00 H new ATOM 0 HD13 LEU A 33 17.613 -7.266 9.471 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.668 -4.351 9.584 1.00 0.00 H new ATOM 0 HD22 LEU A 33 17.906 -5.075 10.638 1.00 0.00 H new ATOM 0 HD23 LEU A 33 18.282 -3.610 9.699 1.00 0.00 H new ATOM 529 N PRO A 34 21.366 -3.649 10.491 1.00 0.00 N ATOM 530 CA PRO A 34 22.429 -3.453 11.512 1.00 0.00 C ATOM 531 C PRO A 34 22.961 -4.807 11.987 1.00 0.00 C ATOM 532 O PRO A 34 22.213 -5.754 12.127 1.00 0.00 O ATOM 533 CB PRO A 34 21.735 -2.716 12.658 1.00 0.00 C ATOM 534 CG PRO A 34 20.465 -2.182 12.081 1.00 0.00 C ATOM 535 CD PRO A 34 20.091 -3.074 10.932 1.00 0.00 C ATOM 0 HA PRO A 34 23.283 -2.897 11.124 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.534 -3.388 13.492 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.361 -1.910 13.042 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.676 -2.171 12.832 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.598 -1.154 11.743 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.391 -3.850 11.242 1.00 0.00 H new ATOM 0 HD3 PRO A 34 19.610 -2.512 10.132 1.00 0.00 H new ATOM 543 N PRO A 35 24.244 -4.849 12.218 1.00 0.00 N ATOM 544 CA PRO A 35 24.854 -6.124 12.684 1.00 0.00 C ATOM 545 C PRO A 35 23.953 -6.792 13.726 1.00 0.00 C ATOM 546 O PRO A 35 23.802 -7.998 13.746 1.00 0.00 O ATOM 547 CB PRO A 35 26.183 -5.705 13.312 1.00 0.00 C ATOM 548 CG PRO A 35 26.047 -4.244 13.589 1.00 0.00 C ATOM 549 CD PRO A 35 25.075 -3.697 12.583 1.00 0.00 C ATOM 0 HA PRO A 35 24.988 -6.844 11.877 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.378 -6.262 14.228 1.00 0.00 H new ATOM 0 HB3 PRO A 35 27.016 -5.901 12.637 1.00 0.00 H new ATOM 0 HG2 PRO A 35 25.688 -4.075 14.604 1.00 0.00 H new ATOM 0 HG3 PRO A 35 27.012 -3.744 13.505 1.00 0.00 H new ATOM 0 HD2 PRO A 35 24.475 -2.892 13.007 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.590 -3.287 11.714 1.00 0.00 H new ATOM 557 N ASP A 36 23.355 -6.019 14.590 1.00 0.00 N ATOM 558 CA ASP A 36 22.465 -6.613 15.627 1.00 0.00 C ATOM 559 C ASP A 36 21.269 -7.304 14.966 1.00 0.00 C ATOM 560 O ASP A 36 20.884 -8.393 15.344 1.00 0.00 O ATOM 561 CB ASP A 36 22.001 -5.429 16.475 1.00 0.00 C ATOM 562 CG ASP A 36 23.108 -5.042 17.458 1.00 0.00 C ATOM 563 OD1 ASP A 36 23.948 -4.240 17.087 1.00 0.00 O ATOM 564 OD2 ASP A 36 23.096 -5.557 18.564 1.00 0.00 O ATOM 0 H ASP A 36 23.444 -5.003 14.623 1.00 0.00 H new ATOM 0 HA ASP A 36 22.975 -7.368 16.226 1.00 0.00 H new ATOM 0 HB2 ASP A 36 21.757 -4.582 15.834 1.00 0.00 H new ATOM 0 HB3 ASP A 36 21.093 -5.690 17.018 1.00 0.00 H new ATOM 569 N GLN A 37 20.679 -6.683 13.982 1.00 0.00 N ATOM 570 CA GLN A 37 19.510 -7.312 13.303 1.00 0.00 C ATOM 571 C GLN A 37 19.966 -8.534 12.501 1.00 0.00 C ATOM 572 O GLN A 37 19.321 -9.563 12.499 1.00 0.00 O ATOM 573 CB GLN A 37 18.961 -6.233 12.371 1.00 0.00 C ATOM 574 CG GLN A 37 18.571 -4.997 13.186 1.00 0.00 C ATOM 575 CD GLN A 37 17.753 -5.422 14.407 1.00 0.00 C ATOM 576 OE1 GLN A 37 16.625 -6.057 14.234 1.00 0.00 O flip ATOM 577 NE2 GLN A 37 18.142 -5.175 15.531 1.00 0.00 N flip ATOM 0 H GLN A 37 20.954 -5.770 13.619 1.00 0.00 H new ATOM 0 HA GLN A 37 18.756 -7.656 14.011 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.710 -5.967 11.625 1.00 0.00 H new ATOM 0 HB3 GLN A 37 18.094 -6.613 11.830 1.00 0.00 H new ATOM 0 HG2 GLN A 37 19.466 -4.462 13.504 1.00 0.00 H new ATOM 0 HG3 GLN A 37 17.991 -4.310 12.569 1.00 0.00 H new ATOM 0 HE21 GLN A 37 19.023 -4.679 15.668 1.00 0.00 H new ATOM 0 HE22 GLN A 37 17.588 -5.463 16.337 1.00 0.00 H new ATOM 586 N ALA A 38 21.075 -8.427 11.819 1.00 0.00 N ATOM 587 CA ALA A 38 21.573 -9.582 11.018 1.00 0.00 C ATOM 588 C ALA A 38 21.914 -10.755 11.942 1.00 0.00 C ATOM 589 O ALA A 38 21.518 -11.880 11.706 1.00 0.00 O ATOM 590 CB ALA A 38 22.830 -9.068 10.319 1.00 0.00 C ATOM 0 H ALA A 38 21.657 -7.590 11.782 1.00 0.00 H new ATOM 0 HA ALA A 38 20.831 -9.942 10.306 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.257 -9.863 9.708 1.00 0.00 H new ATOM 0 HB2 ALA A 38 22.572 -8.220 9.684 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.559 -8.753 11.066 1.00 0.00 H new ATOM 596 N GLN A 39 22.644 -10.501 12.993 1.00 0.00 N ATOM 597 CA GLN A 39 23.007 -11.602 13.930 1.00 0.00 C ATOM 598 C GLN A 39 21.741 -12.313 14.415 1.00 0.00 C ATOM 599 O GLN A 39 21.650 -13.524 14.392 1.00 0.00 O ATOM 600 CB GLN A 39 23.717 -10.915 15.097 1.00 0.00 C ATOM 601 CG GLN A 39 24.471 -11.959 15.922 1.00 0.00 C ATOM 602 CD GLN A 39 25.878 -12.145 15.354 1.00 0.00 C ATOM 603 OE1 GLN A 39 26.509 -11.193 14.936 1.00 0.00 O ATOM 604 NE2 GLN A 39 26.401 -13.339 15.318 1.00 0.00 N ATOM 0 H GLN A 39 23.004 -9.580 13.243 1.00 0.00 H new ATOM 0 HA GLN A 39 23.639 -12.356 13.460 1.00 0.00 H new ATOM 0 HB2 GLN A 39 24.411 -10.162 14.722 1.00 0.00 H new ATOM 0 HB3 GLN A 39 22.991 -10.396 15.723 1.00 0.00 H new ATOM 0 HG2 GLN A 39 24.528 -11.642 16.963 1.00 0.00 H new ATOM 0 HG3 GLN A 39 23.933 -12.907 15.906 1.00 0.00 H new ATOM 0 HE21 GLN A 39 25.873 -14.138 15.668 1.00 0.00 H new ATOM 0 HE22 GLN A 39 27.339 -13.474 14.940 1.00 0.00 H new ATOM 613 N TYR A 40 20.763 -11.568 14.850 1.00 0.00 N ATOM 614 CA TYR A 40 19.502 -12.201 15.331 1.00 0.00 C ATOM 615 C TYR A 40 18.814 -12.932 14.176 1.00 0.00 C ATOM 616 O TYR A 40 18.406 -14.070 14.302 1.00 0.00 O ATOM 617 CB TYR A 40 18.640 -11.038 15.822 1.00 0.00 C ATOM 618 CG TYR A 40 17.884 -11.458 17.060 1.00 0.00 C ATOM 619 CD1 TYR A 40 16.692 -12.183 16.941 1.00 0.00 C ATOM 620 CD2 TYR A 40 18.374 -11.120 18.327 1.00 0.00 C ATOM 621 CE1 TYR A 40 15.991 -12.570 18.089 1.00 0.00 C ATOM 622 CE2 TYR A 40 17.674 -11.508 19.474 1.00 0.00 C ATOM 623 CZ TYR A 40 16.482 -12.232 19.356 1.00 0.00 C ATOM 624 OH TYR A 40 15.792 -12.615 20.488 1.00 0.00 O ATOM 0 H TYR A 40 20.782 -10.549 14.893 1.00 0.00 H new ATOM 0 HA TYR A 40 19.676 -12.936 16.117 1.00 0.00 H new ATOM 0 HB2 TYR A 40 19.267 -10.174 16.042 1.00 0.00 H new ATOM 0 HB3 TYR A 40 17.942 -10.735 15.042 1.00 0.00 H new ATOM 0 HD1 TYR A 40 16.314 -12.444 15.964 1.00 0.00 H new ATOM 0 HD2 TYR A 40 19.293 -10.560 18.419 1.00 0.00 H new ATOM 0 HE1 TYR A 40 15.072 -13.129 17.998 1.00 0.00 H new ATOM 0 HE2 TYR A 40 18.053 -11.249 20.451 1.00 0.00 H new ATOM 0 HH TYR A 40 16.270 -12.301 21.284 1.00 0.00 H new ATOM 634 N CYS A 41 18.684 -12.285 13.050 1.00 0.00 N ATOM 635 CA CYS A 41 18.025 -12.939 11.885 1.00 0.00 C ATOM 636 C CYS A 41 18.861 -14.125 11.396 1.00 0.00 C ATOM 637 O CYS A 41 18.357 -15.212 11.204 1.00 0.00 O ATOM 638 CB CYS A 41 17.955 -11.854 10.810 1.00 0.00 C ATOM 639 SG CYS A 41 16.957 -10.470 11.415 1.00 0.00 S ATOM 0 H