USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 1106 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 57 HIS : no HD1:sc= -0.012 X(o=-0.012,f=-0.1) USER MOD Set 1.2: A 119 SER OG : rot 170:sc= 0 USER MOD Set 2.1: A 42 GLN : amide:sc= 0.307 K(o=0.31,f=-1.2) USER MOD Set 2.2: A 43 ASN : amide:sc= 0 K(o=0.31,f=-1.3!) USER MOD Set 3.1: A 32 SER OG : rot -136:sc= -0.138 USER MOD Set 3.2: A 39 THR OG1 : rot 135:sc= 0.0943 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -168:sc= -0.0325 (180deg=-0.168) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -150:sc= 0.00991 (180deg=-0.431) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= -0.849 K(o=-0.85,f=0.012) USER MOD Single : A 37 ASN : amide:sc= -1.52 X(o=-1.5,f=-1.7) USER MOD Single : A 52 ASN : amide:sc= -2.69! K(o=-2.7!,f=-0.064) USER MOD Single : A 56 GLN : amide:sc= -0.284 K(o=-0.28,f=-2.3!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot -40:sc= -4.55! USER MOD Single : A 71 ASN : amide:sc= -2.97! K(o=-3!,f=-0.32) USER MOD Single : A 80 GLN : amide:sc= -3.47! C(o=-3.5!,f=-5.2!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HE2:sc= -4.88 X(o=-4.9,f=-4.6!) USER MOD Single : A 89 ASN : amide:sc= -2.57 K(o=-2.6,f=-0.61) USER MOD Single : A 95 TYR OH : rot 158:sc= 0.0309 USER MOD Single : A 97 ASN : amide:sc= -0.506 X(o=-0.51,f=-0.077) USER MOD Single : A 98 LYS NZ :NH3+ 161:sc= -0.046 (180deg=-0.165) USER MOD Single : A 103 HIS : no HD1:sc= -0.885 K(o=-0.88,f=-0.32) USER MOD Single : A 106 ASN : amide:sc= -0.0915 K(o=-0.092,f=-1.2) USER MOD Single : A 110 THR OG1 : rot -88:sc= -2.75! USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 167:sc= -0.0266 (180deg=-0.27) USER MOD Single : A 134 ASN : amide:sc= -0.0138 X(o=-0.014,f=-0.42) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -18.882 -2.051 -27.028 1.00 0.00 N ATOM 2 CA MET A 1 -17.741 -1.559 -27.846 1.00 0.00 C ATOM 3 C MET A 1 -16.403 -1.909 -27.199 1.00 0.00 C ATOM 4 O MET A 1 -15.395 -2.070 -27.886 1.00 0.00 O ATOM 5 CB MET A 1 -17.873 -0.041 -28.008 1.00 0.00 C ATOM 6 CG MET A 1 -17.803 0.425 -29.452 1.00 0.00 C ATOM 7 SD MET A 1 -18.210 2.171 -29.639 1.00 0.00 S ATOM 8 CE MET A 1 -17.256 2.586 -31.097 1.00 0.00 C ATOM 0 H1 MET A 1 -19.760 -1.983 -27.581 1.00 0.00 H new ATOM 0 H2 MET A 1 -18.716 -3.043 -26.762 1.00 0.00 H new ATOM 0 H3 MET A 1 -18.968 -1.472 -26.168 1.00 0.00 H new ATOM 0 HA MET A 1 -17.767 -2.043 -28.822 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.821 0.281 -27.577 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.082 0.447 -27.439 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.800 0.246 -29.839 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.488 -0.170 -30.055 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.404 3.638 -31.341 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.199 2.403 -30.904 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.584 1.970 -31.934 1.00 0.00 H new ATOM 18 N ASP A 2 -16.403 -2.027 -25.875 1.00 0.00 N ATOM 19 CA ASP A 2 -15.189 -2.361 -25.139 1.00 0.00 C ATOM 20 C ASP A 2 -15.395 -3.614 -24.293 1.00 0.00 C ATOM 21 O ASP A 2 -16.455 -3.807 -23.700 1.00 0.00 O ATOM 22 CB ASP A 2 -14.771 -1.194 -24.244 1.00 0.00 C ATOM 23 CG ASP A 2 -13.446 -1.443 -23.551 1.00 0.00 C ATOM 24 OD1 ASP A 2 -12.624 -2.206 -24.100 1.00 0.00 O ATOM 25 OD2 ASP A 2 -13.232 -0.876 -22.459 1.00 0.00 O ATOM 0 H ASP A 2 -17.229 -1.897 -25.291 1.00 0.00 H new ATOM 0 HA ASP A 2 -14.398 -2.556 -25.863 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -14.699 -0.287 -24.844 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -15.543 -1.020 -23.494 1.00 0.00 H new ATOM 30 N ASP A 3 -14.373 -4.463 -24.243 1.00 0.00 N ATOM 31 CA ASP A 3 -14.445 -5.696 -23.468 1.00 0.00 C ATOM 32 C ASP A 3 -14.477 -5.397 -21.971 1.00 0.00 C ATOM 33 O ASP A 3 -13.995 -4.356 -21.526 1.00 0.00 O ATOM 34 CB ASP A 3 -13.255 -6.600 -23.796 1.00 0.00 C ATOM 35 CG ASP A 3 -13.405 -7.294 -25.137 1.00 0.00 C ATOM 36 OD1 ASP A 3 -13.016 -6.695 -26.161 1.00 0.00 O ATOM 37 OD2 ASP A 3 -13.910 -8.436 -25.160 1.00 0.00 O ATOM 0 H ASP A 3 -13.488 -4.320 -24.729 1.00 0.00 H new ATOM 0 HA ASP A 3 -15.367 -6.211 -23.736 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -12.341 -6.006 -23.798 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -13.146 -7.350 -23.013 1.00 0.00 H new ATOM 42 N TYR A 4 -15.050 -6.317 -21.200 1.00 0.00 N ATOM 43 CA TYR A 4 -15.149 -6.154 -19.753 1.00 0.00 C ATOM 44 C TYR A 4 -13.767 -5.988 -19.125 1.00 0.00 C ATOM 45 O TYR A 4 -12.747 -6.197 -19.782 1.00 0.00 O ATOM 46 CB TYR A 4 -15.863 -7.359 -19.134 1.00 0.00 C ATOM 47 CG TYR A 4 -17.142 -7.006 -18.404 1.00 0.00 C ATOM 48 CD1 TYR A 4 -17.179 -5.970 -17.479 1.00 0.00 C ATOM 49 CD2 TYR A 4 -18.312 -7.716 -18.640 1.00 0.00 C ATOM 50 CE1 TYR A 4 -18.344 -5.652 -16.810 1.00 0.00 C ATOM 51 CE2 TYR A 4 -19.482 -7.404 -17.974 1.00 0.00 C ATOM 52 CZ TYR A 4 -19.494 -6.372 -17.061 1.00 0.00 C ATOM 53 OH TYR A 4 -20.656 -6.060 -16.395 1.00 0.00 O ATOM 0 H TYR A 4 -15.453 -7.184 -21.554 1.00 0.00 H new ATOM 0 HA TYR A 4 -15.727 -5.252 -19.552 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -16.092 -8.077 -19.921 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -15.184 -7.854 -18.439 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -16.281 -5.404 -17.280 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -18.307 -8.525 -19.356 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -18.355 -4.844 -16.094 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -20.383 -7.967 -18.168 1.00 0.00 H new ATOM 0 HH TYR A 4 -21.372 -6.661 -16.688 1.00 0.00 H new ATOM 63 N GLU A 5 -13.741 -5.615 -17.849 1.00 0.00 N ATOM 64 CA GLU A 5 -12.488 -5.427 -17.133 1.00 0.00 C ATOM 65 C GLU A 5 -11.815 -6.764 -16.862 1.00 0.00 C ATOM 66 O GLU A 5 -12.164 -7.470 -15.916 1.00 0.00 O ATOM 67 CB GLU A 5 -12.731 -4.689 -15.816 1.00 0.00 C ATOM 68 CG GLU A 5 -13.234 -3.268 -16.002 1.00 0.00 C ATOM 69 CD GLU A 5 -13.633 -2.616 -14.693 1.00 0.00 C ATOM 70 OE1 GLU A 5 -12.737 -2.108 -13.986 1.00 0.00 O ATOM 71 OE2 GLU A 5 -14.840 -2.615 -14.375 1.00 0.00 O ATOM 0 H GLU A 5 -14.576 -5.437 -17.291 1.00 0.00 H new ATOM 0 HA GLU A 5 -11.828 -4.826 -17.759 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -13.456 -5.248 -15.224 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -11.803 -4.666 -15.245 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -12.457 -2.671 -16.479 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -14.090 -3.275 -16.676 1.00 0.00 H new ATOM 78 N LYS A 6 -10.847 -7.104 -17.702 1.00 0.00 N ATOM 79 CA LYS A 6 -10.116 -8.354 -17.568 1.00 0.00 C ATOM 80 C LYS A 6 -9.324 -8.388 -16.261 1.00 0.00 C ATOM 81 O LYS A 6 -8.744 -7.383 -15.850 1.00 0.00 O ATOM 82 CB LYS A 6 -9.179 -8.534 -18.763 1.00 0.00 C ATOM 83 CG LYS A 6 -9.254 -9.915 -19.394 1.00 0.00 C ATOM 84 CD LYS A 6 -9.295 -9.833 -20.910 1.00 0.00 C ATOM 85 CE LYS A 6 -10.719 -9.913 -21.435 1.00 0.00 C ATOM 86 NZ LYS A 6 -10.921 -9.048 -22.631 1.00 0.00 N ATOM 0 H LYS A 6 -10.549 -6.526 -18.488 1.00 0.00 H new ATOM 0 HA LYS A 6 -10.833 -9.175 -17.547 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.419 -7.785 -19.518 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.154 -8.346 -18.442 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.392 -10.505 -19.084 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.142 -10.434 -19.033 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.838 -8.899 -21.237 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.703 -10.644 -21.335 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -10.954 -10.946 -21.691 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.413 -9.614 -20.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -11.905 -9.131 -22.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -10.722 -8.058 -22.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -10.277 -9.350 -23.390 1.00 0.00 H new ATOM 100 N LEU A 7 -9.312 -9.547 -15.608 1.00 0.00 N ATOM 101 CA LEU A 7 -8.601 -9.710 -14.343 1.00 0.00 C ATOM 102 C LEU A 7 -7.151 -10.142 -14.572 1.00 0.00 C ATOM 103 O LEU A 7 -6.771 -11.268 -14.252 1.00 0.00 O ATOM 104 CB LEU A 7 -9.325 -10.737 -13.463 1.00 0.00 C ATOM 105 CG LEU A 7 -10.091 -10.149 -12.273 1.00 0.00 C ATOM 106 CD1 LEU A 7 -11.526 -10.657 -12.254 1.00 0.00 C ATOM 107 CD2 LEU A 7 -9.391 -10.487 -10.965 1.00 0.00 C ATOM 0 H LEU A 7 -9.787 -10.388 -15.934 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.588 -8.746 -13.835 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.024 -11.296 -14.085 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -8.592 -11.451 -13.087 1.00 0.00 H new ATOM 0 HG LEU A 7 -10.111 -9.065 -12.383 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -12.053 -10.228 -11.402 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -12.028 -10.364 -13.176 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -11.526 -11.744 -12.171 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -9.950 -10.061 -10.132 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -9.338 -11.570 -10.850 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -8.383 -10.073 -10.974 1.00 0.00 H new ATOM 119 N LEU A 8 -6.342 -9.238 -15.120 1.00 0.00 N ATOM 120 CA LEU A 8 -4.935 -9.533 -15.379 1.00 0.00 C ATOM 121 C LEU A 8 -4.060 -9.066 -14.222 1.00 0.00 C ATOM 122 O LEU A 8 -4.538 -8.414 -13.295 1.00 0.00 O ATOM 123 CB LEU A 8 -4.476 -8.869 -16.679 1.00 0.00 C ATOM 124 CG LEU A 8 -4.722 -9.690 -17.944 1.00 0.00 C ATOM 125 CD1 LEU A 8 -6.203 -9.712 -18.284 1.00 0.00 C ATOM 126 CD2 LEU A 8 -3.913 -9.132 -19.105 1.00 0.00 C ATOM 0 H LEU A 8 -6.635 -8.300 -15.392 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.833 -10.614 -15.479 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -4.986 -7.911 -16.780 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.410 -8.656 -16.604 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.398 -10.714 -17.761 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.360 -10.301 -19.188 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.759 -10.157 -17.459 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.553 -8.693 -18.449 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.100 -9.728 -19.998 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -4.207 -8.099 -19.290 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.852 -9.169 -18.860 1.00 0.00 H new ATOM 138 N GLU A 9 -2.774 -9.399 -14.285 1.00 0.00 N ATOM 139 CA GLU A 9 -1.832 -9.010 -13.243 1.00 0.00 C ATOM 140 C GLU A 9 -0.442 -9.578 -13.526 1.00 0.00 C ATOM 141 O GLU A 9 0.146 -10.263 -12.688 1.00 0.00 O ATOM 142 CB GLU A 9 -2.335 -9.468 -11.868 1.00 0.00 C ATOM 143 CG GLU A 9 -2.629 -8.314 -10.920 1.00 0.00 C ATOM 144 CD GLU A 9 -3.966 -8.459 -10.220 1.00 0.00 C ATOM 145 OE1 GLU A 9 -4.006 -9.085 -9.139 1.00 0.00 O ATOM 146 OE2 GLU A 9 -4.973 -7.947 -10.752 1.00 0.00 O ATOM 0 H GLU A 9 -2.361 -9.937 -15.047 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.757 -7.923 -13.239 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -3.240 -10.061 -11.999 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.589 -10.121 -11.415 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.837 -8.252 -10.173 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -2.615 -7.378 -11.478 1.00 0.00 H new ATOM 153 N ARG A 10 0.078 -9.283 -14.715 1.00 0.00 N ATOM 154 CA ARG A 10 1.401 -9.757 -15.115 1.00 0.00 C ATOM 155 C ARG A 10 2.413 -8.614 -15.118 1.00 0.00 C ATOM 156 O ARG A 10 2.120 -7.514 -15.588 1.00 0.00 O ATOM 157 CB ARG A 10 1.341 -10.404 -16.502 1.00 0.00 C ATOM 158 CG ARG A 10 2.420 -11.452 -16.731 1.00 0.00 C ATOM 159 CD ARG A 10 3.235 -11.151 -17.981 1.00 0.00 C ATOM 160 NE ARG A 10 4.482 -11.914 -18.026 1.00 0.00 N ATOM 161 CZ ARG A 10 5.598 -11.557 -17.391 1.00 0.00 C ATOM 162 NH1 ARG A 10 5.619 -10.466 -16.635 1.00 0.00 N ATOM 163 NH2 ARG A 10 6.693 -12.297 -17.508 1.00 0.00 N ATOM 0 H ARG A 10 -0.397 -8.718 -15.419 1.00 0.00 H new ATOM 0 HA ARG A 10 1.724 -10.503 -14.389 1.00 0.00 H new ATOM 0 HB2 ARG A 10 0.363 -10.866 -16.637 1.00 0.00 H new ATOM 0 HB3 ARG A 10 1.434 -9.627 -17.261 1.00 0.00 H new ATOM 0 HG2 ARG A 10 3.081 -11.490 -15.865 1.00 0.00 H new ATOM 0 HG3 ARG A 10 1.959 -12.435 -16.824 1.00 0.00 H new ATOM 0 HD2 ARG A 10 2.639 -11.380 -18.865 1.00 0.00 H new ATOM 0 HD3 ARG A 10 3.462 -10.085 -18.017 1.00 0.00 H new ATOM 0 HE ARG A 10 4.499 -12.772 -18.577 1.00 0.00 H new ATOM 0 HH11 ARG A 10 4.778 -9.897 -16.538 1.00 0.00 H new ATOM 0 HH12 ARG A 10 6.476 -10.197 -16.151 1.00 0.00 H new ATOM 0 HH21 ARG A 10 6.681 -13.139 -18.084 1.00 0.00 H new ATOM 0 HH22 ARG A 10 7.547 -12.024 -17.022 1.00 0.00 H new ATOM 177 N ALA A 11 3.605 -8.882 -14.592 1.00 0.00 N ATOM 178 CA ALA A 11 4.664 -7.879 -14.532 1.00 0.00 C ATOM 179 C ALA A 11 4.199 -6.627 -13.795 1.00 0.00 C ATOM 180 O ALA A 11 4.657 -5.521 -14.081 1.00 0.00 O ATOM 181 CB ALA A 11 5.136 -7.524 -15.937 1.00 0.00 C ATOM 0 H ALA A 11 3.862 -9.788 -14.200 1.00 0.00 H new ATOM 0 HA ALA A 11 5.499 -8.304 -13.976 1.00 0.00 H new ATOM 0 HB1 ALA A 11 5.926 -6.775 -15.877 1.00 0.00 H new ATOM 0 HB2 ALA A 11 5.520 -8.418 -16.428 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.300 -7.125 -16.512 1.00 0.00 H new ATOM 187 N ILE A 12 3.284 -6.804 -12.847 1.00 0.00 N ATOM 188 CA ILE A 12 2.762 -5.681 -12.079 1.00 0.00 C ATOM 189 C ILE A 12 3.344 -5.655 -10.660 1.00 0.00 C ATOM 190 