CYS A 41 19.006 -11.331 12.887 1.00 0.00 H new ATOM 0 HA CYS A 41 17.039 -13.330 12.136 1.00 0.00 H new ATOM 0 HB2 CYS A 41 18.958 -11.510 10.559 1.00 0.00 H new ATOM 0 HB3 CYS A 41 17.519 -12.259 9.897 1.00 0.00 H new ATOM 0 HG CYS A 41 17.694 -9.694 12.153 1.00 0.00 H new ATOM 645 N ILE A 42 20.136 -13.922 11.193 1.00 0.00 N ATOM 646 CA ILE A 42 21.002 -15.039 10.714 1.00 0.00 C ATOM 647 C ILE A 42 20.641 -16.338 11.440 1.00 0.00 C ATOM 648 O ILE A 42 20.718 -17.415 10.885 1.00 0.00 O ATOM 649 CB ILE A 42 22.428 -14.606 11.057 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.897 -13.561 10.042 1.00 0.00 C ATOM 651 CG2 ILE A 42 23.362 -15.819 11.007 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.166 -14.239 8.697 1.00 0.00 C ATOM 0 H ILE A 42 20.614 -13.033 11.338 1.00 0.00 H new ATOM 0 HA ILE A 42 20.880 -15.231 9.648 1.00 0.00 H new ATOM 0 HB ILE A 42 22.446 -14.179 12.060 1.00 0.00 H new ATOM 0 HG12 ILE A 42 22.139 -12.786 9.925 1.00 0.00 H new ATOM 0 HG13 ILE A 42 23.802 -13.070 10.401 1.00 0.00 H new ATOM 0 HG21 ILE A 42 24.377 -15.507 11.252 1.00 0.00 H new ATOM 0 HG22 ILE A 42 23.028 -16.565 11.728 1.00 0.00 H new ATOM 0 HG23 ILE A 42 23.346 -16.249 10.006 1.00 0.00 H new ATOM 0 HD11 ILE A 42 23.500 -13.494 7.974 1.00 0.00 H new ATOM 0 HD12 ILE A 42 23.939 -14.997 8.820 1.00 0.00 H new ATOM 0 HD13 ILE A 42 22.251 -14.709 8.337 1.00 0.00 H new ATOM 664 N LYS A 43 20.244 -16.241 12.680 1.00 0.00 N ATOM 665 CA LYS A 43 19.876 -17.466 13.445 1.00 0.00 C ATOM 666 C LYS A 43 18.415 -17.836 13.182 1.00 0.00 C ATOM 667 O LYS A 43 18.065 -18.995 13.087 1.00 0.00 O ATOM 668 CB LYS A 43 20.080 -17.092 14.914 1.00 0.00 C ATOM 669 CG LYS A 43 20.812 -18.226 15.633 1.00 0.00 C ATOM 670 CD LYS A 43 21.685 -17.646 16.748 1.00 0.00 C ATOM 671 CE LYS A 43 23.060 -17.281 16.182 1.00 0.00 C ATOM 672 NZ LYS A 43 23.968 -18.364 16.651 1.00 0.00 N ATOM 0 H LYS A 43 20.159 -15.366 13.196 1.00 0.00 H new ATOM 0 HA LYS A 43 20.477 -18.329 13.157 1.00 0.00 H new ATOM 0 HB2 LYS A 43 20.655 -16.169 14.989 1.00 0.00 H new ATOM 0 HB3 LYS A 43 19.117 -16.907 15.390 1.00 0.00 H new ATOM 0 HG2 LYS A 43 20.092 -18.931 16.050 1.00 0.00 H new ATOM 0 HG3 LYS A 43 21.428 -18.781 14.926 1.00 0.00 H new ATOM 0 HD2 LYS A 43 21.209 -16.763 17.175 1.00 0.00 H new ATOM 0 HD3 LYS A 43 21.793 -18.371 17.555 1.00 0.00 H new ATOM 0 HE2 LYS A 43 23.038 -17.228 15.094 1.00 0.00 H new ATOM 0 HE3 LYS A 43 23.389 -16.306 16.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 24.931 -18.184 16.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 23.974 -18.386 17.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 23.634 -19.279 16.287 1.00 0.00 H new ATOM 686 N ARG A 44 17.559 -16.858 13.066 1.00 0.00 N ATOM 687 CA ARG A 44 16.120 -17.152 12.812 1.00 0.00 C ATOM 688 C ARG A 44 15.946 -17.794 11.434 1.00 0.00 C ATOM 689 O ARG A 44 15.737 -18.985 11.318 1.00 0.00 O ATOM 690 CB ARG A 44 15.422 -15.794 12.869 1.00 0.00 C ATOM 691 CG ARG A 44 14.994 -15.500 14.308 1.00 0.00 C ATOM 692 CD ARG A 44 13.726 -16.291 14.635 1.00 0.00 C ATOM 693 NE ARG A 44 13.991 -16.917 15.961 1.00 0.00 N ATOM 694 CZ ARG A 44 13.919 -16.200 17.051 1.00 0.00 C ATOM 695 NH1 ARG A 44 13.621 -14.931 16.985 1.00 0.00 N ATOM 696 NH2 ARG A 44 14.148 -16.754 18.210 1.00 0.00 N ATOM 0 H ARG A 44 17.794 -15.868 13.136 1.00 0.00 H new ATOM 0 HA ARG A 44 15.706 -17.851 13.539 1.00 0.00 H new ATOM 0 HB2 ARG A 44 16.093 -15.013 12.511 1.00 0.00 H new ATOM 0 HB3 ARG A 44 14.552 -15.792 12.212 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.793 -15.771 14.999 1.00 0.00 H new ATOM 0 HG3 ARG A 44 14.812 -14.433 14.434 1.00 0.00 H new ATOM 0 HD2 ARG A 44 12.853 -15.639 14.674 1.00 0.00 H new ATOM 0 HD3 ARG A 44 13.526 -17.046 13.875 1.00 0.00 H new ATOM 0 HE ARG A 44 14.229 -17.907 16.018 1.00 0.00 H new ATOM 0 HH11 ARG A 44 13.443 -14.495 16.080 1.00 0.00 H new ATOM 0 HH12 ARG A 44 13.566 -14.375 17.838 1.00 0.00 H new ATOM 0 HH21 ARG A 44 14.383 -17.745 18.264 1.00 0.00 H new ATOM 0 HH22 ARG A 44 14.092 -16.196 19.062 1.00 0.00 H new ATOM 710 N MET A 45 16.033 -17.017 10.388 1.00 0.00 N ATOM 711 CA MET A 45 15.873 -17.588 9.023 1.00 0.00 C ATOM 712 C MET A 45 16.827 -18.771 8.830 1.00 0.00 C ATOM 713 O MET A 45 18.025 -18.596 8.724 1.00 0.00 O ATOM 714 CB MET A 45 16.224 -16.445 8.071 1.00 0.00 C ATOM 715 CG MET A 45 17.524 -15.770 8.517 1.00 0.00 C ATOM 716 SD MET A 45 18.140 -14.722 7.180 1.00 0.00 S ATOM 717 CE MET A 45 16.575 -13.888 6.826 1.00 0.00 C ATOM 0 H MET A 45 16.208 -16.013 10.421 1.00 0.00 H new ATOM 0 HA MET A 45 14.866 -17.965 8.846 1.00 0.00 H new ATOM 0 HB2 MET A 45 16.333 -16.827 7.056 1.00 0.00 H new ATOM 0 HB3 MET A 45 15.414 -15.716 8.052 1.00 0.00 H new ATOM 0 HG2 MET A 45 17.349 -15.173 9.412 1.00 0.00 H new ATOM 0 HG3 MET A 45 18.268 -16.523 8.777 1.00 0.00 H new ATOM 0 HE1 MET A 45 16.775 -12.896 6.420 1.00 0.00 H new ATOM 0 HE2 MET A 45 16.009 -14.470 6.099 1.00 0.00 H new ATOM 0 HE3 MET A 45 15.997 -13.794 7.745 1.00 0.00 H new ATOM 727 N PRO A 46 16.255 -19.943 8.794 1.00 0.00 N ATOM 728 CA PRO A 46 17.099 -21.155 8.613 1.00 0.00 C ATOM 729 C PRO A 46 17.689 -21.186 7.201 1.00 0.00 C ATOM 730 O PRO A 46 17.981 -20.162 6.616 1.00 0.00 O ATOM 731 CB PRO A 46 16.138 -22.329 8.820 1.00 0.00 C ATOM 732 CG PRO A 46 14.915 -21.744 9.447 1.00 0.00 C ATOM 733 CD PRO A 46 14.855 -20.302 9.033 1.00 0.00 C ATOM 0 HA PRO A 46 17.941 -21.184 9.305 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.899 -22.812 7.872 1.00 0.00 H new ATOM 0 HB3 PRO A 46 16.582 -23.090 9.462 1.00 0.00 H new ATOM 0 HG2 PRO A 46 14.022 -22.276 9.120 1.00 0.00 H new ATOM 0 HG3 PRO A 46 14.959 -21.832 10.533 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.250 -20.169 8.136 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.411 -19.681 9.811 1.00 0.00 H new ATOM 741 N ALA A 47 17.869 -22.355 6.650 1.00 0.00 N ATOM 742 CA ALA A 47 18.440 -22.451 5.276 1.00 0.00 C ATOM 743 C ALA A 47 17.338 -22.261 4.230 1.00 0.00 C ATOM 744 O ALA A 47 16.185 -22.559 4.468 1.00 0.00 O ATOM 745 CB ALA A 47 19.026 -23.862 5.190 1.00 0.00 C ATOM 0 H ALA A 47 17.646 -23.247 7.091 1.00 0.00 H new ATOM 0 HA ALA A 47 19.192 -21.685 5.086 1.00 0.00 H new ATOM 0 HB1 ALA A 47 19.468 -24.013 4.205 1.00 0.00 H new ATOM 0 HB2 ALA A 47 19.793 -23.984 5.954 1.00 0.00 H new ATOM 0 HB3 ALA A 47 18.235 -24.595 5.349 1.00 0.00 H new ATOM 751 N TYR A 48 17.685 -21.769 3.073 1.00 0.00 N ATOM 752 CA TYR A 48 16.658 -21.560 2.012 1.00 0.00 C ATOM 753 C TYR A 48 16.144 -22.909 1.494 1.00 0.00 C ATOM 754 O TYR A 48 16.647 -23.955 1.855 1.00 0.00 O ATOM 755 