O ILE A 12 4.452 -5.164 -10.450 1.00 0.00 O ATOM 191 CB ILE A 12 1.221 -5.710 -12.021 1.00 0.00 C ATOM 192 CG1 ILE A 12 0.637 -5.837 -13.433 1.00 0.00 C ATOM 193 CG2 ILE A 12 0.694 -4.461 -11.323 1.00 0.00 C ATOM 194 CD1 ILE A 12 -0.873 -5.765 -13.473 1.00 0.00 C ATOM 0 H ILE A 12 2.891 -7.710 -12.594 1.00 0.00 H new ATOM 0 HA ILE A 12 3.070 -4.770 -12.593 1.00 0.00 H new ATOM 0 HB ILE A 12 0.907 -6.580 -11.444 1.00 0.00 H new ATOM 0 HG12 ILE A 12 1.047 -5.044 -14.059 1.00 0.00 H new ATOM 0 HG13 ILE A 12 0.959 -6.784 -13.866 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -0.395 -4.495 -11.289 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.087 -4.419 -10.307 1.00 0.00 H new ATOM 0 HG23 ILE A 12 1.012 -3.575 -11.873 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -1.215 -5.862 -14.504 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.292 -6.574 -12.874 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.202 -4.807 -13.070 1.00 0.00 H new ATOM 206 N ASP A 13 2.596 -6.181 -9.692 1.00 0.00 N ATOM 207 CA ASP A 13 3.044 -6.210 -8.304 1.00 0.00 C ATOM 208 C ASP A 13 4.062 -7.323 -8.087 1.00 0.00 C ATOM 209 O ASP A 13 5.207 -7.072 -7.709 1.00 0.00 O ATOM 210 CB ASP A 13 1.849 -6.416 -7.373 1.00 0.00 C ATOM 211 CG ASP A 13 0.704 -5.474 -7.688 1.00 0.00 C ATOM 212 OD1 ASP A 13 0.853 -4.258 -7.450 1.00 0.00 O ATOM 213 OD2 ASP A 13 -0.343 -5.954 -8.172 1.00 0.00 O ATOM 0 H ASP A 13 1.676 -6.593 -9.845 1.00 0.00 H new ATOM 0 HA ASP A 13 3.519 -5.255 -8.078 1.00 0.00 H new ATOM 0 HB2 ASP A 13 1.502 -7.446 -7.454 1.00 0.00 H new ATOM 0 HB3 ASP A 13 2.166 -6.267 -6.341 1.00 0.00 H new ATOM 218 N GLN A 14 3.634 -8.554 -8.337 1.00 0.00 N ATOM 219 CA GLN A 14 4.497 -9.716 -8.182 1.00 0.00 C ATOM 220 C GLN A 14 5.473 -9.803 -9.355 1.00 0.00 C ATOM 221 O GLN A 14 5.719 -8.805 -10.031 1.00 0.00 O ATOM 222 CB GLN A 14 3.639 -10.984 -8.088 1.00 0.00 C ATOM 223 CG GLN A 14 3.588 -11.584 -6.691 1.00 0.00 C ATOM 224 CD GLN A 14 2.559 -10.911 -5.801 1.00 0.00 C ATOM 225 OE1 GLN A 14 2.826 -9.869 -5.203 1.00 0.00 O ATOM 226 NE2 GLN A 14 1.375 -11.506 -5.710 1.00 0.00 N ATOM 0 H GLN A 14 2.688 -8.773 -8.650 1.00 0.00 H new ATOM 0 HA GLN A 14 5.077 -9.620 -7.264 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.624 -10.751 -8.411 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.031 -11.729 -8.780 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.359 -12.647 -6.765 1.00 0.00 H new ATOM 0 HG3 GLN A 14 4.572 -11.502 -6.229 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.197 -12.369 -6.224 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.644 -11.100 -5.127 1.00 0.00 H new ATOM 235 N LEU A 15 6.025 -10.990 -9.601 1.00 0.00 N ATOM 236 CA LEU A 15 6.962 -11.177 -10.703 1.00 0.00 C ATOM 237 C LEU A 15 8.223 -10.341 -10.473 1.00 0.00 C ATOM 238 O LEU A 15 8.217 -9.416 -9.661 1.00 0.00 O ATOM 239 CB LEU A 15 6.298 -10.786 -12.032 1.00 0.00 C ATOM 240 CG LEU A 15 5.144 -11.690 -12.502 1.00 0.00 C ATOM 241 CD1 LEU A 15 5.500 -13.165 -12.362 1.00 0.00 C ATOM 242 CD2 LEU A 15 3.859 -11.374 -11.743 1.00 0.00 C ATOM 0 H LEU A 15 5.840 -11.831 -9.055 1.00 0.00 H new ATOM 0 HA LEU A 15 7.246 -12.228 -10.749 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.921 -9.767 -11.941 1.00 0.00 H new ATOM 0 HB3 LEU A 15 7.063 -10.775 -12.808 1.00 0.00 H new ATOM 0 HG LEU A 15 4.977 -11.485 -13.559 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.663 -13.775 -12.703 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.380 -13.386 -12.966 1.00 0.00 H new ATOM 0 HD13 LEU A 15 5.712 -13.391 -11.317 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.059 -12.026 -12.094 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.017 -11.535 -10.677 1.00 0.00 H new ATOM 0 HD23 LEU A 15 3.581 -10.334 -11.915 1.00 0.00 H new ATOM 254 N PRO A 16 9.328 -10.649 -11.179 1.00 0.00 N ATOM 255 CA PRO A 16 10.588 -9.913 -11.032 1.00 0.00 C ATOM 256 C PRO A 16 10.392 -8.399 -11.109 1.00 0.00 C ATOM 257 O PRO A 16 10.218 -7.846 -12.193 1.00 0.00 O ATOM 258 CB PRO A 16 11.443 -10.396 -12.216 1.00 0.00 C ATOM 259 CG PRO A 16 10.519 -11.188 -13.083 1.00 0.00 C ATOM 260 CD PRO A 16 9.453 -11.724 -12.171 1.00 0.00 C ATOM 0 HA PRO A 16 11.044 -10.098 -10.059 1.00 0.00 H new ATOM 0 HB2 PRO A 16 11.867 -9.554 -12.762 1.00 0.00 H new ATOM 0 HB3 PRO A 16 12.278 -11.007 -11.873 1.00 0.00 H new ATOM 0 HG2 PRO A 16 10.086 -10.563 -13.864 1.00 0.00 H new ATOM 0 HG3 PRO A 16 11.050 -11.999 -13.581 1.00 0.00 H new ATOM 0 HD2 PRO A 16 8.516 -11.902 -12.699 1.00 0.00 H new ATOM 0 HD3 PRO A 16 9.745 -12.669 -11.713 1.00 0.00 H new ATOM 268 N PRO A 17 10.426 -7.703 -9.958 1.00 0.00 N ATOM 269 CA PRO A 17 10.261 -6.247 -9.919 1.00 0.00 C ATOM 270 C PRO A 17 11.347 -5.535 -10.717 1.00 0.00 C ATOM 271 O PRO A 17 12.006 -6.148 -11.557 1.00 0.00 O ATOM 272 CB PRO A 17 10.363 -5.904 -8.427 1.00 0.00 C ATOM 273 CG PRO A 17 11.053 -7.071 -7.808 1.00 0.00 C ATOM 274 CD PRO A 17 10.638 -8.267 -8.615 1.00 0.00 C ATOM 0 HA PRO A 17 9.319 -5.927 -10.365 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.927 -4.984 -8.271 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.377 -5.751 -7.989 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.135 -6.942 -7.829 1.00 0.00 H new ATOM 0 HG3 PRO A 17 10.766 -7.186 -6.763 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.408 -9.039 -8.618 1.00 0.00 H new ATOM 0 HD3 PRO A 17 9.730 -8.724 -8.221 1.00 0.00 H new ATOM 282 N GLU A 18 11.522 -4.238 -10.463 1.00 0.00 N ATOM 283 CA GLU A 18 12.526 -3.441 -11.171 1.00 0.00 C ATOM 284 C GLU A 18 12.042 -3.080 -12.577 1.00 0.00 C ATOM 285 O GLU A 18 12.578 -2.172 -13.213 1.00 0.00 O ATOM 286 CB GLU A 18 13.864 -4.191 -11.250 1.00 0.00 C ATOM 287 CG GLU A 18 15.021 -3.447 -10.605 1.00 0.00 C ATOM 288 CD GLU A 18 15.714 -4.269 -9.534 1.00 0.00 C ATOM 289 OE1 GLU A 18 15.238 -4.262 -8.380 1.00 0.00 O ATOM 290 OE2 GLU A 18 16.731 -4.920 -9.852 1.00 0.00 O ATOM 0 H GLU A 18 10.982 -3.716 -9.773 1.00 0.00 H new ATOM 0 HA GLU A 18 12.677 -2.520 -10.608 1.00 0.00 H new ATOM 0 HB2 GLU A 18 13.755 -5.162 -10.768 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.103 -4.380 -12.297 1.00 0.00 H new ATOM 0 HG2 GLU A 18 15.745 -3.171 -11.372 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.653 -2.520 -10.166 1.00 0.00 H new ATOM 297 N VAL A 19 11.021 -3.791 -13.054 1.00 0.00 N ATOM 298 CA VAL A 19 10.462 -3.545 -14.372 1.00 0.00 C ATOM 299 C VAL A 19 9.305 -2.554 -14.289 1.00 0.00 C ATOM 300 O VAL A 19 8.340 -2.773 -13.558 1.00 0.00 O ATOM 301 CB VAL A 19 9.963 -4.855 -15.018 1.00 0.00 C ATOM 302 CG1 VAL A 19 9.421 -4.602 -16.417 1.00 0.00 C ATOM 303 CG2 VAL A 19 11.077 -5.890 -15.051 1.00 0.00 C ATOM 0 H VAL A 19 10.566 -4.545 -12.540 1.00 0.00 H new ATOM 0 HA VAL A 19 11.255 -3.125 -14.990 1.00 0.00 H new ATOM 0 HB VAL A 19 9.148 -5.245 -14.409 1.00 0.00 H new ATOM 0 HG11 VAL A 19 9.076 -5.541 -16.849 1.00 0.00 H new ATOM 0 HG12 VAL A 19 8.589 -3.900 -16.363 1.00 0.00 H new ATOM 0 HG13 VAL A 19 10.209 -4.183 -17.042 1.00 0.00 H new ATOM 0 HG21 VAL A 19 10.708 -6.807 -15.510 1.00 0.00 H new ATOM 0 HG22 VAL A 19 11.914 -5.505 -15.633 1.00 0.00 H new ATOM 0 HG23 VAL A 19 11.408 -6.101 -14.034 1.00 0.00 H new ATOM 313 N PHE A 20 9.410 -1.466 -15.040 1.00 0.00 N ATOM 314 CA PHE A 20 8.373 -0.442 -15.050 1.00 0.00 C ATOM 315 C PHE A 20 7.548 -0.523 -16.328 1.00 0.00 C ATOM 316 O PHE A 20 8.073 -0.833 -17.398 1.00 0.00 O ATOM 317 CB PHE A 20 9.000 0.946 -14.918 1.00 0.00 C ATOM 318 CG PHE A 20 10.029 1.237 -15.972 1.00 0.00 C ATOM 319 CD1 PHE A 20 9.652 1.752 -17.201 1.00 0.00 C ATOM 320 CD2 PHE A 20 11.372 0.993 -15.734 1.00 0.00 C ATOM 321 CE1 PHE A 20 10.595 2.020 -18.175 1.00 0.00 C ATOM 322 CE2 PHE A 20 12.320 1.258 -16.704 1.00 0.00 C ATOM 323 CZ PHE A 20 11.931 1.773 -17.926 1.00 0.00 C ATOM 0 H PHE A 20 10.203 -1.269 -15.651 1.00 0.00 H new ATOM 0 HA PHE A 20 7.712 -0.615 -14.201 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.213 1.699 -14.971 1.00 0.00 H new ATOM 0 HB3 PHE A 20 9.462 1.036 -13.935 1.00 0.00 H new ATOM 0 HD1 PHE A 20 8.609 1.947 -17.401 1.00 0.00 H new ATOM 0 HD2 PHE A 20 11.681 0.591 -14.780 1.00 0.00 H new ATOM 0 HE1 PHE A 20 10.288 2.422 -19.129 1.00 0.00 H new ATOM 0 HE2 PHE A 20 13.364 1.063 -16.507 1.00 0.00 H new ATOM 0 HZ PHE A 20 12.670 1.982 -18.685 1.00 0.00 H new ATOM 333 N GLU A 21 6.254 -0.247 -16.211 1.00 0.00 N ATOM 334 CA GLU A 21 5.359 -0.293 -17.361 1.00 0.00 C ATOM 335 C GLU A 21 4.016 0.355 -17.036 1.00 0.00 C ATOM 336 O GLU A 21 3.838 0.931 -15.963 1.00 0.00 O ATOM 337 CB GLU A 21 5.150 -1.743 -17.805 1.00 0.00 C ATOM 338 CG GLU A 21 5.627 -2.018 -19.222 1.00 0.00 C ATOM 339 CD GLU A 21 4.523 -2.541 -20.121 1.00 0.00 C ATOM 340 OE1 GLU A 21 3.520 -3.060 -19.590 1.00 0.00 O ATOM 341 OE2 GLU A 21 4.664 -2.431 -21.357 1.00 0.00 O ATOM 0 H GLU A 21 5.802 0.010 -15.334 1.00 0.00 H new ATOM 0 HA GLU A 21 5.819 0.268 -18.174 1.00 0.00 H new ATOM 0 HB2 GLU A 21 5.677 -2.405 -17.118 1.00 0.00 H new ATOM 0 HB3 GLU A 21 4.090 -1.988 -17.733 1.00 0.00 H new ATOM 0 HG2 GLU A 21 6.033 -1.101 -19.649 1.00 0.00 H new ATOM 0 HG3 GLU A 21 6.440 -2.743 -19.193 1.00 0.00 H new ATOM 348 N THR A 22 3.073 0.255 -17.968 1.00 0.00 N ATOM 349 CA THR A 22 1.748 0.830 -17.775 1.00 0.00 C ATOM 350 C THR A 22 0.840 -0.144 -17.035 1.00 0.00 C ATOM 351 O THR A 22 0.274 -1.060 -17.632 1.00 0.00 O ATOM 352 CB THR A 22 1.122 1.210 -19.118 1.00 0.00 C ATOM 353 OG1 THR A 22 -0.173 1.754 -18.926 1.00 0.00 O ATOM 354 CG2 THR A 22 0.993 0.042 -20.075 1.00 0.00 C ATOM 0 H THR A 22 3.202 -0.218 -18.862 1.00 0.00 H new ATOM 0 HA THR A 22 1.858 1.732 -17.173 1.00 0.00 H new ATOM 0 HB THR A 22 1.800 1.941 -19.558 1.00 0.00 H new ATOM 0 HG1 THR A 22 -0.559 1.993 -19.794 1.00 0.00 H new ATOM 0 HG21 THR A 22 0.542 0.383 -21.007 1.00 0.00 H new ATOM 0 HG22 THR A 22 1.981 -0.371 -20.280 1.00 0.00 H new ATOM 0 HG23 THR A 22 0.364 -0.727 -19.627 1.00 0.00 H new ATOM 362 N LYS A 23 0.706 0.060 -15.730 1.00 0.00 N ATOM 363 CA LYS A 23 -0.133 -0.803 -14.908 1.00 0.00 C ATOM 364 C LYS A 23 -1.556 -0.259 -14.825 1.00 0.00 C ATOM 365 O LYS A 23 -1.882 0.530 -13.938 1.00 0.00 O ATOM 366 CB LYS A 23 0.462 -0.961 -13.502 1.00 0.00 C ATOM 367 CG LYS A 23 0.899 0.344 -12.852 1.00 0.00 C ATOM 368 CD LYS A 23 2.083 0.131 -11.917 1.00 0.00 C ATOM 369 CE LYS A 23 3.359 0.732 -12.484 1.00 0.00 C ATOM 370 NZ LYS A 23 4.123 1.482 -11.450 1.00 0.00 N ATOM 0 H LYS A 23 1.166 0.814 -15.219 1.00 0.00 H new ATOM 0 HA LYS A 23 -0.169 -1.785 -15.380 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -0.276 -1.442 -12.861 1.00 0.00 H new ATOM 0 HB3 LYS A 23 1.321 -1.630 -13.558 1.00 0.00 H new ATOM 0 HG2 LYS A 23 1.169 1.064 -13.624 1.00 0.00 H new ATOM 0 HG3 LYS A 23 0.066 0.771 -12.294 1.00 0.00 H new ATOM 0 HD2 LYS A 23 1.868 0.581 -10.948 1.00 0.00 H new ATOM 0 HD3 LYS A 23 2.227 -0.936 -11.748 1.00 0.00 H new ATOM 0 HE2 LYS A 23 3.984 -0.062 -12.894 1.00 0.00 H new ATOM 0 HE3 LYS A 23 3.111 1.400 -13.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 4.986 1.877 -11.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 3.536 2.255 -11.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 4.382 0.839 -10.675 1.00 0.00 H new ATOM 384 N ARG A 24 -2.400 -0.692 -15.760 1.00 0.00 N ATOM 385 CA ARG A 24 -3.794 -0.257 -15.805 1.00 0.00 C ATOM 386 C ARG A 24 -4.698 -1.224 -15.046 1.00 0.00 C ATOM 387 O ARG A 24 -5.830 -1.480 -15.457 1.00 0.00 O ATOM 388 CB ARG A 24 -4.267 -0.139 -17.254 1.00 0.00 C ATOM 389 CG ARG A 24 -3.772 1.110 -17.964 1.00 0.00 C ATOM 390 CD ARG A 24 -3.629 0.877 -19.459 1.00 0.00 C ATOM 391 NE ARG A 24 -2.718 -0.228 -19.752 1.00 0.00 N ATOM 392 CZ ARG A 24 -2.883 -1.086 -20.757 1.00 0.00 C ATOM 393 NH1 ARG A 24 -3.916 -0.968 -21.583 1.00 0.00 N ATOM 394 NH2 ARG A 24 -2.008 -2.065 -20.939 1.00 0.00 N ATOM 0 H ARG A 24 -2.141 -1.346 -16.499 1.00 0.00 H new ATOM 0 HA ARG A 24 -3.854 0.720 -15.325 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -3.932 -1.016 -17.808 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.357 -0.147 -17.272 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -4.467 1.931 -17.787 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -2.811 1.411 -17.547 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -4.608 0.665 -19.889 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -3.262 1.786 -19.935 1.00 0.00 H new ATOM 0 HE ARG A 24 -1.905 -0.350 -19.149 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -4.592 -0.215 -21.451 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -4.034 -1.630 -22.350 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -1.211 -2.160 -20.310 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -2.132 -2.724 -21.708 1.00 0.00 H new ATOM 408 N PHE A 25 -4.197 -1.761 -13.938 1.00 0.00 N ATOM 409 CA PHE A 25 -4.968 -2.697 -13.128 1.00 0.00 C ATOM 410 C PHE A 25 -6.137 -1.987 -12.452 1.00 0.00 C ATOM 411 O PHE A 25 -6.165 -0.759 -12.371 1.00 0.00 O ATOM 412 CB PHE A 25 -4.070 -3.350 -12.075 1.00 0.00 C ATOM 413 CG PHE A 25 -3.386 -2.361 -11.180 1.00 0.00 C ATOM 414 CD1 PHE A 25 -4.099 -1.672 -10.215 1.00 0.00 C ATOM 415 CD2 PHE A 25 -2.030 -2.118 -11.306 1.00 0.00 C ATOM 416 CE1 PHE A 25 -3.469 -0.759 -9.393 1.00 0.00 C ATOM 417 CE2 PHE A 25 -1.393 -1.204 -10.487 1.00 0.00 C ATOM 418 CZ PHE A 25 -2.115 -0.524 -9.527 1.00 0.00 C ATOM 0 H PHE A 25 -3.262 -1.564 -13.581 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.366 -3.472 -13.784 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -4.670 -4.026 -11.466 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -3.316 -3.957 -12.577 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.158 -1.850 -10.104 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -1.461 -2.650 -12.054 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -4.037 -0.227 -8.644 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -0.334 -1.023 -10.598 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.623 0.189 -8.883 1.00 0.00 H new ATOM 428 N GLU A 26 -7.103 -2.765 -11.975 1.00 0.00 N ATOM 429 CA GLU A 26 -8.278 -2.208 -11.313 1.00 0.00 C ATOM 430 C GLU A 26 -8.853 -3.201 -10.303 1.00 0.00 C ATOM 431 O GLU A 26 -9.427 -4.222 -10.681 1.00 0.00 O ATOM 432 CB GLU A 26 -9.337 -1.837 -12.357 1.00 0.00 C ATOM 433 CG GLU A 26 -9.615 -0.343 -12.450 1.00 0.00 C ATOM 434 CD GLU A 26 -11.090 -0.015 -12.324 1.00 0.00 C ATOM 435 OE1 GLU A 26 -11.658 -0.240 -11.236 1.00 0.00 O ATOM 436 OE2 GLU A 26 -11.678 0.468 -13.316 1.00 0.00 O ATOM 0 H GLU A 26 -7.096 -3.783 -12.034 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.980 -1.309 -10.773 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.013 -2.198 -13.333 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.266 -2.355 -12.118 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.063 0.175 -11.666 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.243 0.033 -13.403 1.00 0.00 H new ATOM 443 N VAL A 27 -8.697 -2.889 -9.016 1.00 0.00 N ATOM 444 CA VAL A 27 -9.201 -3.748 -7.945 1.00 0.00 C ATOM 445 C VAL A 27 -9.551 -2.928 -6.703 1.00 0.00 C ATOM 446 O VAL A 27 -8.680 -2.614 -5.894 1.00 0.00 O ATOM 447 CB VAL A 27 -8.172 -4.821 -7.534 1.00 0.00 C ATOM 448 CG1 VAL A 27 -8.802 -5.828 -6.581 1.00 0.00 C ATOM 449 CG2 VAL A 27 -7.595 -5.523 -8.750 1.00 0.00 C ATOM 0 H VAL A 27 -8.225 -2.046 -8.690 1.00 0.00 H new ATOM 0 HA VAL A 27 -10.092 -4.235 -8.340 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.353 -4.321 -7.018 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.061 -6.577 -6.302 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.152 -5.313 -5.686 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -9.644 -6.316 -7.072 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -6.873 -6.274 -8.428 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -8.398 -6.007 -9.306 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.099 -4.793 -9.390 1.00 0.00 H new ATOM 459 N PRO A 28 -10.834 -2.575 -6.531 1.00 0.00 N ATOM 460 CA PRO A 28 -11.288 -1.793 -5.375 1.00 0.00 C ATOM 461 C PRO A 28 -10.856 -2.413 -4.051 1.00 0.00 C ATOM 462 O PRO A 28 -10.429 -1.710 -3.134 1.00 0.00 O ATOM 463 CB PRO A 28 -12.812 -1.819 -5.502 1.00 0.00 C ATOM 464 CG PRO A 28 -13.068 -2.045 -6.951 1.00 0.00 C ATOM 465 CD PRO A 28 -11.942 -2.912 -7.441 1.00 0.00 C ATOM 0 HA PRO A 28 -10.864 -0.789 -5.373 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.246 -2.613 -4.895 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -13.253 -0.882 -5.164 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.031 -2.532 -7.106 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.098 -1.100 -7.494 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -12.197 -3.970 -7.389 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -11.690 -2.695 -8.479 1.00 0.00 H new ATOM 473 N LYS A 29 -10.966 -3.734 -3.957 1.00 0.00 N ATOM 474 CA LYS A 29 -10.585 -4.446 -2.744 1.00 0.00 C ATOM 475 C LYS A 29 -9.068 -4.468 -2.587 1.00 0.00 C ATOM 476 O LYS A 29 -8.384 -5.308 -3.169 1.00 0.00 O ATOM 477 CB LYS A 29 -11.134 -5.874 -2.770 1.00 0.00 C ATOM 478 CG LYS A 29 -11.747 -6.314 -1.450 1.00 0.00 C ATOM 479 CD LYS A 29 -10.714 -6.959 -0.540 1.00 0.00 C ATOM 480 CE LYS A 29 -10.204 -8.271 -1.116 1.00 0.00 C ATOM 481 NZ LYS A 29 -8.804 -8.154 -1.609 1.00 0.00 N ATOM 0 H LYS A 29 -11.316 -4.332 -4.706 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.013 -3.921 -1.890 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -11.887 -5.951 -3.554 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -10.328 -6.559 -3.033 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -12.188 -5.453 -0.948 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -12.555 -7.020 -1.641 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -9.878 -6.275 -0.395 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -11.153 -7.138 0.441 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -10.256 -9.047 -0.353 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -10.852 -8.584 -1.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.658 -8.813 -2.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.630 -7.181 -1.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.144 -8.386 -0.839 1.00 0.00 H new ATOM 495 N ALA A 30 -8.554 -3.536 -1.795 1.00 0.00 N ATOM 496 CA ALA A 30 -7.121 -3.437 -1.556 1.00 0.00 C ATOM 497 C ALA A 30 -6.838 -2.464 -0.419 1.00 0.00 C ATOM 498 O ALA A 30 -5.935 -1.631 -0.504 1.00 0.00 O ATOM 499 CB ALA A 30 -6.401 -3.007 -2.827 1.00 0.00 C ATOM 0 H ALA A 30 -9.111 -2.836 -1.306 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.747 -4.419 -1.266 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -5.331 -2.937 -2.633 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -6.580 -3.741 -3.613 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -6.776 -2.035 -3.146 1.00 0.00 H new ATOM 505 N TYR A 31 -7.625 -2.575 0.646 1.00 0.00 N ATOM 506 CA TYR A 31 -7.472 -1.707 1.803 1.00 0.00 C ATOM 507 C TYR A 31 -7.922 -2.414 3.076 1.00 0.00 C ATOM 508 O TYR A 31 -8.406 -3.545 3.033 1.00 0.00 O ATOM 509 CB TYR A 31 -8.258 -0.405 1.605 1.00 0.00 C ATOM 510 CG TYR A 31 -9.764 -0.561 1.692 1.00 0.00 C ATOM 511 CD1 TYR A 31 -10.424 -1.592 1.030 1.00 0.00 C ATOM 512 CD2 TYR A 31 -10.525 0.332 2.434 1.00 0.00 C ATOM 513 CE1 TYR A 31 -11.797 -1.725 1.108 1.00 0.00 C ATOM 514 CE2 TYR A 31 -11.899 0.206 2.514 1.00 0.00 C ATOM 515 CZ TYR A 31 -12.529 -0.825 1.850 1.00 0.00 C ATOM 516 OH TYR A 31 -13.897 -0.953 1.926 1.00 0.00 O ATOM 0 H TYR A 31 -8.376 -3.260 0.730 1.00 0.00 H new ATOM 0 HA TYR A 31 -6.415 -1.462 1.906 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -7.936 0.317 2.356 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -8.004 0.013 0.631 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -9.854 -2.299 0.446 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -10.035 1.139 2.958 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -12.294 -2.531 0.589 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -12.476 0.911 3.094 1.00 0.00 H new ATOM 0 HH TYR A 31 -14.262 -0.239 2.489 1.00 0.00 H new ATOM 526 N SER A 32 -7.754 -1.743 4.207 1.00 0.00 N ATOM 527 CA SER A 32 -8.136 -2.306 5.494 1.00 0.00 C ATOM 528 C SER A 32 -9.627 -2.124 5.751 1.00 0.00 C ATOM 529 O SER A 32 -10.341 -1.548 4.930 1.00 0.00 O ATOM 530 CB SER A 32 -7.329 -1.647 6.613 1.00 0.00 C ATOM 531 OG SER A 32 -7.756 -2.097 7.884 1.00 0.00 O ATOM 0 H SER A 32 -7.355 -0.806 4.259 1.00 0.00 H new ATOM 0 HA SER A 32 -7.921 -3.375 5.475 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.270 -1.871 6.482 1.00 0.00 H new ATOM 0 HB3 SER A 32 -7.436 -0.564 6.553 1.00 0.00 H new ATOM 0 HG SER A 32 -7.825 -1.334 8.495 1.00 0.00 H new ATOM 537 N VAL A 33 -10.093 -2.616 6.893 1.00 0.00 N ATOM 538 CA VAL A 33 -11.502 -2.502 7.250 1.00 0.00 C ATOM 539 C VAL A 33 -11.660 -1.972 8.669 1.00 0.00 C ATOM 540 O VAL A 33 -10.789 -2.161 9.516 1.00 0.00 O ATOM 541 CB VAL A 33 -12.240 -3.855 7.129 1.00 0.00 C ATOM 542 CG1 VAL A 33 -13.554 -3.680 6.379 1.00 0.00 C ATOM 543 CG2 VAL A 33 -11.361 -4.893 6.445 1.00 0.00 C ATOM 0 H VAL A 33 -9.518 -3.096 7.585 1.00 0.00 H new ATOM 0 HA VAL A 33 -11.948 -1.801 6.545 1.00 0.00 H new ATOM 0 HB VAL A 33 -12.463 -4.214 8.134 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -14.060 -4.642 6.303 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -14.190 -2.977 6.918 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.354 -3.295 5.379 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -11.902 -5.836 6.371 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.099 -4.546 5.445 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.452 -5.041 7.028 1.00 0.00 H new ATOM 553 N ILE A 34 -12.767 -1.287 8.914 1.00 0.00 N ATOM 554 CA ILE A 34 -13.033 -0.710 10.221 1.00 0.00 C ATOM 555 C ILE A 34 -13.970 -1.589 11.037 1.00 0.00 C ATOM 556 O ILE A 34 -14.780 -2.335 10.486 1.00 0.00 O ATOM 557 CB ILE A 34 -13.631 0.699 10.070 1.00 0.00 C ATOM 558 CG1 ILE A 34 -12.679 1.565 9.250 1.00 0.00 C ATOM 559 CG2 ILE A 34 -13.900 1.327 11.429 1.00 0.00 C ATOM 560 CD1 ILE A 34 -13.061 1.660 7.789 1.00 0.00 C ATOM 0 H ILE A 34 -13.497 -1.117 8.222 1.00 0.00 H new ATOM 0 HA ILE A 34 -12.084 -0.642 10.754 1.00 0.00 H new ATOM 0 HB ILE A 34 -14.587 0.626 9.551 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -12.653 2.568 9.677 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -11.671 1.158 9.329 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -14.322 2.323 11.293 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -14.604 0.707 11.983 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -12.966 1.402 11.986 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -12.342 2.290 7.265 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -13.060 0.664 7.347 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -14.057 2.095 7.701 1.00 0.00 H new ATOM 572 N GLN A 35 -13.840 -1.506 12.355 1.00 0.00 N ATOM 573 CA GLN A 35 -14.662 -2.305 13.251 1.00 0.00 C ATOM 574 C GLN A 35 -14.819 -1.622 14.608 1.00 0.00 C ATOM 575 O GLN A 35 -13.964 -1.753 15.480 1.00 0.00 O ATOM 576 CB GLN A 35 -14.034 -3.688 13.424 1.00 0.00 C ATOM 577 CG GLN A 35 -14.885 -4.813 12.862 1.00 0.00 C ATOM 578 CD GLN A 35 -14.152 -6.138 12.833 1.00 0.00 C ATOM 579 OE1 GLN A 35 -13.303 -6.374 11.972 1.00 0.00 O ATOM 580 NE2 GLN A 35 -14.475 -7.012 13.779 1.00 0.00 N ATOM 0 H GLN A 35 -13.174 -0.894 12.826 1.00 0.00 H new ATOM 0 HA GLN A 35 -15.654 -2.409 12.812 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -13.060 -3.700 12.935 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -13.860 -3.869 14.485 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -15.789 -4.915 13.463 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -15.201 -4.555 11.851 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -15.184 -6.774 14.472 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -14.014 -7.921 13.812 1.00 0.00 H new ATOM 589 N GLY A 36 -15.919 -0.895 14.776 1.00 0.00 N ATOM 590 CA GLY A 36 -16.168 -0.202 16.028 1.00 0.00 C ATOM 591 C GLY A 36 -15.181 0.921 16.268 1.00 0.00 C ATOM 592 O GLY A 36 -15.530 2.098 16.169 1.00 0.00 O ATOM 0 H GLY A 36 -16.643 -0.773 14.068 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -17.180 0.202 16.022 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -16.113 -0.913 16.852 1.00 0.00 H new ATOM 596 N ASN A 37 -13.945 0.555 16.584 1.00 0.00 N ATOM 597 CA ASN A 37 -12.897 1.532 16.839 1.00 0.00 C ATOM 598 C ASN A 37 -11.524 0.935 16.545 1.00 0.00 C ATOM 599 O ASN A 37 -10.522 1.370 17.106 1.00 0.00 O ATOM 600 CB ASN A 37 -12.956 2.002 18.294 1.00 0.00 C ATOM 601 CG ASN A 37 -14.338 2.476 18.698 1.00 0.00 C ATOM 602 OD1 ASN A 37 -15.159 1.697 19.182 1.00 0.00 O ATOM 603 ND2 ASN A 37 -14.602 3.763 18.506 1.00 0.00 N ATOM 0 H ASN A 37 -13.644 -0.416 16.670 1.00 0.00 H new ATOM 0 HA ASN A 37 -13.057 2.386 16.180 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -12.650 1.186 18.948 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -12.241 2.812 18.440 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -15.514 4.140 18.763 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -13.893 4.374 18.102 1.00 0.00 H new ATOM 610 N ARG A 38 -11.486 -0.060 15.659 1.00 0.00 N ATOM 611 CA ARG A 38 -10.230 -0.713 15.297 1.00 0.00 C ATOM 612 C ARG A 38 -10.157 -0.990 13.800 1.00 0.00 C ATOM 613 O ARG A 38 -11.179 -1.064 13.119 1.00 0.00 O ATOM 614 CB ARG A 38 -10.066 -2.023 16.067 1.00 0.00 C ATOM 615 CG ARG A 38 -11.282 -2.935 16.021 1.00 0.00 C ATOM 616 CD ARG A 38 -11.068 -4.165 16.889 1.00 0.00 C ATOM 617 NE ARG A 38 -12.298 -4.935 17.090 1.00 0.00 N ATOM 618 CZ ARG A 38 -12.665 -5.964 16.322 1.00 0.00 C ATOM 619 NH1 ARG A 38 -11.968 -6.273 15.238 1.00 0.00 N ATOM 620 NH2 ARG A 38 -13.749 -6.666 16.624 1.00 0.00 N ATOM 0 H ARG A 38 -12.308 -0.430 15.181 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.421 -0.033 15.562 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -9.208 -2.561 15.665 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -9.839 -1.793 17.108 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -12.163 -2.392 16.363 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -11.475 -3.239 14.992 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.315 -4.804 16.427 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -10.674 -3.857 17.858 1.00 0.00 H new ATOM 0 HE ARG A 38 -12.910 -4.670 17.862 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -11.146 -5.724 14.986 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -12.253 -7.060 14.655 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -14.304 -6.420 17.444 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -14.028 -7.452 16.036 1.00 0.00 H new ATOM 634 N THR A 39 -8.936 -1.150 13.295 1.00 0.00 N ATOM 635 CA THR A 39 -8.724 -1.425 11.879 1.00 