CB TYR A 48 17.381 -20.781 0.904 1.00 0.00 C ATOM 756 CG TYR A 48 18.187 -21.722 0.032 1.00 0.00 C ATOM 757 CD1 TYR A 48 18.800 -22.852 0.590 1.00 0.00 C ATOM 758 CD2 TYR A 48 18.320 -21.460 -1.338 1.00 0.00 C ATOM 759 CE1 TYR A 48 19.544 -23.718 -0.221 1.00 0.00 C ATOM 760 CE2 TYR A 48 19.064 -22.325 -2.147 1.00 0.00 C ATOM 761 CZ TYR A 48 19.676 -23.454 -1.589 1.00 0.00 C ATOM 762 OH TYR A 48 20.410 -24.306 -2.388 1.00 0.00 O ATOM 0 H TYR A 48 18.635 -21.502 2.816 1.00 0.00 H new ATOM 0 HA TYR A 48 15.787 -21.018 2.380 1.00 0.00 H new ATOM 0 HB2 TYR A 48 16.654 -20.245 0.295 1.00 0.00 H new ATOM 0 HB3 TYR A 48 18.039 -20.033 1.347 1.00 0.00 H new ATOM 0 HD1 TYR A 48 18.699 -23.055 1.646 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.848 -20.590 -1.769 1.00 0.00 H new ATOM 0 HE1 TYR A 48 20.016 -24.589 0.209 1.00 0.00 H new ATOM 0 HE2 TYR A 48 19.167 -22.122 -3.203 1.00 0.00 H new ATOM 0 HH TYR A 48 20.400 -23.978 -3.311 1.00 0.00 H new ATOM 772 N SER A 49 15.149 -22.891 0.651 1.00 0.00 N ATOM 773 CA SER A 49 14.606 -24.171 0.111 1.00 0.00 C ATOM 774 C SER A 49 13.644 -23.891 -1.047 1.00 0.00 C ATOM 775 O SER A 49 12.573 -24.458 -1.129 1.00 0.00 O ATOM 776 CB SER A 49 13.863 -24.812 1.283 1.00 0.00 C ATOM 777 OG SER A 49 13.071 -23.827 1.933 1.00 0.00 O ATOM 0 H SER A 49 14.688 -22.046 0.312 1.00 0.00 H new ATOM 0 HA SER A 49 15.390 -24.821 -0.278 1.00 0.00 H new ATOM 0 HB2 SER A 49 13.231 -25.626 0.927 1.00 0.00 H new ATOM 0 HB3 SER A 49 14.574 -25.245 1.986 1.00 0.00 H new ATOM 0 HG SER A 49 12.592 -24.236 2.684 1.00 0.00 H new ATOM 783 N GLY A 50 14.018 -23.018 -1.943 1.00 0.00 N ATOM 784 CA GLY A 50 13.126 -22.704 -3.094 1.00 0.00 C ATOM 785 C GLY A 50 13.679 -23.359 -4.361 1.00 0.00 C ATOM 786 O GLY A 50 14.807 -23.809 -4.385 1.00 0.00 O ATOM 0 H GLY A 50 14.902 -22.509 -1.927 1.00 0.00 H new ATOM 0 HA2 GLY A 50 12.117 -23.066 -2.895 1.00 0.00 H new ATOM 0 HA3 GLY A 50 13.057 -21.625 -3.230 1.00 0.00 H new ATOM 790 N PRO A 51 12.859 -23.388 -5.375 1.00 0.00 N ATOM 791 CA PRO A 51 13.311 -24.006 -6.650 1.00 0.00 C ATOM 792 C PRO A 51 14.049 -22.975 -7.509 1.00 0.00 C ATOM 793 O PRO A 51 13.551 -21.897 -7.766 1.00 0.00 O ATOM 794 CB PRO A 51 12.021 -24.458 -7.338 1.00 0.00 C ATOM 795 CG PRO A 51 10.919 -23.721 -6.648 1.00 0.00 C ATOM 796 CD PRO A 51 11.397 -23.414 -5.257 1.00 0.00 C ATOM 0 HA PRO A 51 14.004 -24.832 -6.490 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.042 -24.225 -8.403 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.887 -25.536 -7.250 1.00 0.00 H new ATOM 0 HG2 PRO A 51 10.675 -22.803 -7.183 1.00 0.00 H new ATOM 0 HG3 PRO A 51 10.011 -24.324 -6.619 1.00 0.00 H new ATOM 0 HD2 PRO A 51 11.009 -22.458 -4.905 1.00 0.00 H new ATOM 0 HD3 PRO A 51 11.068 -24.173 -4.547 1.00 0.00 H new ATOM 804 N GLY A 52 15.233 -23.298 -7.954 1.00 0.00 N ATOM 805 CA GLY A 52 16.001 -22.337 -8.796 1.00 0.00 C ATOM 806 C GLY A 52 16.989 -21.564 -7.921 1.00 0.00 C ATOM 807 O GLY A 52 17.942 -20.987 -8.408 1.00 0.00 O ATOM 0 H GLY A 52 15.701 -24.185 -7.771 1.00 0.00 H new ATOM 0 HA2 GLY A 52 16.536 -22.872 -9.580 1.00 0.00 H new ATOM 0 HA3 GLY A 52 15.319 -21.645 -9.290 1.00 0.00 H new ATOM 811 N SER A 53 16.766 -21.539 -6.635 1.00 0.00 N ATOM 812 CA SER A 53 17.675 -20.805 -5.727 1.00 0.00 C ATOM 813 C SER A 53 19.123 -21.257 -5.929 1.00 0.00 C ATOM 814 O SER A 53 19.462 -21.885 -6.912 1.00 0.00 O ATOM 815 CB SER A 53 17.198 -21.159 -4.320 1.00 0.00 C ATOM 816 OG SER A 53 15.783 -21.039 -4.261 1.00 0.00 O ATOM 0 H SER A 53 15.982 -22.003 -6.176 1.00 0.00 H new ATOM 0 HA SER A 53 17.654 -19.731 -5.911 1.00 0.00 H new ATOM 0 HB2 SER A 53 17.499 -22.175 -4.066 1.00 0.00 H new ATOM 0 HB3 SER A 53 17.662 -20.497 -3.589 1.00 0.00 H new ATOM 0 HG SER A 53 15.487 -21.110 -3.329 1.00 0.00 H new ATOM 822 N VAL A 54 19.976 -20.944 -4.998 1.00 0.00 N ATOM 823 CA VAL A 54 21.406 -21.353 -5.122 1.00 0.00 C ATOM 824 C VAL A 54 22.003 -21.610 -3.735 1.00 0.00 C ATOM 825 O VAL A 54 21.419 -21.251 -2.732 1.00 0.00 O ATOM 826 CB VAL A 54 22.101 -20.171 -5.796 1.00 0.00 C ATOM 827 CG1 VAL A 54 21.668 -20.091 -7.261 1.00 0.00 C ATOM 828 CG2 VAL A 54 21.713 -18.876 -5.078 1.00 0.00 C ATOM 0 H VAL A 54 19.747 -20.421 -4.153 1.00 0.00 H new ATOM 0 HA VAL A 54 21.525 -22.273 -5.694 1.00 0.00 H new ATOM 0 HB VAL A 54 23.181 -20.307 -5.744 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.164 -19.248 -7.741 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.943 -21.013 -7.773 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.588 -19.955 -7.314 1.00 0.00 H new ATOM 0 HG21 VAL A 54 22.208 -18.032 -5.558 1.00 0.00 H new ATOM 0 HG22 VAL A 54 20.633 -18.741 -5.130 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.022 -18.932 -4.034 1.00 0.00 H new ATOM 838 N PRO A 55 23.152 -22.227 -3.730 1.00 0.00 N ATOM 839 CA PRO A 55 23.809 -22.523 -2.429 1.00 0.00 C ATOM 840 C PRO A 55 24.367 -21.238 -1.810 1.00 0.00 C ATOM 841 O PRO A 55 25.181 -20.557 -2.400 1.00 0.00 O ATOM 842 CB PRO A 55 24.942 -23.485 -2.784 1.00 0.00 C ATOM 843 CG PRO A 55 25.171 -23.303 -4.247 1.00 0.00 C ATOM 844 CD PRO A 55 23.863 -22.866 -4.845 1.00 0.00 C ATOM 0 HA PRO A 55 23.120 -22.947 -1.699 1.00 0.00 H new ATOM 0 HB2 PRO A 55 25.843 -23.259 -2.214 1.00 0.00 H new ATOM 0 HB3 PRO A 55 24.670 -24.515 -2.554 1.00 0.00 H new ATOM 0 HG2 PRO A 55 25.945 -22.557 -4.426 1.00 0.00 H new ATOM 0 HG3 PRO A 55 25.512 -24.233 -4.703 1.00 0.00 H new ATOM 0 HD2 PRO A 55 24.015 -22.171 -5.671 1.00 0.00 H new ATOM 0 HD3 PRO A 55 23.303 -23.713 -5.241 1.00 0.00 H new ATOM 852 N GLY A 56 23.936 -20.904 -0.625 1.00 0.00 N ATOM 853 CA GLY A 56 24.444 -19.666 0.030 1.00 0.00 C ATOM 854 C GLY A 56 23.281 -18.708 0.290 1.00 0.00 C ATOM 855 O GLY A 56 23.434 -17.692 0.940 1.00 0.00 O ATOM 0 H GLY A 56 23.254 -21.434 -0.082 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.939 -19.916 0.968 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.189 -19.186 -0.605 1.00 0.00 H new ATOM 859 N ALA A 57 22.118 -19.019 -0.212 1.00 0.00 N ATOM 860 CA ALA A 57 20.947 -18.123 0.008 1.00 0.00 C ATOM 861 C ALA A 57 20.218 -18.507 1.300 1.00 0.00 C ATOM 862 O ALA A 57 20.321 -19.620 1.775 1.00 0.00 O ATOM 863 CB ALA A 57 20.043 -18.345 -1.205 1.00 0.00 C ATOM 0 H ALA A 57 21.927 -19.855 -0.765 1.00 0.00 H new ATOM 0 HA ALA A 57 21.242 -17.079 0.110 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.156 -17.718 -1.117 1.00 0.00 H new ATOM 0 HB2 ALA A 57 20.584 -18.083 -2.114 1.00 0.00 H new ATOM 0 HB3 ALA A 57 19.744 -19.392 -1.249 1.00 0.00 H new ATOM 869 N LEU A 58 19.482 -17.592 1.870 1.00 0.00 N ATOM 870 CA LEU A 58 18.745 -17.901 3.129 1.00 0.00 C ATOM 871 C LEU A 58 17.267 -17.533 2.975 1.00 0.00 C ATOM 872 O LEU A 58 16.898 -16.759 2.114 1.00 0.00 O ATOM 873 CB LEU A 58 19.405 -17.032 4.200 1.00 0.00 C ATOM 874 CG LEU A 58 20.848 -17.492 4.413 1.00 0.00 C ATOM 875 CD1 LEU A 58 21.577 -16.489 5.310 1.00 0.00 C ATOM 876 CD2 LEU A 58 20.850 -18.868 5.084 1.00 0.00 C ATOM 0 H LEU A 58 19.359 -16.643 1.518 1.00 0.00 H new ATOM 0 HA LEU A 58 18.786 -18.960 3.384 1.00 0.00 H new ATOM 0 HB2 LEU A 58 19.387 -15.985 3.896 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.848 -17.102 5.134 1.00 0.00 H new ATOM 0 HG LEU A 58 21.355 -17.554 3.450 1.00 0.00 H new ATOM 0 HD11 LEU A 58 22.605 -16.817 5.462 1.00 0.00 H new ATOM 0 HD12 LEU A 58 21.575 -15.508 4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 58 21.070 -16.427 6.273 1.00 0.00 H new ATOM 0 HD21 LEU A 58 21.878 -19.197 5.236 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.343 -18.804 6.047 1.00 0.00 H new ATOM 0 HD23 LEU A 58 20.330 -19.584 4.447 1.00 0.00 H new ATOM 888 N ASP A 59 16.417 -18.081 3.799 1.00 0.00 N ATOM 889 CA ASP A 59 14.966 -17.759 3.687 1.00 0.00 C ATOM 890 C ASP A 59 14.501 -16.947 4.900 1.00 0.00 C ATOM 891 O ASP A 59 14.441 -17.445 6.007 1.00 0.00 O ATOM 892 CB ASP A 59 14.258 -19.114 3.650 1.00 0.00 C ATOM 893 CG ASP A 59 13.962 -19.494 2.198 1.00 0.00 C ATOM 894 OD1 ASP A 59 14.424 -18.789 1.316 1.00 0.00 O ATOM 895 OD2 ASP A 59 13.278 -20.483 1.993 1.00 0.00 O ATOM 0 H ASP A 59 16.663 -18.735 4.542 1.00 0.00 H new ATOM 0 HA ASP A 59 14.749 -17.159 2.803 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.883 -19.876 4.117 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.331 -19.068 4.222 1.00 0.00 H new ATOM 900 N TYR A 60 14.160 -15.704 4.696 1.00 0.00 N ATOM 901 CA TYR A 60 13.686 -14.864 5.834 1.00 0.00 C ATOM 902 C TYR A 60 12.207 -15.146 6.100 1.00 0.00 C ATOM 903 O TYR A 60 11.692 -14.872 7.166 1.00 0.00 O ATOM 904 CB TYR A 60 13.877 -13.414 5.379 1.00 0.00 C ATOM 905 CG TYR A 60 13.267 -13.224 4.011 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.878 -13.140 3.867 1.00 0.00 C ATOM 907 CD2 TYR A 60 14.096 -13.132 2.886 1.00 0.00 C ATOM 908 CE1 TYR A 60 11.317 -12.964 2.596 1.00 0.00 C ATOM 909 CE2 TYR A 60 13.535 -12.955 1.617 1.00 0.00 C ATOM 910 CZ TYR A 60 12.145 -12.871 1.471 1.00 0.00 C ATOM 911 OH TYR A 60 11.593 -12.697 0.219 1.00 0.00 O ATOM 0 H TYR A 60 14.189 -15.233 3.791 1.00 0.00 H new ATOM 0 HA TYR A 60 14.231 -15.071 6.755 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.411 -12.735 6.093 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.939 -13.168 5.351 1.00 0.00 H new ATOM 0 HD1 TYR A 60 11.239 -13.211 4.735 1.00 0.00 H new ATOM 0 HD2 TYR A 60 15.168 -13.198 2.998 1.00 0.00 H new ATOM 0 HE1 TYR A 60 10.245 -12.900 2.484 1.00 0.00 H new ATOM 0 HE2 TYR A 60 14.174 -12.883 0.749 1.00 0.00 H new ATOM 0 HH TYR A 60 12.284 -12.826 -0.464 1.00 0.00 H new ATOM 921 N ALA A 61 11.518 -15.696 5.136 1.00 0.00 N ATOM 922 CA ALA A 61 10.073 -15.999 5.332 1.00 0.00 C ATOM 923 C ALA A 61 9.893 -16.890 6.561 1.00 0.00 C ATOM 924 O ALA A 61 8.940 -16.755 7.304 1.00 0.00 O ATOM 925 CB ALA A 61 9.644 -16.738 4.064 1.00 0.00 C ATOM 0 H ALA A 61 11.894 -15.948 4.222 1.00 0.00 H new ATOM 0 HA ALA A 61 9.478 -15.101 5.495 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.587 -16.996 4.133 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.805 -16.097 3.197 1.00 0.00 H new ATOM 0 HB3 ALA A 61 10.233 -17.649 3.957 1.00 0.00 H new ATOM 931 N ALA A 62 10.804 -17.797 6.787 1.00 0.00 N ATOM 932 CA ALA A 62 10.683 -18.686 7.975 1.00 0.00 C ATOM 933 C ALA A 62 10.775 -17.856 9.252 1.00 0.00 C ATOM 934 O ALA A 62 10.130 -18.135 10.241 1.00 0.00 O ATOM 935 CB ALA A 62 11.863 -19.653 7.873 1.00 0.00 C ATOM 0 H ALA A 62 11.624 -17.960 6.202 1.00 0.00 H new ATOM 0 HA ALA A 62 9.731 -19.216 8.004 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.842 -20.343 8.717 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.793 -20.216 6.942 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.797 -19.091 7.887 1.00 0.00 H new ATOM 941 N PHE A 63 11.573 -16.830 9.227 1.00 0.00 N ATOM 942 CA PHE A 63 11.717 -15.960 10.428 1.00 0.00 C ATOM 943 C PHE A 63 10.449 -15.124 10.628 1.00 0.00 C ATOM 944 O PHE A 63 10.065 -14.817 11.738 1.00 0.00 O ATOM 945 CB PHE A 63 12.911 -15.057 10.120 1.00 0.00 C ATOM 946 CG PHE A 63 13.066 -14.035 11.220 1.00 0.00 C ATOM 947 CD1 PHE A 63 12.679 -14.352 12.528 1.00 0.00 C ATOM 948 CD2 PHE A 63 13.596 -12.772 10.933 1.00 0.00 C ATOM 949 CE1 PHE A 63 12.822 -13.406 13.549 1.00 0.00 C ATOM 950 CE2 PHE A 63 13.739 -11.825 11.955 1.00 0.00 C ATOM 951 CZ PHE A 63 13.352 -12.142 13.263 1.00 0.00 C ATOM 0 H PHE A 63 12.136 -16.553 8.423 1.00 0.00 H new ATOM 0 HA PHE A 63 11.866 -16.536 11.342 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.819 -15.654 10.033 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.765 -14.557 9.162 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.270 -15.327 12.749 1.00 0.00 H new ATOM 0 HD2 PHE A 63 13.895 -12.528 9.924 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.524 -13.651 14.558 1.00 0.00 H new ATOM 0 HE2 PHE A 63 14.148 -10.850 11.734 1.00 0.00 H new ATOM 0 HZ PHE A 63 13.462 -11.412 14.051 1.00 0.00 H new ATOM 961 N SER A 64 9.799 -14.754 9.558 1.00 0.00 N ATOM 962 CA SER A 64 8.558 -13.936 9.683 1.00 0.00 C ATOM 963 C SER A 64 7.412 -14.790 10.233 1.00 0.00 C ATOM 964 O SER A 64 6.732 -14.405 11.164 1.00 0.00 O ATOM 965 CB SER A 64 8.245 -13.474 8.261 1.00 0.00 C ATOM 966 OG SER A 64 9.463 -13.287 7.551 1.00 0.00 O ATOM 0 H SER A 64 10.073 -14.983 8.603 1.00 0.00 H new ATOM 0 HA SER A 64 8.685 -13.097 10.367 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.625 -14.213 7.754 1.00 0.00 H new ATOM 0 HB3 SER A 64 7.678 -12.544 8.285 1.00 0.00 H new ATOM 0 HG SER A 64 9.312 -12.681 6.796 1.00 0.00 H new ATOM 972 N SER A 65 7.192 -15.944 9.666 1.00 0.00 N ATOM 973 CA SER A 65 6.087 -16.818 10.158 1.00 0.00 C ATOM 974 C SER A 65 6.358 -17.256 11.599 1.00 0.00 C ATOM 975 O SER A 65 5.472 -17.274 12.430 1.00 0.00 O ATOM 976 CB SER A 65 6.092 -18.025 9.221 1.00 0.00 C ATOM 977 OG SER A 65 5.828 -17.591 7.894 1.00 0.00 O ATOM 0 H SER A 65 7.728 -16.320 8.884 1.00 0.00 H new ATOM 0 HA SER A 65 5.125 -16.306 10.159 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.057 -18.530 9.265 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.339 -18.747 9.536 1.00 0.00 H new ATOM 0 HG SER A 65 6.659 -17.273 7.483 1.00 0.00 H new ATOM 983 N ALA A 66 7.576 -17.613 11.902 1.00 0.00 N