0.00 C ATOM 636 C THR A 39 -8.335 -2.888 11.660 1.00 0.00 C ATOM 637 O THR A 39 -7.407 -3.395 12.288 1.00 0.00 O ATOM 638 CB THR A 39 -7.664 -0.466 11.308 1.00 0.00 C ATOM 639 OG1 THR A 39 -8.146 0.149 10.131 1.00 0.00 O ATOM 640 CG2 THR A 39 -6.336 -1.115 10.962 1.00 0.00 C ATOM 0 H THR A 39 -8.080 -1.094 13.846 1.00 0.00 H new ATOM 0 HA THR A 39 -9.658 -1.255 11.344 1.00 0.00 H new ATOM 0 HB THR A 39 -7.484 0.249 12.110 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.948 1.108 10.159 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.655 -0.361 10.567 1.00 0.00 H new ATOM 0 HG22 THR A 39 -5.904 -1.561 11.858 1.00 0.00 H new ATOM 0 HG23 THR A 39 -6.494 -1.890 10.212 1.00 0.00 H new ATOM 648 N PHE A 40 -9.061 -3.562 10.776 1.00 0.00 N ATOM 649 CA PHE A 40 -8.803 -4.967 10.480 1.00 0.00 C ATOM 650 C PHE A 40 -7.991 -5.114 9.197 1.00 0.00 C ATOM 651 O PHE A 40 -8.550 -5.325 8.121 1.00 0.00 O ATOM 652 CB PHE A 40 -10.129 -5.728 10.357 1.00 0.00 C ATOM 653 CG PHE A 40 -10.014 -7.048 9.647 1.00 0.00 C ATOM 654 CD1 PHE A 40 -8.947 -7.892 9.905 1.00 0.00 C ATOM 655 CD2 PHE A 40 -10.969 -7.441 8.725 1.00 0.00 C ATOM 656 CE1 PHE A 40 -8.834 -9.104 9.256 1.00 0.00 C ATOM 657 CE2 PHE A 40 -10.862 -8.654 8.070 1.00 0.00 C ATOM 658 CZ PHE A 40 -9.792 -9.487 8.336 1.00 0.00 C ATOM 0 H PHE A 40 -9.835 -3.157 10.250 1.00 0.00 H new ATOM 0 HA PHE A 40 -8.222 -5.390 11.300 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -10.532 -5.898 11.355 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -10.847 -5.103 9.826 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -8.195 -7.598 10.622 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -11.807 -6.793 8.515 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -7.997 -9.754 9.467 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -11.613 -8.950 7.352 1.00 0.00 H new ATOM 0 HZ PHE A 40 -9.704 -10.435 7.826 1.00 0.00 H new ATOM 668 N ILE A 41 -6.674 -5.009 9.310 1.00 0.00 N ATOM 669 CA ILE A 41 -5.816 -5.139 8.145 1.00 0.00 C ATOM 670 C ILE A 41 -5.546 -6.613 7.840 1.00 0.00 C ATOM 671 O ILE A 41 -5.040 -7.355 8.686 1.00 0.00 O ATOM 672 CB ILE A 41 -4.490 -4.354 8.336 1.00 0.00 C ATOM 673 CG1 ILE A 41 -4.242 -3.431 7.139 1.00 0.00 C ATOM 674 CG2 ILE A 41 -3.297 -5.284 8.543 1.00 0.00 C ATOM 675 CD1 ILE A 41 -3.902 -2.007 7.528 1.00 0.00 C ATOM 0 H ILE A 41 -6.183 -4.836 10.187 1.00 0.00 H new ATOM 0 HA ILE A 41 -6.334 -4.704 7.290 1.00 0.00 H new ATOM 0 HB ILE A 41 -4.595 -3.753 9.239 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -3.428 -3.839 6.540 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -5.130 -3.423 6.507 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -2.392 -4.691 8.672 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -3.461 -5.894 9.431 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.185 -5.932 7.674 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -3.740 -1.413 6.629 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.725 -1.580 8.101 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -2.996 -2.002 8.134 1.00 0.00 H new ATOM 687 N GLN A 42 -5.900 -7.032 6.629 1.00 0.00 N ATOM 688 CA GLN A 42 -5.703 -8.417 6.210 1.00 0.00 C ATOM 689 C GLN A 42 -4.753 -8.489 5.021 1.00 0.00 C ATOM 690 O GLN A 42 -3.998 -9.451 4.870 1.00 0.00 O ATOM 691 CB GLN A 42 -7.042 -9.070 5.852 1.00 0.00 C ATOM 692 CG GLN A 42 -8.019 -8.133 5.157 1.00 0.00 C ATOM 693 CD GLN A 42 -9.000 -8.874 4.268 1.00 0.00 C ATOM 694 OE1 GLN A 42 -8.648 -9.327 3.179 1.00 0.00 O ATOM 695 NE2 GLN A 42 -10.239 -9.001 4.730 1.00 0.00 N ATOM 0 H GLN A 42 -6.324 -6.433 5.921 1.00 0.00 H new ATOM 0 HA GLN A 42 -5.261 -8.962 7.044 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.855 -9.928 5.206 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -7.504 -9.451 6.763 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -8.570 -7.566 5.907 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.463 -7.412 4.558 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -10.487 -8.610 5.639 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -10.942 -9.490 4.176 1.00 0.00 H new ATOM 704 N ASN A 43 -4.792 -7.461 4.182 1.00 0.00 N ATOM 705 CA ASN A 43 -3.933 -7.403 3.013 1.00 0.00 C ATOM 706 C ASN A 43 -2.815 -6.394 3.230 1.00 0.00 C ATOM 707 O ASN A 43 -2.510 -5.580 2.357 1.00 0.00 O ATOM 708 CB ASN A 43 -4.750 -7.048 1.768 1.00 0.00 C ATOM 709 CG ASN A 43 -4.873 -8.222 0.816 1.00 0.00 C ATOM 710 OD1 ASN A 43 -4.243 -8.247 -0.241 1.00 0.00 O ATOM 711 ND2 ASN A 43 -5.680 -9.207 1.194 1.00 0.00 N ATOM 0 H ASN A 43 -5.411 -6.658 4.292 1.00 0.00 H new ATOM 0 HA ASN A 43 -3.485 -8.384 2.859 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -5.745 -6.719 2.069 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -4.280 -6.211 1.252 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -5.797 -10.027 0.599 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -6.183 -9.143 2.079 1.00 0.00 H new ATOM 718 N PHE A 44 -2.202 -6.460 4.407 1.00 0.00 N ATOM 719 CA PHE A 44 -1.106 -5.566 4.762 1.00 0.00 C ATOM 720 C PHE A 44 -0.079 -5.467 3.634 1.00 0.00 C ATOM 721 O PHE A 44 0.664 -4.498 3.555 1.00 0.00 O ATOM 722 CB PHE A 44 -0.428 -6.041 6.055 1.00 0.00 C ATOM 723 CG PHE A 44 0.259 -7.380 5.949 1.00 0.00 C ATOM 724 CD1 PHE A 44 -0.382 -8.475 5.386 1.00 0.00 C ATOM 725 CD2 PHE A 44 1.552 -7.543 6.427 1.00 0.00 C ATOM 726 CE1 PHE A 44 0.250 -9.699 5.298 1.00 0.00 C ATOM 727 CE2 PHE A 44 2.189 -8.768 6.342 1.00 0.00 C ATOM 728 CZ PHE A 44 1.537 -9.847 5.776 1.00 0.00 C ATOM 0 H PHE A 44 -2.448 -7.129 5.136 1.00 0.00 H new ATOM 0 HA PHE A 44 -1.525 -4.573 4.923 1.00 0.00 H new ATOM 0 HB2 PHE A 44 0.305 -5.295 6.361 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -1.178 -6.094 6.845 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -1.389 -8.368 5.012 1.00 0.00 H new ATOM 0 HD2 PHE A 44 2.067 -6.704 6.870 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -0.262 -10.541 4.855 1.00 0.00 H new ATOM 0 HE2 PHE A 44 3.195 -8.881 6.718 1.00 0.00 H new ATOM 0 HZ PHE A 44 2.033 -10.804 5.708 1.00 0.00 H new ATOM 738 N ARG A 45 -0.044 -6.472 2.764 1.00 0.00 N ATOM 739 CA ARG A 45 0.892 -6.483 1.647 1.00 0.00 C ATOM 740 C ARG A 45 0.446 -5.527 0.545 1.00 0.00 C ATOM 741 O ARG A 45 1.166 -4.595 0.187 1.00 0.00 O ATOM 742 CB ARG A 45 1.018 -7.896 1.079 1.00 0.00 C ATOM 743 CG ARG A 45 2.438 -8.273 0.691 1.00 0.00 C ATOM 744 CD ARG A 45 3.012 -9.320 1.631 1.00 0.00 C ATOM 745 NE ARG A 45 4.059 -8.770 2.489 1.00 0.00 N ATOM 746 CZ ARG A 45 5.360 -8.835 2.211 1.00 0.00 C ATOM 747 NH1 ARG A 45 5.784 -9.415 1.094 1.00 0.00 N ATOM 748 NH2 ARG A 45 6.242 -8.315 3.053 1.00 0.00 N ATOM 0 H ARG A 45 -0.653 -7.289 2.812 1.00 0.00 H new ATOM 0 HA ARG A 45 1.862 -6.153 2.020 1.00 0.00 H new ATOM 0 HB2 ARG A 45 0.651 -8.609 1.817 1.00 0.00 H new ATOM 0 HB3 ARG A 45 0.375 -7.985 0.203 1.00 0.00 H new ATOM 0 HG2 ARG A 45 2.448 -8.654 -0.330 1.00 0.00 H new ATOM 0 HG3 ARG A 45 3.069 -7.384 0.706 1.00 0.00 H new ATOM 0 HD2 ARG A 45 2.213 -9.728 2.250 1.00 0.00 H new ATOM 0 HD3 ARG A 45 3.418 -10.147 1.048 1.00 0.00 H new ATOM 0 HE ARG A 45 3.776 -8.308 3.353 1.00 0.00 H new ATOM 0 HH11 ARG A 45 5.111 -9.816 0.440 1.00 0.00 H new ATOM 0 HH12 ARG A 45 6.782 -9.460 0.890 1.00 0.00 H new ATOM 0 HH21 ARG A 45 5.924 -7.866 3.912 1.00 0.00 H new ATOM 0 HH22 ARG A 45 7.239 -8.364 2.842 1.00 0.00 H new ATOM 762 N GLU A 46 -0.750 -5.767 0.014 1.00 0.00 N ATOM 763 CA GLU A 46 -1.298 -4.930 -1.044 1.00 0.00 C ATOM 764 C GLU A 46 -1.653 -3.552 -0.503 1.00 0.00 C ATOM 765 O GLU A 46 -1.371 -2.533 -1.134 1.00 0.00 O ATOM 766 CB GLU A 46 -2.532 -5.588 -1.660 1.00 0.00 C ATOM 767 CG GLU A 46 -3.241 -4.720 -2.688 1.00 0.00 C ATOM 768 CD GLU A 46 -3.702 -5.508 -3.898 1.00 0.00 C ATOM 769 OE1 GLU A 46 -2.837 -5.964 -4.675 1.00 0.00 O ATOM 770 OE2 GLU A 46 -4.929 -5.671 -4.069 1.00 0.00 O ATOM 0 H GLU A 46 -1.357 -6.535 0.301 1.00 0.00 H new ATOM 0 HA GLU A 46 -0.540 -4.816 -1.819 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -2.236 -6.525 -2.132 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.234 -5.840 -0.865 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.102 -4.241 -2.222 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -2.570 -3.924 -3.011 1.00 0.00 H new ATOM 777 N VAL A 47 -2.267 -3.527 0.676 1.00 0.00 N ATOM 778 CA VAL A 47 -2.652 -2.270 1.302 1.00 0.00 C ATOM 779 C VAL A 47 -1.423 -1.424 1.609 1.00 0.00 C ATOM 780 O VAL A 47 -1.433 -0.211 1.409 1.00 0.00 O ATOM 781 CB VAL A 47 -3.445 -2.500 2.605 1.00 0.00 C ATOM 782 CG1 VAL A 47 -3.889 -1.174 3.206 1.00 0.00 C ATOM 783 CG2 VAL A 47 -4.643 -3.405 2.349 1.00 0.00 C ATOM 0 H VAL A 47 -2.507 -4.360 1.214 1.00 0.00 H new ATOM 0 HA VAL A 47 -3.292 -1.745 0.594 1.00 0.00 H new ATOM 0 HB VAL A 47 -2.790 -2.995 3.322 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.447 -1.359 4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -3.013 -0.565 3.430 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.526 -0.647 2.495 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -5.190 -3.556 3.279 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.299 -2.940 1.613 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -4.298 -4.367 1.971 1.00 0.00 H new ATOM 793 N ALA A 48 -0.369 -2.066 2.099 1.00 0.00 N ATOM 794 CA ALA A 48 0.855 -1.353 2.434 1.00 0.00 C ATOM 795 C ALA A 48 1.456 -0.676 1.210 1.00 0.00 C ATOM 796 O ALA A 48 1.834 0.491 1.253 1.00 0.00 O ATOM 797 CB ALA A 48 1.873 -2.282 3.074 1.00 0.00 C ATOM 0 H ALA A 48 -0.338 -3.071 2.272 1.00 0.00 H new ATOM 0 HA ALA A 48 0.591 -0.580 3.156 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.777 -1.722 3.313 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.456 -2.705 3.988 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.118 -3.087 2.381 1.00 0.00 H new ATOM 803 N ASP A 49 1.556 -1.426 0.122 1.00 0.00 N ATOM 804 CA ASP A 49 2.131 -0.890 -1.106 1.00 0.00 C ATOM 805 C ASP A 49 1.389 0.372 -1.550 1.00 0.00 C ATOM 806 O ASP A 49 1.952 1.467 -1.551 1.00 0.00 O ATOM 807 CB ASP A 49 2.093 -1.939 -2.219 1.00 0.00 C ATOM 808 CG ASP A 49 3.169 -1.707 -3.260 1.00 0.00 C ATOM 809 OD1 ASP A 49 2.925 -0.925 -4.203 1.00 0.00 O ATOM 810 OD2 ASP A 49 4.258 -2.305 -3.130 1.00 0.00 O ATOM 0 H ASP A 49 1.250 -2.397 0.063 1.00 0.00 H new ATOM 0 HA ASP A 49 3.170 -0.628 -0.904 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.217 -2.931 -1.785 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.115 -1.921 -2.700 1.00 0.00 H new ATOM 815 N ALA A 50 0.132 0.209 -1.947 1.00 0.00 N ATOM 816 CA ALA A 50 -0.678 1.328 -2.418 1.00 0.00 C ATOM 817 C ALA A 50 -0.681 2.504 -1.435 1.00 0.00 C ATOM 818 O ALA A 50 -0.517 3.655 -1.840 1.00 0.00 O ATOM 819 CB ALA A 50 -2.096 0.855 -2.711 1.00 0.00 C ATOM 0 H ALA A 50 -0.350 -0.690 -1.952 1.00 0.00 H new ATOM 0 HA ALA A 50 -0.227 1.698 -3.339 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -2.695 1.696 -3.062 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -2.070 0.082 -3.479 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -2.539 0.449 -1.802 1.00 0.00 H new ATOM 825 N LEU A 51 -0.871 2.214 -0.147 1.00 0.00 N ATOM 826 CA LEU A 51 -0.899 3.251 0.869 1.00 0.00 C ATOM 827 C LEU A 51 0.495 3.842 1.068 1.00 0.00 C ATOM 828 O LEU A 51 0.646 4.916 1.641 1.00 0.00 O ATOM 829 CB LEU A 51 -1.448 2.690 2.185 1.00 0.00 C ATOM 830 CG LEU A 51 -1.040 3.457 3.445 1.00 0.00 C ATOM 831 CD1 LEU A 51 -1.385 4.930 3.307 1.00 0.00 C ATOM 832 CD2 LEU A 51 -1.707 2.869 4.677 1.00 0.00 C ATOM 0 H LEU A 51 -1.007 1.269 0.211 1.00 0.00 H new ATOM 0 HA LEU A 51 -1.561 4.050 0.535 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.536 2.672 2.127 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.117 1.656 2.286 1.00 0.00 H new ATOM 0 HG LEU A 51 0.039 3.363 3.564 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.088 5.460 4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.856 5.349 2.451 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.459 5.040 3.159 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.401 3.431 5.559 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.790 2.927 4.567 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.409 1.827 4.790 1.00 0.00 H new ATOM 844 N ASN A 52 1.510 3.134 0.581 1.00 0.00 N ATOM 845 CA ASN A 52 2.892 3.587 0.689 1.00 0.00 C ATOM 846 C ASN A 52 3.861 2.447 0.421 1.00 0.00 C ATOM 847 O ASN A 52 4.054 1.568 1.262 1.00 0.00 O ATOM 848 CB ASN A 52 3.177 4.191 2.068 1.00 0.00 C ATOM 849 CG ASN A 52 3.522 5.667 1.990 1.00 0.00 C ATOM 850 OD1 ASN A 52 2.686 6.493 1.623 1.00 0.00 O ATOM 851 ND2 ASN A 52 4.758 6.008 2.336 1.00 0.00 N ATOM 0 H ASN A 52 1.399 2.239 0.105 1.00 0.00 H new ATOM 0 HA ASN A 52 3.036 4.361 -0.065 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.305 4.057 2.708 1.00 0.00 H new ATOM 0 HB3 ASN A 52 4.001 3.652 2.535 1.00 0.00 H new ATOM 0 HD21 ASN A 52 5.045 6.986 2.303 1.00 0.00 H new ATOM 0 HD22 ASN A 52 5.420 5.292 2.634 1.00 0.00 H new ATOM 858 N ARG A 53 4.487 2.475 -0.749 1.00 0.00 N ATOM 859 CA ARG A 53 5.453 1.449 -1.114 1.00 0.00 C ATOM 860 C ARG A 53 6.476 1.261 0.006 1.00 0.00 C ATOM 861 O ARG A 53 7.081 0.197 0.136 1.00 0.00 O ATOM 862 CB ARG A 53 6.157 1.827 -2.418 1.00 0.00 C ATOM 863 CG ARG A 53 7.000 3.087 -2.307 1.00 0.00 C ATOM 864 CD ARG A 53 8.435 2.845 -2.748 1.00 0.00 C ATOM 865 NE ARG A 53 8.541 2.679 -4.196 1.00 0.00 N ATOM 866 CZ ARG A 53 8.670 1.502 -4.806 1.00 0.00 C ATOM 867 NH1 ARG A 53 8.703 0.377 -4.102 1.00 0.00 N ATOM 868 NH2 ARG A 53 8.762 1.448 -6.127 1.00 0.00 N ATOM 0 H ARG A 53 4.343 3.194 -1.458 1.00 0.00 H new ATOM 0 HA ARG A 53 4.924 0.508 -1.263 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.794 1.000 -2.731 1.00 0.00 H new ATOM 0 HB3 ARG A 53 5.409 1.967 -3.198 1.00 0.00 H new ATOM 0 HG2 ARG A 53 6.559 3.874 -2.918 1.00 0.00 H new ATOM 0 HG3 ARG A 53 6.991 3.441 -1.276 1.00 0.00 H new ATOM 0 HD2 ARG A 53 9.058 3.682 -2.432 1.00 0.00 H new ATOM 0 HD3 ARG A 53 8.822 1.955 -2.252 1.00 0.00 H new ATOM 0 HE ARG A 53 8.515 3.517 -4.776 1.00 0.00 H new ATOM 0 HH11 ARG A 53 8.629 0.409 -3.085 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.802 -0.520 -4.578 1.00 0.00 H new ATOM 0 HH21 ARG A 53 8.734 2.307 -6.676 1.00 0.00 H new ATOM 0 HH22 ARG A 53 8.861 0.547 -6.595 1.00 0.00 H new ATOM 882 N ASP A 54 6.650 2.304 0.820 1.00 0.00 N ATOM 883 CA ASP A 54 7.584 2.264 1.939 1.00 0.00 C ATOM 884 C ASP A 54 6.878 1.813 3.220 1.00 0.00 C ATOM 885 O ASP A 54 5.886 2.414 3.633 1.00 0.00 O ATOM 886 CB ASP A 54 8.204 3.644 2.158 1.00 0.00 C ATOM 887 CG ASP A 54 9.329 3.616 3.174 1.00 0.00 C ATOM 888 OD1 ASP A 54 9.064 3.271 4.344 1.00 0.00 O ATOM 889 OD2 ASP A 54 10.477 3.940 2.798 1.00 0.00 O ATOM 0 H ASP A 54 6.152 3.189 0.722 1.00 0.00 H new ATOM 0 HA ASP A 54 8.369 1.547 1.699 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.584 4.024 1.209 1.00 0.00 H new ATOM 0 HB3 ASP A 54 7.432 4.337 2.493 1.00 0.00 H new ATOM 894 N PRO A 55 7.380 0.746 3.868 1.00 0.00 N ATOM 895 CA PRO A 55 6.790 0.222 5.106 1.00 0.00 C ATOM 896 C PRO A 55 7.058 1.122 6.309 1.00 0.00 C ATOM 897 O PRO A 55 6.234 1.219 7.220 1.00 0.00 O ATOM 898 CB PRO A 55 7.490 -1.125 5.284 1.00 0.00 C ATOM 899 CG PRO A 55 8.804 -0.962 4.603 1.00 0.00 C ATOM 900 CD PRO A 55 8.560 -0.033 3.445 1.00 0.00 C ATOM 0 HA PRO A 55 5.704 0.153 5.042 1.00 0.00 H new ATOM 0 HB2 PRO A 55 7.618 -1.368 6.339 1.00 0.00 H new ATOM 0 HB3 PRO A 55 6.911 -1.934 4.839 1.00 0.00 H new ATOM 0 HG2 PRO A 55 9.548 -0.549 5.284 1.00 0.00 H new ATOM 0 HG3 PRO A 55 9.186 -1.923 4.258 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.420 0.611 3.259 1.00 0.00 H new ATOM 0 HD3 PRO A 55 8.368 -0.583 2.523 1.00 0.00 H new ATOM 908 N GLN A 56 8.215 1.774 6.307 1.00 0.00 N ATOM 909 CA GLN A 56 8.600 2.666 7.398 1.00 0.00 C ATOM 910 C GLN A 56 7.600 3.805 7.554 1.00 0.00 C ATOM 911 O GLN A 56 7.322 4.255 8.666 1.00 0.00 O ATOM 912 CB GLN A 56 9.997 3.234 7.143 1.00 0.00 C ATOM 913 CG GLN A 56 10.758 3.574 8.413 1.00 0.00 C ATOM 914 CD GLN A 56 10.719 5.054 8.737 1.00 0.00 C ATOM 915 OE1 GLN A 56 10.467 5.887 7.866 1.00 0.00 O ATOM 916 NE2 GLN A 56 10.970 5.390 9.998 1.00 0.00 N ATOM 0 H GLN A 56 8.906 1.702 5.560 1.00 0.00 H new ATOM 0 HA GLN A 56 8.607 2.087 8.322 1.00 0.00 H new ATOM 0 HB2 GLN A 56 10.574 2.511 6.567 1.00 0.00 H new ATOM 0 HB3 GLN A 56 9.909 4.132 6.531 1.00 0.00 H new ATOM 0 HG2 GLN A 56 10.336 3.012 9.246 1.00 0.00 H new ATOM 0 HG3 GLN A 56 11.795 3.256 8.307 1.00 0.00 H new ATOM 0 HE21 GLN A 56 11.174 4.667 10.688 1.00 0.00 H new ATOM 0 HE22 GLN A 56 10.958 6.371 10.276 1.00 0.00 H new ATOM 925 N HIS A 57 7.063 4.267 6.432 1.00 0.00 N ATOM 926 CA HIS A 57 6.096 5.358 6.441 1.00 0.00 C ATOM 927 C HIS A 57 4.739 4.872 6.918 1.00 0.00 C ATOM 928 O HIS A 57 4.190 5.384 7.892 1.00 0.00 O ATOM 929 CB HIS A 57 5.964 5.966 5.044 1.00 0.00 C ATOM 930 CG HIS A 57 5.883 7.459 5.047 1.00 0.00 C ATOM 931 ND1 HIS A 57 6.835 8.264 4.460 1.00 0.00 N ATOM 932 CD2 HIS A 57 4.955 8.297 5.568 1.00 0.00 C ATOM 933 CE1 HIS A 57 6.500 9.530 4.619 1.00 0.00 C ATOM 934 NE2 HIS A 57 5.362 9.578 5.288 1.00 0.00 N ATOM 0 H HIS A 57 7.280 3.903 5.504 1.00 0.00 H new ATOM 0 HA HIS A 57 6.457 6.122 7.130 1.00 0.00 H new ATOM 0 HB2 HIS A 57 6.818 5.658 4.440 1.00 0.00 H new ATOM 0 HB3 HIS A 57 5.072 5.563 4.564 1.00 0.00 H new ATOM 0 HD2 HIS A 57 4.062 8.011 6.104 1.00 0.00 H new ATOM 0 HE1 HIS A 57 7.060 10.382 4.263 1.00 0.00 H new ATOM 0 HE2 HIS A 57 4.866 10.429 5.554 1.00 0.00 H new ATOM 942 N LEU A 58 4.208 3.880 6.219 1.00 0.00 N ATOM 943 CA LEU A 58 2.910 3.310 6.550 1.00 0.00 C ATOM 944 C LEU A 58 2.753 3.126 8.051 1.00 0.00 C ATOM 945 O LEU A 58 1.731 3.490 8.632 1.00 0.00 O ATOM 946 CB LEU A 58 2.750 1.966 5.855 1.00 0.00 C ATOM 947 CG LEU A 58 1.393 1.754 5.202 1.00 0.00 C ATOM 948 CD1 LEU A 58 1.552 1.505 3.713 1.00 0.00 C ATOM 949 CD2 LEU A 58 0.657 0.603 5.877 1.00 0.00 C ATOM 0 H LEU A 58 4.660 3.450 5.412 1.00 0.00 H new ATOM 0 HA LEU A 58 2.140 4.001 6.208 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.525 1.870 5.094 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.917 1.172 6.583 1.00 0.00 H new ATOM 0 HG LEU A 58 0.797 2.658 5.328 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.571 1.355 3.262 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.037 2.365 3.250 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.163 0.616 3.556 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.313 0.462 5.400 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.245 -0.310 5.782 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.512 0.833 6.933 1.00 0.00 H new ATOM 961 N LEU A 59 3.777 2.557 8.665 1.00 0.00 N ATOM 962 CA LEU A 59 3.766 2.314 10.096 1.00 0.00 C ATOM 963 C LEU A 59 3.770 3.632 10.863 1.00 0.00 C ATOM 964 O LEU A 59 2.985 3.824 11.791 1.00 0.00 O ATOM 965 CB LEU A 59 4.971 1.462 10.492 1.00 0.00 C ATOM 966 CG LEU A 59 4.688 0.395 11.548 1.00 0.00 C ATOM 967 CD1 LEU A 59 5.972 -0.317 11.939 1.00 0.00 C ATOM 968 CD2 LEU A 59 4.028 1.024 12.765 1.00 0.00 C ATOM 0 H LEU A 59 4.629 2.254 8.192 1.00 0.00 H new ATOM 0 HA LEU A 59 2.855 1.773 10.351 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.361 0.974 9.599 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.756 2.120 10.864 1.00 0.00 H new ATOM 0 HG LEU A 59 4.004 -0.343 11.128 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.753 -1.074 12.692 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.406 -0.794 11.060 1.00 0.00 H new ATOM 0 HD13 LEU A 59 6.679 0.406 12.346 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.831 0.254 13.511 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.690 1.779 13.189 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.089 1.491 12.469 1.00 0.00 H new ATOM 980 N LYS A 60 4.652 4.540 10.460 1.00 0.00 N ATOM 981 CA LYS A 60 4.757 5.845 11.099 1.00 0.00 C ATOM 982 C LYS A 60 3.412 6.569 11.083 1.00 0.00 C ATOM 983 O LYS A 60 3.041 7.231 12.052 1.00 0.00 O ATOM 984 CB LYS A 60 5.817 6.693 10.390 1.00 0.00 C ATOM 985 CG LYS A 60 6.995 7.072 11.275 1.00 0.00 C ATOM 986 CD LYS A 60 6.822 8.457 11.880 1.00 0.00 C ATOM 987 CE LYS A 60 6.730 9.534 10.809 1.00 0.00 C ATOM 988 NZ LYS A 60 8.075 10.004 10.372 1.00 0.00 N ATOM 0 H LYS A 60 5.306 4.395 9.691 1.00 0.00 H new ATOM 0 HA LYS A 60 5.053 5.695 12.137 1.00 0.00 H new ATOM 0 HB2 LYS A 60 6.187 6.145 9.524 1.00 0.00 H new ATOM 0 HB3 LYS A 60 5.349 7.603 10.015 1.00 0.00 H new ATOM 0 HG2 LYS A 60 7.102 6.337 12.073 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.914 7.043 10.690 1.00 0.00 H new ATOM 0 HD2 LYS A 60 5.921 8.476 12.493 1.00 0.00 H new ATOM 0 HD3 LYS A 60 7.662 8.672 12.541 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.185 9.144 9.949 1.00 0.00 H new ATOM 0 HE3 LYS A 60 6.158 10.379 11.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 7.966 10.737 9.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 8.586 10.400 11.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 8.612 9.204 9.982 1.00 0.00 H new ATOM 1002 N PHE A 61 2.684 6.438 9.975 1.00 0.00 N ATOM 1003 CA PHE A 61 1.380 7.080 9.830 1.00 0.00 C ATOM 1004 C PHE A 61 0.330 6.363 10.673 1.00 0.00 C ATOM 1005 O PHE A 61 -0.569 6.990 11.234 1.00 0.00 O ATOM 1006 CB PHE A 61 0.962 7.105 8.359 1.00 0.00 C ATOM 1007 CG PHE A 61 0.905 8.487 7.778 1.00 0.00 C ATOM 1008 CD1 PHE A 61 0.260 9.509 8.456 1.00 0.00 C ATOM 1009 CD2 PHE A 61 1.494 8.765 6.556 1.00 0.00 C ATOM 1010 CE1 PHE A 61 0.204 10.783 7.925 1.00 0.00 C ATOM 1011 CE2 PHE A 61 1.441 10.037 6.020 1.00 0.00 C ATOM 1012 CZ PHE A 61 0.796 11.048 6.706 1.00 0.00 C ATOM 0 H PHE A 61 2.976 5.892 9.164 1.00 0.00 H new ATOM 0 HA PHE A 61 1.459 8.107 10.186 1.00 0.00 H new ATOM 0 HB2 PHE A 61 1.663 6.504 7.780 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -0.017 6.637 8.259 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -0.204 9.307 9.410 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.000 7.979 6.016 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.302 11.571 8.463 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.903 10.241 5.066 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.755 12.044 6.290 1.00 0.00 H new ATOM 1022 N LEU A 62 0.460 5.046 10.764 1.00 0.00 N ATOM 1023 CA LEU A 62 -0.459 4.231 11.544 1.00 0.00 C ATOM 1024 C LEU A 62 -0.490 4.704 12.999 1.00 0.00 C ATOM 1025 O LEU A 62 -1.535 5.109 13.505 1.00 0.00 O ATOM 1026 CB LEU A 62 -0.017 2.764 11.453 1.00 0.00 C ATOM 1027 CG LEU A 62 -0.472 1.844 12.590 1.00 0.00 C ATOM 1028 CD1 LEU A 62 -1.888 1.354 12.348 1.00 0.00 C ATOM 1029 CD2 LEU A 62 0.476 0.661 12.724 1.00 0.00 C ATOM 0 H LEU A 62 1.200 4.517 10.303 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.469 4.328 11.145 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -0.386 2.354 10.513 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.072 2.737 11.407 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.457 2.414 13.519 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.192 0.702 13.167 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.564 2.207 12.293 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -1.926 0.800 11.410 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.140 0.016 13.536 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.487 0.096 11.792 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.481 1.023 12.940 1.00 0.00 H new ATOM 1041 N LEU A 63 0.659 4.662 13.664 1.00 0.00 N ATOM 1042 CA LEU A 63 0.751 5.093 15.055 1.00 0.00 C ATOM 1043 C LEU A 63 0.484 6.591 15.194 1.00 0.00 C ATOM 1044 O LEU A 63 -0.021 7.049 16.219 1.00 0.00 O ATOM 1045 CB LEU A 63 2.128 4.753 15.620 1.00 0.00 C ATOM 1046 CG LEU A 63 2.274 3.316 16.125 1.00 0.00 C ATOM 1047 CD1 LEU A 63 1.560 3.145 17.457 1.00 0.00 C ATOM 1048 CD2 LEU A 63 1.729 2.336 15.096 1.00 0.00 C ATOM 0 H LEU A 63 1.538 4.335 13.264 1.00 0.00 H new ATOM 0 HA LEU A 63 -0.013 4.561 15.621 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.877 4.930 14.848 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.348 5.436 16.440 1.00 0.00 H new ATOM 0 HG LEU A 63 3.333 3.106 16.275 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.674 2.117 17.802 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.993 3.824 18.192 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.501 3.371 17.334 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.840 1.318 15.469 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.674 2.545 14.918 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.282 2.443 14.163 1.00 0.00 H new ATOM 1060 N ARG A 64 0.829 7.353 14.158 1.00 0.00 N ATOM 1061 CA ARG A 64 0.625 8.796 14.178 1.00 0.00 C ATOM 1062 C ARG A 64 -0.860 9.146 14.188 1.00 0.00 C ATOM 1063 O ARG A 64 -1.251 10.216 14.653 1.00 0.00 O ATOM 1064 CB ARG A 64 1.312 9.451 12.980 1.00 0.00 C ATOM 1065 CG ARG A 64 2.766 9.812 13.236 1.00 0.00 C ATOM 1066 CD ARG A 64 2.905 10.815 14.370 1.00 0.00 C ATOM 1067 NE ARG A 64 2.329 12.112 14.029 1.00 0.00 N ATOM 1068 CZ ARG A 64 3.004 13.090 13.428 1.00 0.00 C ATOM 1069 NH1 ARG A 64 4.275 12.916 13.085 1.00 0.00 N ATOM 1070 NH2 ARG A 64 2.406 14.243 13.165 1.00 0.00 N ATOM 0 H ARG A 64 1.249 6.996 13.300 1.00 0.00 H new ATOM 0 HA ARG A 64 1.070 9.181 15.095 1.00 0.00 H new ATOM 0 HB2 ARG A 64 1.259 8.775 12.127 1.00 0.00 H new ATOM 0 HB3 ARG A 64 0.765 10.353 12.706 1.00 0.00 H new ATOM 0 HG2 ARG A 64 3.328 8.910 13.477 1.00 0.00 H new ATOM 0 HG3 ARG A 64 3.203 10.227 12.328 1.00 0.00 H new ATOM 0 HD2 ARG A 64 2.415 10.424 15.261 1.00 0.00 H new ATOM 0 HD3 ARG A 64 3.960 10.940 14.615 1.00 0.00 H new ATOM 0 HE ARG A 64 1.351 12.279 14.265 1.00 0.00 H new ATOM 0 HH11 ARG A 64 4.740 12.029 13.282 1.00 0.00 H new ATOM 0 HH12 ARG A 64 4.787 13.669 12.625 1.00 0.00 H new ATOM 0 HH21 ARG A 64 1.429 14.381 13.423 1.00 0.00 H new ATOM 0 HH22 ARG A 64 2.923 14.992 12.705 1.00 0.00 H new ATOM 1084 N GLU A 65 -1.683 8.237 13.680 1.00 0.00 N ATOM 1085 CA GLU A 65 -3.125 8.454 13.644 1.00 0.00 C ATOM 1086 C GLU A 65 -3.837 7.548 14.647 1.00 0.00 C ATOM 1087 O GLU A 65 -5.026 7.717 14.910 1.00 0.00 O ATOM 1088 CB GLU A 65 -3.669 8.201 12.236 1.00 0.00 C ATOM 1089 CG GLU A 65 -4.442 9.380 11.665 1.00 0.00 C ATOM 1090 CD GLU A 65 -4.504 9.369 10.148 1.00 0.00 C ATOM 1091 OE1 GLU A 65 -4.064 8.370 9.541 1.00 0.00 O ATOM 1092 OE2 GLU A 65 -4.994 10.361 9.568 1.00 0.00 O ATOM 0 H GLU A 65 -1.379 7.346 13.289 1.00 0.00 H new ATOM 0 HA GLU A 65 -3.316 9.492 13.917 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -2.838 7.965 11.571 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.319 7.326 12.258 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -5.456 9.371 12.065 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -3.977 10.308 11.998 1.00 0.00 H new ATOM 1099 N LEU A 66 -3.104 6.584 15.201 1.00 0.00 N ATOM 1100 CA LEU A 66 -3.667 5.648 