ATOM 984 CA ALA A 66 7.904 -18.053 13.289 1.00 0.00 C ATOM 985 C ALA A 66 7.856 -16.861 14.249 1.00 0.00 C ATOM 986 O ALA A 66 7.578 -17.006 15.422 1.00 0.00 O ATOM 987 CB ALA A 66 9.323 -18.614 13.203 1.00 0.00 C ATOM 0 H ALA A 66 8.359 -17.619 11.249 1.00 0.00 H new ATOM 0 HA ALA A 66 7.196 -18.792 13.665 1.00 0.00 H new ATOM 0 HB1 ALA A 66 9.638 -18.960 14.188 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.342 -19.448 12.502 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.002 -17.834 12.858 1.00 0.00 H new ATOM 993 N LEU A 67 8.127 -15.682 13.759 1.00 0.00 N ATOM 994 CA LEU A 67 8.098 -14.482 14.645 1.00 0.00 C ATOM 995 C LEU A 67 6.696 -14.282 15.225 1.00 0.00 C ATOM 996 O LEU A 67 6.533 -13.982 16.391 1.00 0.00 O ATOM 997 CB LEU A 67 8.475 -13.312 13.736 1.00 0.00 C ATOM 998 CG LEU A 67 9.981 -13.067 13.815 1.00 0.00 C ATOM 999 CD1 LEU A 67 10.407 -12.130 12.685 1.00 0.00 C ATOM 1000 CD2 LEU A 67 10.323 -12.428 15.163 1.00 0.00 C ATOM 0 H LEU A 67 8.367 -15.497 12.785 1.00 0.00 H new ATOM 0 HA LEU A 67 8.778 -14.578 15.492 1.00 0.00 H new ATOM 0 HB2 LEU A 67 8.185 -13.529 12.708 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.934 -12.415 14.037 1.00 0.00 H new ATOM 0 HG LEU A 67 10.508 -14.016 13.717 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.481 -11.956 12.742 1.00 0.00 H new ATOM 0 HD12 LEU A 67 10.164 -12.584 11.724 1.00 0.00 H new ATOM 0 HD13 LEU A 67 9.880 -11.181 12.781 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.397 -12.253 15.220 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.795 -11.479 15.260 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.021 -13.096 15.969 1.00 0.00 H new ATOM 1012 N TYR A 68 5.681 -14.448 14.421 1.00 0.00 N ATOM 1013 CA TYR A 68 4.290 -14.267 14.929 1.00 0.00 C ATOM 1014 C TYR A 68 3.670 -15.624 15.268 1.00 0.00 C ATOM 1015 O TYR A 68 2.511 -15.716 15.624 1.00 0.00 O ATOM 1016 CB TYR A 68 3.534 -13.599 13.780 1.00 0.00 C ATOM 1017 CG TYR A 68 3.724 -12.104 13.854 1.00 0.00 C ATOM 1018 CD1 TYR A 68 3.021 -11.356 14.806 1.00 0.00 C ATOM 1019 CD2 TYR A 68 4.605 -11.465 12.974 1.00 0.00 C ATOM 1020 CE1 TYR A 68 3.198 -9.969 14.877 1.00 0.00 C ATOM 1021 CE2 TYR A 68 4.782 -10.077 13.045 1.00 0.00 C ATOM 1022 CZ TYR A 68 4.079 -9.330 13.997 1.00 0.00 C ATOM 1023 OH TYR A 68 4.254 -7.963 14.068 1.00 0.00 O ATOM 0 H TYR A 68 5.754 -14.701 13.436 1.00 0.00 H new ATOM 0 HA TYR A 68 4.256 -13.669 15.840 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.898 -13.976 12.824 1.00 0.00 H new ATOM 0 HB3 TYR A 68 2.474 -13.845 13.837 1.00 0.00 H new ATOM 0 HD1 TYR A 68 2.342 -11.849 15.486 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.148 -12.042 12.240 1.00 0.00 H new ATOM 0 HE1 TYR A 68 2.655 -9.392 15.611 1.00 0.00 H new ATOM 0 HE2 TYR A 68 5.461 -9.584 12.365 1.00 0.00 H new ATOM 0 HH TYR A 68 5.163 -7.734 13.783 1.00 0.00 H new ATOM 1033 N GLY A 69 4.430 -16.679 15.161 1.00 0.00 N ATOM 1034 CA GLY A 69 3.881 -18.028 15.477 1.00 0.00 C ATOM 1035 C GLY A 69 5.009 -18.938 15.967 1.00 0.00 C ATOM 1036 O GLY A 69 6.075 -18.989 15.387 1.00 0.00 O ATOM 0 H GLY A 69 5.407 -16.665 14.869 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.107 -17.947 16.241 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.412 -18.458 14.592 1.00 0.00 H new ATOM 1040 N GLU A 70 4.781 -19.657 17.032 1.00 0.00 N ATOM 1041 CA GLU A 70 5.842 -20.564 17.559 1.00 0.00 C ATOM 1042 C GLU A 70 5.360 -22.017 17.524 1.00 0.00 C ATOM 1043 O GLU A 70 4.196 -22.300 17.728 1.00 0.00 O ATOM 1044 CB GLU A 70 6.073 -20.109 18.999 1.00 0.00 C ATOM 1045 CG GLU A 70 4.767 -20.223 19.787 1.00 0.00 C ATOM 1046 CD GLU A 70 5.077 -20.273 21.284 1.00 0.00 C ATOM 1047 OE1 GLU A 70 6.148 -19.832 21.663 1.00 0.00 O ATOM 1048 OE2 GLU A 70 4.236 -20.755 22.027 1.00 0.00 O ATOM 0 H GLU A 70 3.908 -19.656 17.560 1.00 0.00 H new ATOM 0 HA GLU A 70 6.756 -20.519 16.967 1.00 0.00 H new ATOM 0 HB2 GLU A 70 6.846 -20.720 19.465 1.00 0.00 H new ATOM 0 HB3 GLU A 70 6.430 -19.079 19.013 1.00 0.00 H new ATOM 0 HG2 GLU A 70 4.122 -19.373 19.567 1.00 0.00 H new ATOM 0 HG3 GLU A 70 4.226 -21.120 19.487 1.00 0.00 H new ATOM 1055 N SER A 71 6.246 -22.940 17.270 1.00 0.00 N ATOM 1056 CA SER A 71 5.839 -24.374 17.223 1.00 0.00 C ATOM 1057 C SER A 71 7.077 -25.274 17.224 1.00 0.00 C ATOM 1058 O SER A 71 8.170 -24.842 17.534 1.00 0.00 O ATOM 1059 CB SER A 71 5.069 -24.523 15.913 1.00 0.00 C ATOM 1060 OG SER A 71 5.902 -24.131 14.830 1.00 0.00 O ATOM 0 H SER A 71 7.235 -22.764 17.093 1.00 0.00 H new ATOM 0 HA SER A 71 5.237 -24.662 18.085 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.747 -25.556 15.783 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.169 -23.909 15.935 1.00 0.00 H new ATOM 0 HG SER A 71 5.410 -24.227 13.988 1.00 0.00 H new ATOM 1066 N ASP A 72 6.913 -26.523 16.881 1.00 0.00 N ATOM 1067 CA ASP A 72 8.082 -27.449 16.862 1.00 0.00 C ATOM 1068 C ASP A 72 8.530 -27.704 15.421 1.00 0.00 C ATOM 1069 O ASP A 72 7.804 -28.265 14.625 1.00 0.00 O ATOM 1070 CB ASP A 72 7.574 -28.742 17.501 1.00 0.00 C ATOM 1071 CG ASP A 72 6.505 -29.369 16.605 1.00 0.00 C ATOM 1072 OD1 ASP A 72 5.768 -28.621 15.983 1.00 0.00 O ATOM 1073 OD2 ASP A 72 6.442 -30.586 16.554 1.00 0.00 O ATOM 0 H ASP A 72 6.022 -26.942 16.614 1.00 0.00 H new ATOM 0 HA ASP A 72 8.941 -27.041 17.395 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.400 -29.439 17.642 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.160 -28.534 18.488 1.00 0.00 H new ATOM 1078 N LEU A 73 9.722 -27.295 15.080 1.00 0.00 N ATOM 1079 CA LEU A 73 10.216 -27.514 13.690 1.00 0.00 C ATOM 1080 C LEU A 73 11.745 -27.592 13.678 1.00 0.00 C ATOM 1081 O LEU A 73 12.325 -28.635 13.906 1.00 0.00 O ATOM 1082 CB LEU A 73 9.736 -26.296 12.902 1.00 0.00 C ATOM 1083 CG LEU A 73 9.683 -26.639 11.412 1.00 0.00 C ATOM 1084 CD1 LEU A 73 8.448 -27.496 11.128 1.00 0.00 C ATOM 1085 CD2 LEU A 73 9.604 -25.347 10.594 1.00 0.00 C ATOM 0 H LEU A 73 10.375 -26.819 15.703 1.00 0.00 H new ATOM 0 HA LEU A 73 9.847 -28.447 13.263 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.750 -25.990 13.251 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.408 -25.454 13.068 1.00 0.00 H new ATOM 0 HG LEU A 73 10.581 -27.192 11.135 1.00 0.00 H new ATOM 0 HD11 LEU A 73 8.411 -27.740 10.066 1.00 0.00 H new ATOM 0 HD12 LEU A 73 8.502 -28.416 11.710 1.00 0.00 H new ATOM 0 HD13 LEU A 73 7.550 -26.943 11.405 1.00 0.00 H new ATOM 0 HD21 LEU A 73 9.566 -25.590 9.532 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.706 -24.795 10.872 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.483 -24.735 10.795 