16.170 1.00 0.00 C ATOM 1101 C LEU A 66 -3.810 6.288 17.546 1.00 0.00 C ATOM 1102 O LEU A 66 -2.902 6.208 18.374 1.00 0.00 O ATOM 1103 CB LEU A 66 -2.789 4.396 16.272 1.00 0.00 C ATOM 1104 CG LEU A 66 -3.361 3.145 15.607 1.00 0.00 C ATOM 1105 CD1 LEU A 66 -3.778 3.444 14.173 1.00 0.00 C ATOM 1106 CD2 LEU A 66 -2.351 2.008 15.652 1.00 0.00 C ATOM 0 H LEU A 66 -2.117 6.431 14.994 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.660 5.368 15.819 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.819 4.614 15.825 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.613 4.180 17.326 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.248 2.834 16.160 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.183 2.541 13.716 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.539 4.224 14.171 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.911 3.781 13.605 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.775 1.125 15.174 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.444 2.306 15.125 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.109 1.778 16.689 1.00 0.00 H new ATOM 1118 N GLY A 67 -4.960 6.908 17.790 1.00 0.00 N ATOM 1119 CA GLY A 67 -5.202 7.534 19.077 1.00 0.00 C ATOM 1120 C GLY A 67 -5.524 6.521 20.161 1.00 0.00 C ATOM 1121 O GLY A 67 -5.550 6.859 21.344 1.00 0.00 O ATOM 0 H GLY A 67 -5.727 6.988 17.122 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.323 8.109 19.370 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.028 8.239 18.986 1.00 0.00 H new ATOM 1125 N THR A 68 -5.755 5.271 19.760 1.00 0.00 N ATOM 1126 CA THR A 68 -6.059 4.206 20.713 1.00 0.00 C ATOM 1127 C THR A 68 -4.816 3.360 20.968 1.00 0.00 C ATOM 1128 O THR A 68 -3.815 3.490 20.262 1.00 0.00 O ATOM 1129 CB THR A 68 -7.235 3.318 20.236 1.00 0.00 C ATOM 1130 OG1 THR A 68 -6.789 2.049 19.780 1.00 0.00 O ATOM 1131 CG2 THR A 68 -8.075 3.922 19.126 1.00 0.00 C ATOM 0 H THR A 68 -5.737 4.973 18.785 1.00 0.00 H new ATOM 0 HA THR A 68 -6.370 4.676 21.646 1.00 0.00 H new ATOM 0 HB THR A 68 -7.857 3.225 21.127 1.00 0.00 H new ATOM 0 HG1 THR A 68 -5.962 2.158 19.265 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.874 3.231 18.857 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.508 4.862 19.468 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.447 4.108 18.255 1.00 0.00 H new ATOM 1139 N ALA A 69 -4.884 2.503 21.985 1.00 0.00 N ATOM 1140 CA ALA A 69 -3.763 1.633 22.352 1.00 0.00 C ATOM 1141 C ALA A 69 -2.868 1.297 21.154 1.00 0.00 C ATOM 1142 O ALA A 69 -1.705 1.697 21.110 1.00 0.00 O ATOM 1143 CB ALA A 69 -4.276 0.356 22.994 1.00 0.00 C ATOM 0 H ALA A 69 -5.709 2.391 22.575 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.153 2.182 23.069 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -3.433 -0.281 23.262 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.844 0.602 23.891 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.920 -0.171 22.291 1.00 0.00 H new ATOM 1149 N GLY A 70 -3.414 0.566 20.185 1.00 0.00 N ATOM 1150 CA GLY A 70 -2.640 0.199 19.008 1.00 0.00 C ATOM 1151 C GLY A 70 -1.881 -1.106 19.183 1.00 0.00 C ATOM 1152 O GLY A 70 -0.801 -1.130 19.774 1.00 0.00 O ATOM 0 H GLY A 70 -4.374 0.222 20.192 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -3.309 0.112 18.152 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -1.933 0.997 18.781 1.00 0.00 H new ATOM 1156 N ASN A 71 -2.451 -2.193 18.665 1.00 0.00 N ATOM 1157 CA ASN A 71 -1.831 -3.513 18.755 1.00 0.00 C ATOM 1158 C ASN A 71 -2.487 -4.484 17.781 1.00 0.00 C ATOM 1159 O ASN A 71 -3.566 -4.219 17.268 1.00 0.00 O ATOM 1160 CB ASN A 71 -1.940 -4.060 20.182 1.00 0.00 C ATOM 1161 CG ASN A 71 -0.603 -4.171 20.905 1.00 0.00 C ATOM 1162 OD1 ASN A 71 -0.543 -4.686 22.021 1.00 0.00 O ATOM 1163 ND2 ASN A 71 0.479 -3.691 20.291 1.00 0.00 N ATOM 0 H ASN A 71 -3.346 -2.184 18.176 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.778 -3.410 18.493 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -2.601 -3.413 20.759 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -2.407 -5.045 20.149 1.00 0.00 H new ATOM 0 HD21 ASN A 71 1.390 -3.745 20.747 1.00 0.00 H new ATOM 0 HD22 ASN A 71 0.396 -3.270 19.366 1.00 0.00 H new ATOM 1170 N LEU A 72 -1.831 -5.612 17.540 1.00 0.00 N ATOM 1171 CA LEU A 72 -2.358 -6.624 16.630 1.00 0.00 C ATOM 1172 C LEU A 72 -3.355 -7.538 17.338 1.00 0.00 C ATOM 1173 O LEU A 72 -2.971 -8.370 18.159 1.00 0.00 O ATOM 1174 CB LEU A 72 -1.214 -7.453 16.052 1.00 0.00 C ATOM 1175 CG LEU A 72 -0.027 -6.638 15.536 1.00 0.00 C ATOM 1176 CD1 LEU A 72 1.122 -6.681 16.533 1.00 0.00 C ATOM 1177 CD2 LEU A 72 0.422 -7.148 14.175 1.00 0.00 C ATOM 0 H LEU A 72 -0.933 -5.850 17.961 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.880 -6.112 15.821 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.858 -8.140 16.820 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.602 -8.061 15.235 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.344 -5.601 15.423 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.958 -6.096 16.150 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.793 -6.264 17.485 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.438 -7.714 16.679 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.267 -6.555 13.825 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.721 -8.193 14.259 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.400 -7.062 13.465 1.00 0.00 H new ATOM 1189 N GLU A 73 -4.633 -7.390 17.000 1.00 0.00 N ATOM 1190 CA GLU A 73 -5.678 -8.218 17.591 1.00 0.00 C ATOM 1191 C GLU A 73 -6.152 -9.277 16.598 1.00 0.00 C ATOM 1192 O GLU A 73 -6.106 -9.066 15.385 1.00 0.00 O ATOM 1193 CB GLU A 73 -6.861 -7.355 18.043 1.00 0.00 C ATOM 1194 CG GLU A 73 -6.732 -6.841 19.468 1.00 0.00 C ATOM 1195 CD GLU A 73 -7.118 -7.882 20.502 1.00 0.00 C ATOM 1196 OE1 GLU A 73 -8.329 -8.138 20.662 1.00 0.00 O ATOM 1197 OE2 GLU A 73 -6.207 -8.440 21.150 1.00 0.00 O ATOM 0 H GLU A 73 -4.969 -6.706 16.322 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.259 -8.720 18.463 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -6.959 -6.506 17.367 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -7.778 -7.938 17.958 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.704 -6.524 19.644 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -7.363 -5.961 19.591 1.00 0.00 H new ATOM 1204 N GLY A 74 -6.610 -10.411 17.117 1.00 0.00 N ATOM 1205 CA GLY A 74 -7.089 -11.479 16.258 1.00 0.00 C ATOM 1206 C GLY A 74 -5.967 -12.180 15.518 1.00 0.00 C ATOM 1207 O GLY A 74 -4.798 -11.825 15.668 1.00 0.00 O ATOM 0 H GLY A 74 -6.658 -10.610 18.116 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -7.633 -12.207 16.859 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -7.796 -11.070 15.536 1.00 0.00 H new ATOM 1211 N GLY A 75 -6.323 -13.180 14.717 1.00 0.00 N ATOM 1212 CA GLY A 75 -5.328 -13.920 13.960 1.00 0.00 C ATOM 1213 C GLY A 75 -4.710 -13.102 12.840 1.00 0.00 C ATOM 1214 O GLY A 75 -3.751 -13.536 12.202 1.00 0.00 O ATOM 0 H GLY A 75 -7.284 -13.492 14.578 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.541 -14.256 14.635 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -5.789 -14.813 13.539 1.00 0.00 H new ATOM 1218 N ARG A 76 -5.264 -11.918 12.602 1.00 0.00 N ATOM 1219 CA ARG A 76 -4.772 -11.031 11.557 1.00 0.00 C ATOM 1220 C ARG A 76 -4.110 -9.814 12.190 1.00 0.00 C ATOM 1221 O ARG A 76 -3.664 -9.878 13.335 1.00 0.00 O ATOM 1222 CB ARG A 76 -5.930 -10.611 10.641 1.00 0.00 C ATOM 1223 CG ARG A 76 -7.051 -11.642 10.560 1.00 0.00 C ATOM 1224 CD ARG A 76 -7.316 -12.084 9.130 1.00 0.00 C ATOM 1225 NE ARG A 76 -7.472 -13.534 9.030 1.00 0.00 N ATOM 1226 CZ ARG A 76 -6.707 -14.321 8.277 1.00 0.00 C ATOM 1227 NH1 ARG A 76 -5.750 -13.807 7.514 1.00 0.00 N ATOM 1228 NH2 ARG A 76 -6.904 -15.632 8.281 1.00 0.00 N ATOM 0 H ARG A 76 -6.060 -11.550 13.123 1.00 0.00 H new ATOM 0 HA ARG A 76 -4.031 -11.554 10.952 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.341 -9.667 10.999 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.542 -10.430 9.639 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.790 -12.510 11.165 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.962 -11.221 10.984 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.217 -11.595 8.760 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.493 -11.762 8.492 1.00 0.00 H new ATOM 0 HE ARG A 76 -8.216 -13.972 9.573 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -5.595 -12.799 7.501 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -5.170 -14.420 6.941 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -7.640 -16.035 8.860 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -6.319 -16.237 7.705 1.00 0.00 H new ATOM 1242 N ALA A 77 -4.048 -8.703 11.464 1.00 0.00 N ATOM 1243 CA ALA A 77 -3.439 -7.498 12.010 1.00 0.00 C ATOM 1244 C ALA A 77 -4.505 -6.456 12.325 1.00 0.00 C ATOM 1245 O ALA A 77 -4.562 -5.396 11.699 1.00 0.00 O ATOM 1246 CB ALA A 77 -2.386 -6.942 11.061 1.00 0.00 C ATOM 0 H ALA A 77 -4.405 -8.612 10.513 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.937 -7.759 12.942 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.946 -6.042 11.492 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.607 -7.688 10.905 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -2.850 -6.697 10.106 1.00 0.00 H new ATOM 1252 N ILE A 78 -5.352 -6.773 13.302 1.00 0.00 N ATOM 1253 CA ILE A 78 -6.420 -5.873 13.708 1.00 0.00 C ATOM 1254 C ILE A 78 -5.944 -4.922 14.797 1.00 0.00 C ATOM 1255 O ILE A 78 -6.023 -5.226 15.984 1.00 0.00 O ATOM 1256 CB ILE A 78 -7.652 -6.642 14.218 1.00 0.00 C ATOM 1257 CG1 ILE A 78 -8.237 -7.508 13.104 1.00 0.00 C ATOM 1258 CG2 ILE A 78 -8.703 -5.674 14.743 1.00 0.00 C ATOM 1259 CD1 ILE A 78 -9.114 -8.628 13.617 1.00 0.00 C ATOM 0 H ILE A 78 -5.316 -7.648 13.825 1.00 0.00 H new ATOM 0 HA ILE A 78 -6.704 -5.304 12.823 1.00 0.00 H new ATOM 0 HB ILE A 78 -7.340 -7.292 15.036 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.819 -6.878 12.431 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -7.422 -7.933 12.517 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -9.567 -6.234 15.100 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -8.284 -5.092 15.564 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -9.011 -5.002 13.942 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -9.497 -9.205 12.775 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -8.529 -9.279 14.267 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -9.948 -8.208 14.179 1.00 0.00 H new ATOM 1271 N LEU A 79 -5.457 -3.771 14.382 1.00 0.00 N ATOM 1272 CA LEU A 79 -4.972 -2.770 15.315 1.00 0.00 C ATOM 1273 C LEU A 79 -6.119 -1.905 15.818 1.00 0.00 C ATOM 1274 O LEU A 79 -7.282 -2.194 15.559 1.00 0.00 O ATOM 1275 CB LEU A 79 -3.940 -1.900 14.624 1.00 0.00 C ATOM 1276 CG LEU A 79 -4.491 -1.186 13.399 1.00 0.00 C ATOM 1277 CD1 LEU A 79 -4.724 0.281 13.698 1.00 0.00 C ATOM 1278 CD2 LEU A 79 -3.566 -1.366 12.207 1.00 0.00 C ATOM 0 H LEU A 79 -5.386 -3.503 13.400 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.519 -3.273 16.169 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.564 -1.160 15.331 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.092 -2.517 14.328 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.451 -1.633 13.143 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -5.118 0.775 12.810 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.440 0.377 14.514 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.782 0.748 13.985 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.981 -0.847 11.343 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.585 -0.953 12.442 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.468 -2.428 11.980 1.00 0.00 H new ATOM 1290 N GLN A 80 -5.783 -0.841 16.536 1.00 0.00 N ATOM 1291 CA GLN A 80 -6.791 0.063 17.073 1.00 0.00 C ATOM 1292 C GLN A 80 -6.284 1.504 17.084 1.00 0.00 C ATOM 1293 O GLN A 80 -5.294 1.812 17.745 1.00 0.00 O ATOM 1294 CB GLN A 80 -7.167 -0.377 18.487 1.00 0.00 C ATOM 1295 CG GLN A 80 -8.570 0.031 18.900 1.00 0.00 C ATOM 1296 CD GLN A 80 -9.431 -1.153 19.298 1.00 0.00 C ATOM 1297 OE1 GLN A 80 -8.928 -2.254 19.517 1.00 0.00 O ATOM 1298 NE2 GLN A 80 -10.738 -0.934 19.383 1.00 0.00 N ATOM 0 H GLN A 80 -4.822 -0.583 16.760 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.673 0.024 16.434 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -7.078 -1.461 18.556 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.452 0.047 19.192 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -8.510 0.728 19.736 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.047 0.561 18.076 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -11.113 -0.005 19.193 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -11.367 -1.695 19.638 1.00 0.00 H new ATOM 1307 N GLY A 81 -6.963 2.386 16.346 1.00 0.00 N ATOM 1308 CA GLY A 81 -6.542 3.775 16.299 1.00 0.00 C ATOM 1309 C GLY A 81 -7.536 4.687 15.609 1.00 0.00 C ATOM 1310 O GLY A 81 -8.658 4.870 16.081 1.00 0.00 O ATOM 0 H GLY A 81 -7.787 2.164 15.787 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.380 4.131 17.316 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.584 3.838 15.783 1.00 0.00 H new ATOM 1314 N LYS A 82 -7.113 5.269 14.487 1.00 0.00 N ATOM 1315 CA LYS A 82 -7.960 6.177 13.722 1.00 0.00 C ATOM 1316 C LYS A 82 -7.736 6.004 12.224 1.00 0.00 C ATOM 1317 O LYS A 82 -8.072 6.886 11.433 1.00 0.00 O ATOM 1318 CB LYS A 82 -7.680 7.628 14.118 1.00 0.00 C ATOM 1319 CG LYS A 82 -8.931 8.488 14.231 1.00 0.00 C ATOM 1320 CD LYS A 82 -8.948 9.276 15.531 1.00 0.00 C ATOM 1321 CE LYS A 82 -8.941 8.356 16.742 1.00 0.00 C ATOM 1322 NZ LYS A 82 -10.303 7.855 17.071 1.00 0.00 N ATOM 0 H LYS A 82 -6.185 5.126 14.089 1.00 0.00 H new ATOM 0 HA LYS A 82 -8.998 5.935 13.949 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -7.156 7.639 15.074 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.010 8.073 13.382 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -8.979 9.176 13.387 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -9.816 7.854 14.177 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -8.081 9.935 15.569 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -9.833 9.911 15.561 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -8.280 7.510 16.551 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -8.534 8.890 17.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -10.252 7.232 17.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -10.928 8.660 17.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -10.682 7.323 16.262 1.00 0.00 H new ATOM 1336 N PHE A 83 -7.181 4.861 11.834 1.00 0.00 N ATOM 1337 CA PHE A 83 -6.931 4.578 10.429 1.00 0.00 C ATOM 1338 C PHE A 83 -8.227 4.157 9.738 1.00 0.00 C ATOM 1339 O PHE A 83 -8.271 3.166 9.009 1.00 0.00 O ATOM 1340 CB PHE A 83 -5.854 3.498 10.293 1.00 0.00 C ATOM 1341 CG PHE A 83 -4.527 4.033 9.821 1.00 0.00 C ATOM 1342 CD1 PHE A 83 -4.086 5.289 10.212 1.00 0.00 C ATOM 1343 CD2 PHE A 83 -3.722 3.280 8.982 1.00 0.00 C ATOM 1344 CE1 PHE A 83 -2.870 5.779 9.774 1.00 0.00 C ATOM 1345 CE2 PHE A 83 -2.505 3.765 8.541 1.00 0.00 C ATOM 1346 CZ PHE A 83 -2.080 5.016 8.937 1.00 0.00 C ATOM 0 H PHE A 83 -6.897 4.118 12.472 1.00 0.00 H new ATOM 0 HA PHE A 83 -6.567 5.482 9.941 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -5.718 3.008 11.257 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.200 2.736 9.594 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -4.700 5.891 10.866 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -4.050 2.300 8.668 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -2.538 6.758 10.086 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -1.888 3.166 7.888 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.130 5.398 8.593 1.00 0.00 H new ATOM 1356 N THR A 84 -9.281 4.935 9.982 1.00 0.00 N ATOM 1357 CA THR A 84 -10.594 4.687 9.402 1.00 0.00 C ATOM 1358 C THR A 84 -10.594 5.077 7.930 1.00 0.00 C ATOM 1359 O THR A 84 -11.109 6.131 7.560 1.00 0.00 O ATOM 1360 CB THR A 84 -11.649 5.495 10.161 1.00 0.00 C ATOM 1361 OG1 THR A 84 -11.379 5.484 11.553 1.00 0.00 O ATOM 1362 CG2 THR A 84 -13.064 4.991 9.966 1.00 0.00 C ATOM 0 H THR A 84 -9.245 5.755 10.588 1.00 0.00 H new ATOM 0 HA THR A 84 -10.830 3.626 9.483 1.00 0.00 H new ATOM 0 HB THR A 84 -11.586 6.501 9.747 1.00 0.00 H new ATOM 0 HG1 THR A 84 -12.062 6.007 12.023 1.00 0.00 H new ATOM 0 HG21 THR A 84 -13.754 5.614 10.535 1.00 0.00 H new ATOM 0 HG22 THR A 84 -13.323 5.035 8.908 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.134 3.961 10.314 1.00 0.00 H new ATOM 1370 N HIS A 85 -9.985 4.235 7.103 1.00 0.00 N ATOM 1371 CA HIS A 85 -9.877 4.495 5.670 1.00 0.00 C ATOM 1372 C HIS A 85 -9.515 5.955 5.414 1.00 0.00 C ATOM 1373 O HIS A 85 -9.983 6.563 4.452 1.00 0.00 O ATOM 1374 CB HIS A 85 -11.197 4.164 4.968 1.00 0.00 C ATOM 1375 CG HIS A 85 -12.331 5.058 5.368 1.00 0.00 C ATOM 1376 ND1 HIS A 85 -12.605 6.254 4.739 1.00 0.00 N ATOM 1377 CD2 HIS A 85 -13.265 4.931 6.342 1.00 0.00 C ATOM 1378 CE1 HIS A 85 -13.652 6.824 5.306 1.00 0.00 C ATOM 1379 NE2 HIS A 85 -14.072 6.040 6.281 1.00 0.00 N ATOM 0 H HIS A 85 -9.555 3.360 7.402 1.00 0.00 H new ATOM 0 HA HIS A 85 -9.088 3.859 5.269 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -11.053 4.235 3.890 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -11.466 3.131 5.187 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -12.079 6.640 3.955 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -13.357 4.110 7.037 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -14.090 7.769 5.021 1.00 0.00 H new ATOM 1387 N PHE A 86 -8.665 6.505 6.275 1.00 0.00 N ATOM 1388 CA PHE A 86 -8.225 7.885 6.133 1.00 0.00 C ATOM 1389 C PHE A 86 -6.938 7.961 5.323 1.00 0.00 C ATOM 1390 O PHE A 86 -6.955 8.298 4.142 1.00 0.00 O ATOM 1391 CB PHE A 86 -8.044 8.543 7.502 1.00 0.00 C ATOM 1392 CG PHE A 86 -8.904 9.762 7.683 1.00 0.00 C ATOM 1393 CD1 PHE A 86 -8.474 11.001 7.237 1.00 0.00 C ATOM 1394 CD2 PHE A 86 -10.151 9.667 8.283 1.00 0.00 C ATOM 1395 CE1 PHE A 86 -9.268 12.123 7.386 1.00 0.00 C ATOM 1396 CE2 PHE A 86 -10.951 10.784 8.432 1.00 0.00 C ATOM 1397 CZ PHE A 86 -10.509 12.014 7.984 1.00 0.00 C ATOM 0 H PHE A 86 -8.268 6.015 7.077 1.00 0.00 H new ATOM 0 HA PHE A 86 -8.998 8.433 5.594 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -8.280 7.819 8.282 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -6.998 8.820 7.631 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -7.506 11.092 6.767 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -10.501 8.709 8.638 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -8.919 13.083 7.036 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -11.921 10.696 8.898 1.00 0.00 H new ATOM 0 HZ PHE A 86 -11.132 12.888 8.101 1.00 0.00 H new ATOM 1407 N LEU A 87 -5.820 7.638 5.971 1.00 0.00 N ATOM 1408 CA LEU A 87 -4.521 7.662 5.312 1.00 0.00 C ATOM 1409 C LEU A 87 -4.390 6.489 4.341 1.00 0.00 C ATOM 1410 O LEU A 87 -3.919 6.657 3.217 1.00 0.00 O ATOM 1411 CB LEU A 87 -3.392 7.612 6.349 1.00 0.00 C ATOM 1412 CG LEU A 87 -2.512 8.867 6.456 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -2.133 9.401 5.080 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -3.205 9.944 7.280 1.00 0.00 C ATOM 0 H LEU A 87 -5.790 7.357 6.951 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.441 8.593 4.750 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.833 7.419 7.327 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.750 6.763 6.116 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.592 8.582 6.966 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.511 10.289 5.193 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.580 8.637 4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.037 9.659 4.528 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.564 10.823 7.343 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.148 10.215 6.805 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.400 9.565 8.283 1.00 0.00 H new ATOM 1426 N ILE A 88 -4.811 5.298 4.778 1.00 0.00 N ATOM 1427 CA ILE A 88 -4.730 4.115 3.926 1.00 0.00 C ATOM 1428 C ILE A 88 -5.539 4.309 2.643 1.00 0.00 C ATOM 1429 O ILE A 88 -4.995 4.271 1.544 1.00 0.00 O ATOM 1430 CB ILE A 88 -5.256 2.838 4.631 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -4.602 2.632 6.012 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -5.022 1.627 3.735 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -4.922 1.285 6.643 1.00 0.00 C ATOM 0 H ILE A 88 -5.205 5.132 5.704 1.00 0.00 H new ATOM 0 HA ILE A 88 -3.672 3.985 3.698 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.326 2.960 4.802 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.521 2.729 5.911 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.932 3.425 6.683 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -5.392 0.730 4.232 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -5.551 1.764 2.792 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -3.955 1.520 3.540 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.428 1.211 7.612 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -6.000 1.193 6.777 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -4.567 0.485 5.993 1.00 0.00 H new ATOM 1445 N ASN A 89 -6.841 4.495 2.796 1.00 0.00 N ATOM 1446 CA ASN A 89 -7.735 4.664 1.653 1.00 0.00 C ATOM 1447 C ASN A 89 -7.343 5.851 0.769 1.00 0.00 C ATOM 1448 O ASN A 89 -7.213 5.705 -0.446 1.00 0.00 O ATOM 1449 CB ASN A 89 -9.178 4.818 2.133 1.00 0.00 C ATOM 1450 CG ASN A 89 -10.173 4.159 1.195 1.00 0.00 C ATOM 1451 OD1 ASN A 89 -10.284 4.535 0.028 1.00 0.00 O ATOM 1452 ND2 ASN A 89 -10.899 3.166 1.699 1.00 0.00 N ATOM 0 H ASN A 89 -7.307 4.533 3.703 1.00 0.00 H new ATOM 0 HA ASN A 89 -7.645 3.767 1.041 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -9.276 4.382 3.127 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.416 5.878 2.225 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -11.580 2.684 1.113 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -10.775 2.886 2.672 1.00 0.00 H new ATOM 1459 N GLU A 90 -7.174 7.023 1.375 1.00 0.00 N ATOM 1460 CA GLU A 90 -6.817 8.225 0.622 1.00 0.00 C ATOM 1461 C GLU A 90 -5.529 8.030 -0.161 1.00 0.00 C ATOM 1462 O GLU A 90 -5.488 8.217 -1.377 1.00 0.00 O ATOM 1463 CB GLU A 90 -6.656 9.425 1.559 1.00 0.00 C ATOM 1464 CG GLU A 90 -7.970 10.066 1.965 1.00 0.00 C ATOM 1465 CD GLU A 90 -7.843 11.564 2.169 1.00 0.00 C ATOM 1466 OE1 GLU A 90 -6.920 12.165 1.580 1.00 0.00 O ATOM 1467 OE2 GLU A 90 -8.663 12.135 2.917 1.00 0.00 O ATOM 0 H GLU A 90 -7.277 7.167 2.379 1.00 0.00 H new ATOM 0 HA GLU A 90 -7.629 8.416 -0.079 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -6.126 9.105 2.456 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -6.033 10.174 1.071 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.720 9.869 1.199 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -8.327 9.605 2.886 1.00 0.00 H new ATOM 1474 N ARG A 91 -4.475 7.666 0.550 1.00 0.00 N ATOM 1475 CA ARG A 91 -3.178 7.458 -0.063 1.00 0.00 C ATOM 1476 C ARG A 91 -3.249 6.368 -1.127 1.00 0.00 C ATOM 1477 O ARG A 91 -2.784 6.555 -2.249 1.00 0.00 O ATOM 1478 CB ARG A 91 -2.157 7.106 1.013 1.00 0.00 C ATOM 1479 CG ARG A 91 -0.729 7.003 0.508 1.00 0.00 C ATOM 1480 CD ARG A 91 -0.015 8.344 0.562 1.00 0.00 C ATOM 1481 NE ARG A 91 -0.552 9.288 -0.411 1.00 0.00 N ATOM 1482 CZ ARG A 91 0.034 10.436 -0.732 1.00 0.00 C ATOM 1483 NH1 ARG A 91 1.209 10.759 -0.204 1.00 0.00 N ATOM 1484 NH2 ARG A 91 -0.551 11.257 -1.591 1.00 0.00 N ATOM 0 H ARG A 91 -4.495 7.508 1.558 1.00 0.00 H new ATOM 0 HA ARG A 91 -2.866 8.378 -0.557 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.199 7.861 1.798 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.439 6.156 1.468 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.182 6.275 1.108 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.731 6.633 -0.517 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -0.107 8.764 1.564 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.049 8.196 0.375 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.430 9.053 -0.873 1.00 0.00 H new ATOM 0 HH11 ARG A 91 1.665 10.124 0.451 1.00 0.00 H new ATOM 0 HH12 ARG A 91 1.655 11.642 -0.454 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -1.449 11.007 -2.004 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -0.103 12.139 -1.839 1.00 0.00 H new ATOM 1498 N ILE A 92 -3.854 5.239 -0.776 1.00 0.00 N ATOM 1499 CA ILE A 92 -4.001 4.129 -1.710 1.00 0.00 C ATOM 1500 C ILE A 92 -4.688 4.601 -2.990 1.00 0.00 C ATOM 1501 O ILE A 92 -4.159 4.440 -4.086 1.00 0.00 O ATOM 1502 CB ILE A 92 -4.807 2.971 -1.072 1.00 0.00 C ATOM 1503 CG1 ILE A 92 -3.940 2.247 -0.044 1.00 0.00 C ATOM 1504 CG2 ILE A 92 -5.307 1.991 -2.128 1.00 0.00 C ATOM 1505 CD1 ILE A 92 -4.562 0.980 0.500 1.00 0.00 C ATOM 0 H ILE A 92 -4.250 5.068 0.148 1.00 0.00 H new ATOM 0 HA ILE A 92 -3.005 3.760 -1.956 1.00 0.00 H new ATOM 0 HB ILE A 92 -5.680 3.395 -0.576 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -2.981 2.002 -0.500 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -3.735 2.924 0.785 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -5.868 1.191 -1.645 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -5.953 2.514 -2.833 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -4.457 1.566 -2.662 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -3.886 0.524 1.223 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -5.507 1.219 0.987 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.742 0.282 -0.318 1.00 0.00 H new ATOM 1517 N GLU A 93 -5.871 5.185 -2.834 1.00 0.00 N ATOM 1518 CA GLU A 93 -6.642 5.683 -3.970 1.00 0.00 C ATOM 1519 C GLU A 93 -5.816 6.648 -4.823 1.00 0.00 C ATOM 1520 O GLU A 93 -6.073 6.810 -6.014 1.00 0.00 O ATOM 1521 CB GLU A 93 -7.913 6.378 -3.478 1.00 0.00 C ATOM 1522 CG GLU A 93 -9.041 6.390 -4.498 1.00 0.00 C ATOM 1523 CD GLU A 93 -9.982 7.567 -4.311 1.00 0.00 C ATOM 1524 OE1 GLU A 93 -9.574 8.556 -3.664 1.00 0.00 O ATOM 1525 OE2 GLU A 93 -11.124 7.498 -4.810 1.00 0.00 O ATOM 0 H GLU A 93 -6.319 5.326 -1.929 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.914 4.830 -4.592 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -8.260 5.881 -2.572 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -7.672 7.405 -3.205 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.618 6.423 -5.502 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.606 5.461 -4.421 1.00 0.00 H new ATOM 1532 N ASP A 94 -4.825 7.290 -4.208 1.00 0.00 N ATOM 1533 CA ASP A 94 -3.974 8.239 -4.922 1.00 0.00 C ATOM 1534 C ASP A 94 -2.982 7.519 -5.838 1.00 0.00 C ATOM 1535 O ASP A 94 -2.692 7.987 -6.938 1.00 0.00 O ATOM 1536 CB ASP A 94 -3.219 9.127 -3.931 1.00 0.00 C ATOM 1537 CG ASP A 94 -3.930 10.443 -3.678 1.00 0.00 C ATOM 