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 13.751 5.966 0.399 1.00 0.00 N ATOM 1099 CA GLY B 7 12.378 6.030 0.973 1.00 0.00 C ATOM 1100 C GLY B 7 11.674 4.688 0.769 1.00 0.00 C ATOM 1101 O GLY B 7 10.648 4.417 1.359 1.00 0.00 O ATOM 0 HA2 GLY B 7 12.428 6.268 2.035 1.00 0.00 H new ATOM 0 HA3 GLY B 7 11.809 6.827 0.494 1.00 0.00 H new ATOM 1105 N LYS B 8 12.218 3.844 -0.066 1.00 0.00 N ATOM 1106 CA LYS B 8 11.577 2.519 -0.309 1.00 0.00 C ATOM 1107 C LYS B 8 12.343 1.419 0.432 1.00 0.00 C ATOM 1108 O LYS B 8 11.832 0.799 1.343 1.00 0.00 O ATOM 1109 CB LYS B 8 11.660 2.310 -1.820 1.00 0.00 C ATOM 1110 CG LYS B 8 10.534 1.377 -2.270 1.00 0.00 C ATOM 1111 CD LYS B 8 11.115 0.007 -2.619 1.00 0.00 C ATOM 1112 CE LYS B 8 10.171 -0.721 -3.579 1.00 0.00 C ATOM 1113 NZ LYS B 8 8.910 -0.907 -2.809 1.00 0.00 N ATOM 0 H LYS B 8 13.077 4.014 -0.589 1.00 0.00 H new ATOM 0 HA LYS B 8 10.548 2.484 0.049 1.00 0.00 H new ATOM 0 HB2 LYS B 8 11.581 3.267 -2.335 1.00 0.00 H new ATOM 0 HB3 LYS B 8 12.627 1.884 -2.086 1.00 0.00 H new ATOM 0 HG2 LYS B 8 9.791 1.278 -1.478 1.00 0.00 H new ATOM 0 HG3 LYS B 8 10.023 1.798 -3.136 1.00 0.00 H new ATOM 0 HD2 LYS B 8 12.097 0.123 -3.077 1.00 0.00 H new ATOM 0 HD3 LYS B 8 11.254 -0.582 -1.713 1.00 0.00 H new ATOM 0 HE2 LYS B 8 9.999 -0.137 -4.483 1.00 0.00 H new ATOM 0 HE3 LYS B 8 10.587 -1.678 -3.892 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 8.364 -1.691 -3.221 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 9.137 -1.127 -1.818 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 8.347 -0.034 -2.849 1.00 0.00 H new ATOM 1127 N LYS B 9 13.565 1.170 0.047 1.00 0.00 N ATOM 1128 CA LYS B 9 14.360 0.110 0.732 1.00 0.00 C ATOM 1129 C LYS B 9 14.550 0.465 2.209 1.00 0.00 C ATOM 1130 O LYS B 9 14.396 -0.366 3.082 1.00 0.00 O ATOM 1131 CB LYS B 9 15.706 0.089 0.006 1.00 0.00 C ATOM 1132 CG LYS B 9 16.361 -1.281 0.186 1.00 0.00 C ATOM 1133 CD LYS B 9 17.874 -1.155 -0.004 1.00 0.00 C ATOM 1134 CE LYS B 9 18.526 -0.766 1.325 1.00 0.00 C ATOM 1135 NZ LYS B 9 19.319 0.457 1.020 1.00 0.00 N ATOM 0 H LYS B 9 14.047 1.653 -0.711 1.00 0.00 H new ATOM 0 HA LYS B 9 13.867 -0.862 0.700 1.00 0.00 H new ATOM 0 HB2 LYS B 9 15.563 0.299 -1.054 1.00 0.00 H new ATOM 0 HB3 LYS B 9 16.356 0.870 0.401 1.00 0.00 H new ATOM 0 HG2 LYS B 9 16.140 -1.673 1.179 1.00 0.00 H new ATOM 0 HG3 LYS B 9 15.951 -1.989 -0.535 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.286 -2.099 -0.361 1.00 0.00 H new ATOM 0 HD3 LYS B 9 18.094 -0.404 -0.763 1.00 0.00 H new ATOM 0 HE2 LYS B 9 17.775 -0.569 2.091 1.00 0.00 H new ATOM 0 HE3 LYS B 9 19.163 -1.566 1.702 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 19.797 0.785 1.883 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 20.030 0.238 0.293 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 18.685 1.204 0.670 1.00 0.00 H new ATOM 1149 N ALA B 10 14.882 1.694 2.496 1.00 0.00 N ATOM 1150 CA ALA B 10 15.078 2.099 3.918 1.00 0.00 C ATOM 1151 C ALA B 10 13.828 1.764 4.733 1.00 0.00 C ATOM 1152 O ALA B 10 13.909 1.333 5.865 1.00 0.00 O ATOM 1153 CB ALA B 10 15.302 3.611 3.874 1.00 0.00 C ATOM 0 H ALA B 10 15.026 2.434 1.809 1.00 0.00 H new ATOM 0 HA ALA B 10 15.914 1.580 4.386 1.00 0.00 H new ATOM 0 HB1 ALA B 10 15.455 3.986 4.886 1.00 0.00 H new ATOM 0 HB2 ALA B 10 16.182 3.831 3.269 1.00 0.00 H new ATOM 0 HB3 ALA B 10 14.430 4.095 3.435 1.00 0.00 H new ATOM 1159 N GLU B 11 12.670 1.956 4.162 1.00 0.00 N ATOM 1160 CA GLU B 11 11.414 1.645 4.901 1.00 0.00 C ATOM 1161 C GLU B 11 11.321 0.141 5.166 1.00 0.00 C ATOM 1162 O GLU B 11 10.904 -0.288 6.224 1.00 0.00 O ATOM 1163 CB GLU B 11 10.286 2.098 3.975 1.00 0.00 C ATOM 1164 CG GLU B 11 8.939 1.818 4.644 1.00 0.00 C ATOM 1165 CD GLU B 11 8.885 2.522 6.001 1.00 0.00 C ATOM 1166 OE1 GLU B 11 8.766 3.736 6.013 1.00 0.00 O ATOM 1167 OE2 GLU B 11 8.963 1.834 7.007 1.00 0.00 O ATOM 0 H GLU B 11 12.540 2.315 3.216 1.00 0.00 H new ATOM 0 HA GLU B 11 11.368 2.143 5.869 1.00 0.00 H new ATOM 0 HB2 GLU B 11 10.383 3.162 3.758 1.00 0.00 H new ATOM 0 HB3 GLU B 11 10.348 1.572 3.023 1.00 0.00 H new ATOM 0 HG2 GLU B 11 8.126 2.168 4.008 1.00 0.00 H new ATOM 0 HG3 GLU B 11 8.802 0.744 4.774 1.00 0.00 H new ATOM 1174 N ALA B 12 11.704 -0.665 4.213 1.00 0.00 N ATOM 1175 CA ALA B 12 11.636 -2.141 4.413 1.00 0.00 C ATOM 1176 C ALA B 12 12.551 -2.555 5.566 1.00 0.00 C ATOM 1177 O ALA B 12 12.230 -3.432 6.344 1.00 0.00 O ATOM 1178 CB ALA B 12 12.125 -2.744 3.096 1.00 0.00 C ATOM 0 H ALA B 12 12.061 -0.366 3.306 1.00 0.00 H new ATOM 0 HA ALA B 12 10.631 -2.480 4.665 1.00 0.00 H new ATOM 0 HB1 ALA B 12 12.104 -3.832 3.164 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.475 -2.419 2.283 1.00 0.00 H new ATOM 0 HB3 ALA B 12 13.145 -2.412 2.900 1.00 0.00 H new ATOM 1184 N VAL B 13 13.688 -1.927 5.687 1.00 0.00 N ATOM 1185 CA VAL B 13 14.619 -2.281 6.796 1.00 0.00 C ATOM 1186 C VAL B 13 13.977 -1.936 8.142 1.00 0.00 C ATOM 1187 O VAL B 13 14.083 -2.675 9.100 1.00 0.00 O ATOM 1188 CB VAL B 13 15.863 -1.426 6.558 1.00 0.00 C ATOM 1189 CG1 VAL B 13 16.917 -1.754 7.617 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.429 -1.725 5.168 1.00 0.00 C ATOM 0 H VAL B 13 14.013 -1.185 5.067 1.00 0.00 H new ATOM 0 HA VAL B 13 14.858 -3.344 6.817 1.00 0.00 H new ATOM 0 HB VAL B 13 15.597 -0.371 6.624 1.00 0.00 H new ATOM 0 HG11 VAL B 13 17.805 -1.144 7.448 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.515 -1.543 8.608 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.183 -2.809 7.551 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.316 -1.115 4.998 1.00 0.00 H new ATOM 0 HG22 VAL B 13 16.695 -2.780 5.103 1.00 0.00 H new ATOM 0 HG23 VAL B 13 15.679 -1.493 4.412 1.00 0.00 H new ATOM 1200 N ALA B 14 13.308 -0.819 8.218 1.00 0.00 N ATOM 1201 CA ALA B 14 12.655 -0.424 9.497 1.00 0.00 C ATOM 1202 C ALA B 14 11.620 -1.476 9.905 1.00 0.00 C ATOM 1203 O ALA B 14 11.432 -1.758 11.072 1.00 0.00 O ATOM 1204 CB ALA B 14 11.973 0.912 9.197 1.00 0.00 C ATOM 0 H ALA B 14 13.185 -0.162 7.448 1.00 0.00 H new ATOM 0 HA ALA B 14 13.367 -0.342 10.318 1.00 0.00 H new ATOM 0 HB1 ALA B 14 11.467 1.272 10.093 1.00 0.00 H new ATOM 0 HB2 ALA B 14 12.721 1.641 8.886 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.244 0.777 8.398 1.00 0.00 H new ATOM 1210 N THR B 15 10.947 -2.058 8.950 1.00 0.00 N ATOM 1211 CA THR B 15 9.924 -3.091 9.279 1.00 0.00 C ATOM 1212 C THR B 15 10.600 -4.347 9.839 1.00 0.00 C ATOM 1213 O THR B 15 10.150 -4.925 10.807 1.00 0.00 O ATOM 1214 CB THR B 15 9.232 -3.401 7.951 1.00 0.00 C ATOM 1215 OG1 THR B 15 8.749 -2.194 7.378 1.00 0.00 O ATOM 1216 CG2 THR B 15 8.063 -4.357 8.192 1.00 0.00 C ATOM 0 H THR B 15 11.062 -1.863 7.955 1.00 0.00 H new ATOM 0 HA THR B 15 9.219 -2.747 10.035 1.00 0.00 H new ATOM 0 HB THR B 15 9.944 -3.868 7.271 1.00 0.00 H new ATOM 0 HG1 THR B 15 8.307 -2.390 6.526 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.571 -4.577 7.244 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.435 -5.283 8.631 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.349 -3.894 8.873 1.00 0.00 H new ATOM 1224 N VAL B 16 11.678 -4.772 9.236 1.00 0.00 N ATOM 1225 CA VAL B 16 12.380 -5.989 9.737 1.00 0.00 C ATOM 1226 C VAL B 16 12.979 -5.720 11.121 1.00 0.00 C ATOM 1227 O VAL B 16 12.906 -6.544 12.010 1.00 0.00 O ATOM 1228 CB VAL B 16 13.487 -6.258 8.718 1.00 0.00 C ATOM 1229 CG1 VAL B 16 14.348 -7.429 9.195 1.00 0.00 C ATOM 1230 CG2 VAL B 16 12.863 -6.604 7.364 1.00 0.00 C ATOM 0 H VAL B 16 12.102 -4.330 8.420 1.00 0.00 H new ATOM 0 HA VAL B 16 11.707 -6.840 9.840 1.00 0.00 H new ATOM 0 HB VAL B 16 14.108 -5.368 8.616 1.00 0.00 H new ATOM 0 HG11 VAL B 16 15.137 -7.620 8.468 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.794 -7.184 10.159 1.00 0.00 H new ATOM 0 HG13 VAL B 16 13.727 -8.319 9.299 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.653 -6.796 6.638 1.00 0.00 H new ATOM 0 HG22 VAL B 16 12.241 -7.493 7.467 1.00 0.00 H new ATOM 0 HG23 VAL B 16 12.250 -5.770 7.022 1.00 0.00 H new ATOM 1240 N VAL B 17 13.571 -4.572 11.305 1.00 0.00 N ATOM 1241 CA VAL B 17 14.175 -4.245 12.629 1.00 0.00 C ATOM 1242 C VAL B 17 13.090 -4.188 13.709 1.00 0.00 C ATOM 1243 O VAL B 17 13.230 -4.757 14.774 1.00 0.00 O ATOM 1244 CB VAL B 17 14.816 -2.871 12.441 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.293 -2.338 13.793 1.00 0.00 C ATOM 1246 CG2 VAL B 17 16.010 -2.994 11.492 1.00 0.00 C ATOM 0 H VAL B 17 13.663 -3.845 10.595 1.00 0.00 H new ATOM 0 HA VAL B 17 14.899 -4.994 12.948 1.00 0.00 H new ATOM 0 HB VAL B 17 14.083 -2.183 12.020 1.00 0.00 H new ATOM 0 HG11 VAL B 17 15.750 -1.358 13.657 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.443 -2.251 14.470 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.026 -3.024 14.217 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.469 -2.015 11.356 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.742 -3.682 11.915 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.671 -3.373 10.528 1.00 0.00 H new ATOM 1256 N ALA B 18 12.011 -3.505 13.442 1.00 0.00 N ATOM 1257 CA ALA B 18 10.920 -3.412 14.453 1.00 0.00 C ATOM 1258 C ALA B 18 10.365 -4.806 14.762 1.00 0.00 C ATOM 1259 O ALA B 18 10.081 -5.134 15.896 1.00 0.00 O ATOM 1260 CB ALA B 18 9.849 -2.540 13.801 1.00 0.00 C ATOM 0 H ALA B 18 11.838 -3.008 12.568 1.00 0.00 H new ATOM 0 HA ALA B 18 11.266 -2.992 15.397 1.00 0.00 H new ATOM 0 HB1 ALA B 18 9.009 -2.423 14.485 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.268 -1.560 13.571 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.505 -3.013 12.881 1.00 0.00 H new ATOM 1266 N ALA B 19 10.207 -5.626 13.760 1.00 0.00 N ATOM 1267 CA ALA B 19 9.671 -6.998 13.996 1.00 0.00 C ATOM 1268 C ALA B 19 10.659 -7.816 14.832 1.00 0.00 C ATOM 1269 O ALA B 19 10.273 -8.592 15.685 1.00 0.00 O ATOM 1270 CB ALA B 19 9.514 -7.608 12.603 1.00 0.00 C ATOM 0 H ALA B 19 10.425 -5.406 12.788 1.00 0.00 H new ATOM 0 HA ALA B 19 8.728 -6.984 14.543 1.00 0.00 H new ATOM 0 HB1 ALA B 19 9.123 -8.621 12.692 1.00 0.00 H new ATOM 0 HB2 ALA B 19 8.823 -7.002 12.016 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.484 -7.636 12.106 1.00 0.00 H new ATOM 1276 N VAL B 20 11.932 -7.650 14.595 1.00 0.00 N ATOM 1277 CA VAL B 20 12.943 -8.420 15.375 1.00 0.00 C ATOM 1278 C VAL B 20 12.948 -7.961 16.836 1.00 0.00 C ATOM 1279 O VAL B 20 12.993 -8.762 17.748 1.00 0.00 O ATOM 1280 CB VAL B 20 14.282 -8.101 14.708 1.00 0.00 C ATOM 1281 CG1 VAL B 20 15.423 -8.651 15.566 1.00 0.00 C ATOM 1282 CG2 VAL B 20 14.326 -8.750 13.323 1.00 0.00 C ATOM 0 H VAL B 20 12.316 -7.015 13.895 1.00 0.00 H new ATOM 0 HA VAL B 20 12.734 -9.490 15.380 1.00 0.00 H new ATOM 0 HB VAL B 20 14.392 -7.021 14.608 1.00 0.00 H new ATOM 0 HG11 VAL B 20 16.377 -8.424 15.091 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.390 -8.190 16.553 1.00 0.00 H new ATOM 0 HG13 VAL B 20 15.315 -9.731 15.666 1.00 0.00 H new ATOM 0 HG21 VAL B 20 15.279 -8.524 12.845 1.00 0.00 H new ATOM 0 HG22 VAL B 20 14.217 -9.830 13.424 1.00 0.00 H new ATOM 0 HG23 VAL B 20 13.513 -8.359 12.712 1.00 0.00 H new ATOM 1292 N ASP B 21 12.903 -6.677 17.063 1.00 0.00 N ATOM 1293 CA ASP B 21 12.906 -6.168 18.465 1.00 0.00 C ATOM 1294 C ASP B 21 11.667 -6.665 19.215 1.00 0.00 C ATOM 1295 O ASP B 21 11.717 -6.951 20.395 1.00 0.00 O ATOM 1296 CB ASP B 21 12.876 -4.645 18.333 1.00 0.00 C ATOM 1297 CG ASP B 21 13.297 -4.007 19.659 1.00 0.00 C ATOM 1298 OD1 ASP B 21 13.682 -4.743 20.553 1.00 0.00 O ATOM 1299 OD2 ASP B 21 13.229 -2.794 19.758 1.00 0.00 O ATOM 0 H ASP B 21 12.864 -5.959 16.340 1.00 0.00 H new ATOM 0 HA ASP B 21 13.775 -6.513 19.026 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.546 -4.326 17.535 1.00 0.00 H new ATOM 0 HB3 ASP B 21 11.874 -4.313 18.060 1.00 0.00 H new ATOM 1304 N GLN B 22 10.555 -6.770 18.540 1.00 0.00 N ATOM 1305 CA GLN B 22 9.315 -7.248 19.216 1.00 0.00 C ATOM 1306 C GLN B 22 9.525 -8.657 19.776 1.00 0.00 C ATOM 1307 O GLN B 22 9.241 -8.927 20.925 1.00 0.00 O ATOM 1308 CB GLN B 22 8.247 -7.259 18.122 1.00 0.00 C ATOM 1309 CG GLN B 22 6.866 -7.071 18.755 1.00 0.00 C ATOM 1310 CD GLN B 22 5.895 -6.520 17.710 1.00 0.00 C ATOM 1311 OE1 GLN B 22 6.303 -6.110 16.641 1.00 0.00 O ATOM 1312 NE2 GLN B 22 4.618 -6.495 17.973 1.00 0.00 N ATOM 0 H GLN B 22 10.451 -6.546 17.550 1.00 0.00 H new ATOM 0 HA GLN B 22 9.032 -6.613 20.056 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.440 -6.464 17.402 1.00 0.00 H new ATOM 0 HB3 GLN B 22 8.282 -8.200 17.574 1.00 0.00 H new ATOM 0 HG2 GLN B 22 6.499 -8.022 19.142 1.00 0.00 H new ATOM 0 HG3 GLN B 22 6.932 -6.387 19.601 1.00 0.00 H new ATOM 0 HE21 GLN B 22 4.275 -6.839 18.870 1.00 0.00 H new ATOM 0 HE22 GLN B 22 3.962 -6.131 17.282 1.00 0.00 H new ATOM 1321 N ALA B 23 10.020 -9.557 18.971 1.00 0.00 N ATOM 1322 CA ALA B 23 10.247 -10.947 19.460 1.00 0.00 C ATOM 1323 C ALA B 23 11.298 -10.948 20.576 1.00 0.00 C ATOM 1324 O ALA B 23 11.220 -11.717 21.512 1.00 0.00 O ATOM 1325 CB ALA B 23 10.751 -11.718 18.241 1.00 0.00 C ATOM 0 H ALA B 23 10.277 -9.391 17.998 1.00 0.00 H new ATOM 0 HA ALA B 23 9.344 -11.394 19.876 1.00 0.00 H new ATOM 0 HB1 ALA B 23 10.942 -12.754 18.519 1.00 0.00 H new ATOM 0 HB2 ALA B 23 9.998 -11.687 17.454 1.00 0.00 H new ATOM 0 HB3 ALA B 23 11.673 -11.264 17.879 1.00 0.00 H new ATOM 1331 N ARG B 24 12.277 -10.089 20.485 1.00 0.00 N ATOM 1332 CA ARG B 24 13.328 -10.041 21.544 1.00 0.00 C ATOM 1333 C ARG B 24 12.744 -9.477 22.843 1.00 0.00 C ATOM 1334 O ARG B 24 13.026 -9.961 23.922 1.00 0.00 O ATOM 1335 CB ARG B 24 14.407 -9.109 20.992 1.00 0.00 C ATOM 1336 CG ARG B 24 15.675 -9.238 21.839 1.00 0.00 C ATOM 1337 CD ARG B 24 15.660 -8.182 22.946 1.00 0.00 C ATOM 1338 NE ARG B 24 17.092 -7.853 23.189 1.00 0.00 N ATOM 1339 CZ ARG B 24 17.849 -8.674 23.867 1.00 0.00 C ATOM 1340 NH1 ARG B 24 17.359 -9.795 24.323 1.00 0.00 N ATOM 1341 NH2 ARG B 24 19.100 -8.373 24.089 1.00 0.00 N ATOM 0 H ARG B 24 12.395 -9.419 19.725 1.00 0.00 H new ATOM 0 HA ARG B 24 13.725 -11.029 21.776 1.00 0.00 H new ATOM 0 HB2 ARG B 24 14.623 -9.360 19.954 1.00 0.00 H new ATOM 0 HB3 ARG B 24 14.053 -8.078 21.003 1.00 0.00 H new ATOM 0 HG2 ARG B 24 15.734 -10.236 22.274 1.00 0.00 H new ATOM 0 HG3 ARG B 24 16.558 -9.111 21.213 1.00 0.00 H new ATOM 0 HD2 ARG B 24 15.099 -7.299 22.640 1.00 0.00 H new ATOM 0 HD3 ARG B 24 15.185 -8.565 23.849 1.00 0.00 H new ATOM 0 HE ARG B 24 17.483 -6.984 22.825 1.00 0.00 H new ATOM 0 HH11 ARG B 24 16.382 -10.032 24.150 1.00 0.00 H new ATOM 0 HH12 ARG B 24 17.953 -10.434 24.852 1.00 0.00 H new ATOM 0 HH21 ARG B 24 19.485 -7.498 23.733 1.00 0.00 H new ATOM 0 HH22 ARG B 24 19.692 -9.013 24.618 1.00 0.00 H new ATOM 1355 N VAL B 25 11.933 -8.457 22.749 1.00 0.00 N ATOM 1356 CA VAL B 25 11.333 -7.864 23.981 1.00 0.00 C ATOM 1357 C VAL B 25 10.169 -8.727 24.471 1.00 0.00 C ATOM 1358 O VAL B 25 9.790 -8.684 25.625 1.00 0.00 O ATOM 1359 CB VAL B 25 10.834 -6.483 23.553 1.00 0.00 C ATOM 1360 CG1 VAL B 25 10.186 -5.777 24.746 1.00 0.00 C ATOM 1361 CG2 VAL B 25 12.015 -5.650 23.049 1.00 0.00 C ATOM 0 H VAL B 25 11.660 -8.009 21.874 1.00 0.00 H new ATOM 0 HA VAL B 25 12.049 -7.803 24.801 1.00 0.00 H new ATOM 0 HB VAL B 25 10.098 -6.595 22.757 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.831 -4.793 24.438 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.345 -6.369 25.106 1.00 0.00 H new ATOM 0 HG13 VAL B 25 10.919 -5.665 25.545 1.00 0.00 H new ATOM 0 HG21 VAL B 25 11.662 -4.665 22.743 1.00 0.00 H new ATOM 0 HG22 VAL B 25 12.750 -5.540 23.847 1.00 0.00 H new ATOM 0 HG23 VAL B 25 12.476 -6.150 22.197 1.00 0.00 H new ATOM 1371 N ARG B 26 9.605 -9.513 23.601 1.00 0.00 N ATOM 1372 CA ARG B 26 8.467 -10.388 24.007 1.00 0.00 C ATOM 1373 C ARG B 26 7.417 -9.579 24.774 1.00 0.00 C ATOM 1374 O ARG B 26 6.796 -10.066 25.697 1.00 0.00 O ATOM 1375 CB ARG B 26 9.090 -11.450 24.913 1.00 0.00 C ATOM 1376 CG ARG B 26 8.681 -12.841 24.427 1.00 0.00 C ATOM 1377 CD ARG B 26 7.432 -13.301 25.182 1.00 0.00 C ATOM 1378 NE ARG B 26 6.865 -14.399 24.351 1.00 0.00 N ATOM 1379 CZ ARG B 26 5.619 -14.760 24.503 1.00 0.00 C ATOM 1380 NH1 ARG B 26 4.865 -14.166 25.389 1.00 0.00 N ATOM 1381 NH2 ARG B 26 5.125 -15.718 23.766 1.00 0.00 N ATOM 0 H ARG B 26 9.882 -9.590 22.622 1.00 0.00 H new ATOM 0 HA ARG B 26 7.960 -10.827 23.148 1.00 0.00 H new ATOM 0 HB2 ARG B 26 10.176 -11.356 24.907 1.00 0.00 H new ATOM 0 HB3 ARG B 26 8.763 -11.302 25.942 1.00 0.00 H new ATOM 0 HG2 ARG B 26 8.483 -12.819 23.355 1.00 0.00 H new ATOM 0 HG3 ARG B 26 9.496 -13.547 24.587 1.00 0.00 H new ATOM 0 HD2 ARG B 26 7.682 -13.652 26.183 1.00 0.00 H new ATOM 0 HD3 ARG B 26 6.718 -12.485 25.299 1.00 0.00 H new ATOM 0 HE ARG B 26 7.451 -14.870 23.662 1.00 0.00 H new ATOM 0 HH11 ARG B 26 5.249 -13.417 25.965 1.00 0.00 H new ATOM 0 HH12 ARG B 26 3.892 -14.451 25.504 1.00 0.00 H new ATOM 0 HH21 ARG B 26 5.712 -16.183 23.073 1.00 0.00 H new ATOM 0 HH22 ARG B 26 4.152 -16.002 23.883 1.00 0.00 H new ATOM 1395 N GLU B 27 7.211 -8.345 24.399 1.00 0.00 N ATOM 1396 CA GLU B 27 6.198 -7.510 25.109 1.00 0.00 C ATOM 1397 C GLU B 27 5.012 -7.216 24.185 1.00 0.00 C ATOM 1398 O GLU B 27 5.187 -6.974 23.007 1.00 0.00 O ATOM 1399 CB GLU B 27 6.933 -6.216 25.466 1.00 0.00 C ATOM 1400 CG GLU B 27 6.034 -5.348 26.349 1.00 0.00 C ATOM 1401 CD GLU B 27 6.876 -4.684 27.440 1.00 0.00 C ATOM 1402 OE1 GLU B 27 7.868 -4.060 27.099 1.00 0.00 O ATOM 1403 OE2 GLU B 27 6.515 -4.809 28.599 1.00 0.00 O ATOM 0 H GLU B 27 7.699 -7.879 23.634 1.00 0.00 H new ATOM 0 HA GLU B 27 5.797 -8.009 25.991 1.00 0.00 H new ATOM 0 HB2 GLU B 27 7.862 -6.445 25.988 1.00 0.00 H new ATOM 0 HB3 GLU B 27 7.202 -5.675 24.559 1.00 0.00 H new ATOM 0 HG2 GLU B 27 5.538 -4.588 25.745 1.00 0.00 H new ATOM 0 HG3 GLU B 27 5.251 -5.958 26.800 1.00 0.00 H new ATOM 1410 N PRO B 28 3.839 -7.246 24.758 1.00 0.00 N ATOM 1411 CA PRO B 28 2.628 -6.970 23.936 1.00 0.00 C ATOM 1412 C PRO B 28 2.359 -5.465 23.873 1.00 0.00 C ATOM 1413 O PRO B 28 2.477 -4.846 22.834 1.00 0.00 O ATOM 1414 CB PRO B 28 1.498 -7.690 24.671 1.00 0.00 C ATOM 1415 CG PRO B 28 2.170 -8.698 25.540 1.00 0.00 C ATOM 1416 CD PRO B 28 3.536 -8.162 25.864 1.00 0.00 C ATOM 0 HA PRO B 28 2.734 -7.310 22.906 1.00 0.00 H new ATOM 0 HB2 PRO B 28 0.907 -6.992 25.264 1.00 0.00 H new ATOM 0 HB3 PRO B 28 0.815 -8.169 23.969 1.00 0.00 H new ATOM 0 HG2 PRO B 28 1.596 -8.865 26.451 1.00 0.00 H new ATOM 0 HG3 PRO B 28 2.244 -9.658 25.030 1.00 0.00 H new ATOM 0 HD2 PRO B 28 3.543 -7.644 26.823 1.00 0.00 H new ATOM 0 HD3 PRO B 28 4.272 -8.963 25.930 1.00 0.00 H new ATOM 1424 N ARG B 29 1.998 -4.869 24.978 1.00 0.00 N ATOM 1425 CA ARG B 29 1.721 -3.404 24.980 1.00 0.00 C ATOM 1426 C ARG B 29 2.930 -2.635 24.443 1.00 0.00 C ATOM 1427 O ARG B 29 4.037 -3.136 24.420 1.00 0.00 O ATOM 1428 CB ARG B 29 1.471 -3.051 26.447 1.00 0.00 C ATOM 1429 CG ARG B 29 2.542 -3.708 27.319 1.00 0.00 C ATOM 1430 CD ARG B 29 1.895 -4.780 28.198 1.00 0.00 C ATOM 1431 NE ARG B 29 2.356 -4.474 29.581 1.00 0.00 N ATOM 1432 CZ ARG B 29 1.835 -5.102 30.601 1.00 0.00 C ATOM 1433 NH1 ARG B 29 0.900 -5.995 30.414 1.00 0.00 N ATOM 1434 NH2 ARG B 29 2.248 -4.836 31.810 1.00 0.00 N ATOM 0 H ARG B 29 1.883 -5.334 25.879 1.00 0.00 H new ATOM 0 HA ARG B 29 0.873 -3.144 24.347 1.00 0.00 H new ATOM 0 HB2 ARG B 29 1.491 -1.969 26.580 1.00 0.00 H new ATOM 0 HB3 ARG B 29 0.481 -3.391 26.750 1.00 0.00 H new ATOM 0 HG2 ARG B 29 3.314 -4.154 26.692 1.00 0.00 H new ATOM 0 HG3 ARG B 29 3.030 -2.958 27.941 1.00 0.00 H new ATOM 0 HD2 ARG B 29 0.808 -4.745 28.127 1.00 0.00 H new ATOM 0 HD3 ARG B 29 2.202 -5.780 27.892 1.00 0.00 H new ATOM 0 HE ARG B 29 3.081 -3.772 29.732 1.00 0.00 H new ATOM 0 HH11 ARG B 29 0.575 -6.203 29.470 1.00 0.00 H new ATOM 0 HH12 ARG B 29 0.495 -6.484 31.212 1.00 0.00 H new ATOM 0 HH21 ARG B 29 2.977 -4.138 31.958 1.00 0.00 H new ATOM 0 HH22 ARG B 29 1.842 -5.326 32.607 1.00 0.00 H new TER 1448 ARG B 29