1538 OD1 ASP A 94 -5.178 10.452 -3.671 1.00 0.00 O ATOM 1539 OD2 ASP A 94 -3.236 11.465 -3.487 1.00 0.00 O ATOM 0 H ASP A 94 -4.592 7.171 -3.222 1.00 0.00 H new ATOM 0 HA ASP A 94 -4.619 8.861 -5.542 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -3.099 8.594 -2.988 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -2.218 9.325 -4.314 1.00 0.00 H new ATOM 1544 N TYR A 95 -2.470 6.379 -5.382 1.00 0.00 N ATOM 1545 CA TYR A 95 -1.518 5.598 -6.165 1.00 0.00 C ATOM 1546 C TYR A 95 -2.249 4.655 -7.109 1.00 0.00 C ATOM 1547 O TYR A 95 -2.036 4.680 -8.317 1.00 0.00 O ATOM 1548 CB TYR A 95 -0.590 4.798 -5.246 1.00 0.00 C ATOM 1549 CG TYR A 95 0.379 5.657 -4.467 1.00 0.00 C ATOM 1550 CD1 TYR A 95 0.012 6.221 -3.255 1.00 0.00 C ATOM 1551 CD2 TYR A 95 1.660 5.904 -4.943 1.00 0.00 C ATOM 1552 CE1 TYR A 95 0.891 7.009 -2.539 1.00 0.00 C ATOM 1553 CE2 TYR A 95 2.546 6.689 -4.232 1.00 0.00 C ATOM 1554 CZ TYR A 95 2.157 7.240 -3.030 1.00 0.00 C ATOM 1555 OH TYR A 95 3.036 8.025 -2.318 1.00 0.00 O ATOM 0 H TYR A 95 -2.699 5.976 -4.474 1.00 0.00 H new ATOM 0 HA TYR A 95 -0.917 6.291 -6.754 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -1.195 4.221 -4.546 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -0.027 4.083 -5.846 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -0.979 6.041 -2.864 1.00 0.00 H new ATOM 0 HD2 TYR A 95 1.968 5.475 -5.885 1.00 0.00 H new ATOM 0 HE1 TYR A 95 0.587 7.443 -1.598 1.00 0.00 H new ATOM 0 HE2 TYR A 95 3.539 6.870 -4.616 1.00 0.00 H new ATOM 0 HH TYR A 95 3.954 7.819 -2.592 1.00 0.00 H new ATOM 1565 N VAL A 96 -3.118 3.826 -6.546 1.00 0.00 N ATOM 1566 CA VAL A 96 -3.894 2.874 -7.327 1.00 0.00 C ATOM 1567 C VAL A 96 -4.669 3.580 -8.432 1.00 0.00 C ATOM 1568 O VAL A 96 -4.703 3.123 -9.573 1.00 0.00 O ATOM 1569 CB VAL A 96 -4.882 2.103 -6.431 1.00 0.00 C ATOM 1570 CG1 VAL A 96 -5.688 1.096 -7.238 1.00 0.00 C ATOM 1571 CG2 VAL A 96 -4.139 1.413 -5.299 1.00 0.00 C ATOM 0 H VAL A 96 -3.303 3.795 -5.543 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.191 2.171 -7.774 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.582 2.820 -6.003 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.376 0.568 -6.578 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.254 1.618 -8.010 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.012 0.380 -7.705 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.849 0.872 -4.674 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.414 0.713 -5.713 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.620 2.159 -4.697 1.00 0.00 H new ATOM 1581 N ASN A 97 -5.290 4.700 -8.080 1.00 0.00 N ATOM 1582 CA ASN A 97 -6.061 5.476 -9.036 1.00 0.00 C ATOM 1583 C ASN A 97 -5.373 6.803 -9.341 1.00 0.00 C ATOM 1584 O ASN A 97 -5.989 7.862 -9.259 1.00 0.00 O ATOM 1585 CB ASN A 97 -7.472 5.716 -8.497 1.00 0.00 C ATOM 1586 CG ASN A 97 -8.388 4.532 -8.734 1.00 0.00 C ATOM 1587 OD1 ASN A 97 -8.500 3.641 -7.892 1.00 0.00 O ATOM 1588 ND2 ASN A 97 -9.048 4.516 -9.886 1.00 0.00 N ATOM 0 H ASN A 97 -5.273 5.089 -7.137 1.00 0.00 H new ATOM 0 HA ASN A 97 -6.129 4.911 -9.966 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -7.420 5.924 -7.428 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -7.895 6.601 -8.973 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -9.678 3.744 -10.102 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -8.925 5.276 -10.555 1.00 0.00 H new ATOM 1595 N LYS A 98 -4.094 6.747 -9.695 1.00 0.00 N ATOM 1596 CA LYS A 98 -3.343 7.960 -10.007 1.00 0.00 C ATOM 1597 C LYS A 98 -3.651 8.441 -11.426 1.00 0.00 C ATOM 1598 O LYS A 98 -3.300 9.559 -11.802 1.00 0.00 O ATOM 1599 CB LYS A 98 -1.835 7.707 -9.858 1.00 0.00 C ATOM 1600 CG LYS A 98 -1.213 6.934 -11.016 1.00 0.00 C ATOM 1601 CD LYS A 98 -0.939 5.486 -10.643 1.00 0.00 C ATOM 1602 CE LYS A 98 -0.335 4.711 -11.802 1.00 0.00 C ATOM 1603 NZ LYS A 98 -0.673 3.261 -11.734 1.00 0.00 N ATOM 0 H LYS A 98 -3.558 5.883 -9.773 1.00 0.00 H new ATOM 0 HA LYS A 98 -3.646 8.736 -9.304 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -1.325 8.665 -9.760 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -1.660 7.157 -8.933 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -1.881 6.968 -11.877 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.282 7.415 -11.316 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.261 5.452 -9.790 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.868 5.009 -10.331 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -0.696 5.125 -12.743 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.748 4.832 -11.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.534 2.828 -12.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.056 2.793 -11.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.666 3.149 -11.445 1.00 0.00 H new ATOM 1617 N PHE A 99 -4.311 7.591 -12.206 1.00 0.00 N ATOM 1618 CA PHE A 99 -4.667 7.939 -13.576 1.00 0.00 C ATOM 1619 C PHE A 99 -5.791 8.968 -13.599 1.00 0.00 C ATOM 1620 O PHE A 99 -5.709 9.968 -14.308 1.00 0.00 O ATOM 1621 CB PHE A 99 -5.075 6.697 -14.381 1.00 0.00 C ATOM 1622 CG PHE A 99 -5.741 5.622 -13.570 1.00 0.00 C ATOM 1623 CD1 PHE A 99 -7.116 5.613 -13.399 1.00 0.00 C ATOM 1624 CD2 PHE A 99 -4.989 4.617 -12.982 1.00 0.00 C ATOM 1625 CE1 PHE A 99 -7.728 4.623 -12.654 1.00 0.00 C ATOM 1626 CE2 PHE A 99 -5.594 3.625 -12.237 1.00 0.00 C ATOM 1627 CZ PHE A 99 -6.966 3.627 -12.072 1.00 0.00 C ATOM 0 H PHE A 99 -4.609 6.660 -11.914 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.783 8.373 -14.043 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -5.750 7.003 -15.180 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.187 6.279 -14.856 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.716 6.388 -13.853 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.916 4.610 -13.108 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -8.800 4.627 -12.527 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -4.996 2.848 -11.784 1.00 0.00 H new ATOM 0 HZ PHE A 99 -7.442 2.852 -11.490 1.00 0.00 H new ATOM 1637 N VAL A 100 -6.848 8.717 -12.831 1.00 0.00 N ATOM 1638 CA VAL A 100 -7.985 9.631 -12.781 1.00 0.00 C ATOM 1639 C VAL A 100 -7.767 10.741 -11.757 1.00 0.00 C ATOM 1640 O VAL A 100 -8.297 11.843 -11.903 1.00 0.00 O ATOM 1641 CB VAL A 100 -9.295 8.887 -12.452 1.00 0.00 C ATOM 1642 CG1 VAL A 100 -9.241 8.282 -11.054 1.00 0.00 C ATOM 1643 CG2 VAL A 100 -10.491 9.821 -12.598 1.00 0.00 C ATOM 0 H VAL A 100 -6.941 7.893 -12.238 1.00 0.00 H new ATOM 0 HA VAL A 100 -8.069 10.076 -13.773 1.00 0.00 H new ATOM 0 HB VAL A 100 -9.413 8.070 -13.164 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -10.177 7.763 -10.846 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -8.413 7.576 -10.995 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -9.095 9.074 -10.320 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -11.407 9.279 -12.362 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -10.381 10.663 -11.914 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -10.542 10.190 -13.622 1.00 0.00 H new ATOM 1653 N ILE A 101 -6.989 10.447 -10.720 1.00 0.00 N ATOM 1654 CA ILE A 101 -6.710 11.426 -9.677 1.00 0.00 C ATOM 1655 C ILE A 101 -5.605 12.388 -10.108 1.00 0.00 C ATOM 1656 O ILE A 101 -5.791 13.605 -10.094 1.00 0.00 O ATOM 1657 CB ILE A 101 -6.310 10.739 -8.349 1.00 0.00 C ATOM 1658 CG1 ILE A 101 -7.422 9.794 -7.873 1.00 0.00 C ATOM 1659 CG2 ILE A 101 -5.999 11.775 -7.276 1.00 0.00 C ATOM 1660 CD1 ILE A 101 -8.816 10.375 -7.984 1.00 0.00 C ATOM 0 H ILE A 101 -6.542 9.541 -10.580 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.628 11.990 -9.515 1.00 0.00 H new ATOM 0 HB ILE A 101 -5.410 10.152 -8.530 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -7.376 8.874 -8.455 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -7.234 9.524 -6.834 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.720 11.269 -6.352 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -5.174 12.406 -7.607 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -6.880 12.393 -7.100 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -9.544 9.646 -7.628 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.883 11.279 -7.379 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.027 10.619 -9.025 1.00 0.00 H new ATOM 1672 N CYS A 102 -4.456 11.839 -10.492 1.00 0.00 N ATOM 1673 CA CYS A 102 -3.327 12.656 -10.925 1.00 0.00 C ATOM 1674 C CYS A 102 -3.367 12.922 -12.431 1.00 0.00 C ATOM 1675 O CYS A 102 -2.534 13.660 -12.957 1.00 0.00 O ATOM 1676 CB CYS A 102 -2.009 11.977 -10.556 1.00 0.00 C ATOM 1677 SG CYS A 102 -0.577 13.083 -10.591 1.00 0.00 S ATOM 0 H CYS A 102 -4.283 10.834 -10.512 1.00 0.00 H new ATOM 0 HA CYS A 102 -3.400 13.614 -10.410 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.100 11.548 -9.558 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.833 11.150 -11.244 1.00 0.00 H new ATOM 1682 N HIS A 103 -4.333 12.320 -13.122 1.00 0.00 N ATOM 1683 CA HIS A 103 -4.467 12.500 -14.565 1.00 0.00 C ATOM 1684 C HIS A 103 -3.250 11.941 -15.300 1.00 0.00 C ATOM 1685 O HIS A 103 -2.662 12.611 -16.149 1.00 0.00 O ATOM 1686 CB HIS A 103 -4.654 13.982 -14.904 1.00 0.00 C ATOM 1687 CG HIS A 103 -5.534 14.711 -13.935 1.00 0.00 C ATOM 1688 ND1 HIS A 103 -6.906 14.770 -14.059 1.00 0.00 N ATOM 1689 CD2 HIS A 103 -5.231 15.410 -12.815 1.00 0.00 C ATOM 1690 CE1 HIS A 103 -7.410 15.473 -13.059 1.00 0.00 C ATOM 1691 NE2 HIS A 103 -6.414 15.871 -12.289 1.00 0.00 N ATOM 0 H HIS A 103 -5.033 11.705 -12.707 1.00 0.00 H new ATOM 0 HA HIS A 103 -5.349 11.950 -14.894 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -3.678 14.466 -14.931 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -5.080 14.067 -15.904 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -4.243 15.574 -12.411 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -8.457 15.685 -12.899 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -6.507 16.430 -11.441 1.00 0.00 H new ATOM 1699 N GLU A 104 -2.885 10.702 -14.966 1.00 0.00 N ATOM 1700 CA GLU A 104 -1.745 10.025 -15.586 1.00 0.00 C ATOM 1701 C GLU A 104 -0.548 10.957 -15.746 1.00 0.00 C ATOM 1702 O GLU A 104 -0.262 11.431 -16.845 1.00 0.00 O ATOM 1703 CB GLU A 104 -2.140 9.438 -16.943 1.00 0.00 C ATOM 1704 CG GLU A 104 -2.904 10.405 -17.833 1.00 0.00 C ATOM 1705 CD GLU A 104 -3.103 9.871 -19.238 1.00 0.00 C ATOM 1706 OE1 GLU A 104 -2.190 10.044 -20.074 1.00 0.00 O ATOM 1707 OE2 GLU A 104 -4.170 9.279 -19.503 1.00 0.00 O ATOM 0 H GLU A 104 -3.368 10.143 -14.263 1.00 0.00 H new ATOM 0 HA GLU A 104 -1.449 9.215 -14.919 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -1.239 9.114 -17.464 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -2.750 8.550 -16.780 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -3.876 10.613 -17.386 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -2.366 11.352 -17.881 1.00 0.00 H new ATOM 1714 N CYS A 105 0.142 11.219 -14.639 1.00 0.00 N ATOM 1715 CA CYS A 105 1.308 12.095 -14.647 1.00 0.00 C ATOM 1716 C CYS A 105 2.449 11.481 -15.459 1.00 0.00 C ATOM 1717 O CYS A 105 3.494 11.130 -14.913 1.00 0.00 O ATOM 1718 CB CYS A 105 1.768 12.370 -13.211 1.00 0.00 C ATOM 1719 SG CYS A 105 2.262 14.083 -12.907 1.00 0.00 S ATOM 0 H CYS A 105 -0.088 10.835 -13.722 1.00 0.00 H new ATOM 0 HA CYS A 105 1.026 13.037 -15.118 1.00 0.00 H new ATOM 0 HB2 CYS A 105 0.961 12.109 -12.526 1.00 0.00 H new ATOM 0 HB3 CYS A 105 2.607 11.715 -12.978 1.00 0.00 H new ATOM 1724 N ASN A 106 2.243 11.358 -16.769 1.00 0.00 N ATOM 1725 CA ASN A 106 3.258 10.793 -17.647 1.00 0.00 C ATOM 1726 C ASN A 106 4.420 11.779 -17.827 1.00 0.00 C ATOM 1727 O ASN A 106 5.234 11.949 -16.918 1.00 0.00 O ATOM 1728 CB ASN A 106 2.638 10.414 -18.998 1.00 0.00 C ATOM 1729 CG ASN A 106 2.308 8.938 -19.092 1.00 0.00 C ATOM 1730 OD1 ASN A 106 2.210 8.245 -18.080 1.00 0.00 O ATOM 1731 ND2 ASN A 106 2.134 8.453 -20.316 1.00 0.00 N ATOM 0 H ASN A 106 1.385 11.642 -17.242 1.00 0.00 H new ATOM 0 HA ASN A 106 3.656 9.887 -17.190 1.00 0.00 H new ATOM 0 HB2 ASN A 106 1.730 10.997 -19.153 1.00 0.00 H new ATOM 0 HB3 ASN A 106 3.328 10.680 -19.798 1.00 0.00 H new ATOM 0 HD21 ASN A 106 1.909 7.467 -20.447 1.00 0.00 H new ATOM 0 HD22 ASN A 106 2.225 9.067 -21.126 1.00 0.00 H new ATOM 1738 N ARG A 107 4.495 12.433 -18.990 1.00 0.00 N ATOM 1739 CA ARG A 107 5.553 13.401 -19.261 1.00 0.00 C ATOM 1740 C ARG A 107 5.022 14.840 -19.246 1.00 0.00 C ATOM 1741 O ARG A 107 5.047 15.518 -20.273 1.00 0.00 O ATOM 1742 CB ARG A 107 6.198 13.107 -20.617 1.00 0.00 C ATOM 1743 CG ARG A 107 7.022 11.831 -20.643 1.00 0.00 C ATOM 1744 CD ARG A 107 8.498 12.119 -20.419 1.00 0.00 C ATOM 1745 NE ARG A 107 9.354 11.296 -21.270 1.00 0.00 N ATOM 1746 CZ ARG A 107 10.673 11.199 -21.120 1.00 0.00 C ATOM 1747 NH1 ARG A 107 11.292 11.877 -20.160 1.00 0.00 N ATOM 1748 NH2 ARG A 107 11.376 10.424 -21.933 1.00 0.00 N ATOM 0 H ARG A 107 3.834 12.307 -19.757 1.00 0.00 H new ATOM 0 HA ARG A 107 6.297 13.306 -18.470 1.00 0.00 H new ATOM 0 HB2 ARG A 107 5.416 13.038 -21.373 1.00 0.00 H new ATOM 0 HB3 ARG A 107 6.836 13.946 -20.894 1.00 0.00 H new ATOM 0 HG2 ARG A 107 6.662 11.148 -19.873 1.00 0.00 H new ATOM 0 HG3 ARG A 107 6.889 11.330 -21.602 1.00 0.00 H new ATOM 0 HD2 ARG A 107 8.696 13.172 -20.618 1.00 0.00 H new ATOM 0 HD3 ARG A 107 8.747 11.940 -19.373 1.00 0.00 H new ATOM 0 HE ARG A 107 8.916 10.765 -22.023 1.00 0.00 H new ATOM 0 HH11 ARG A 107 10.756 12.476 -19.532 1.00 0.00 H new ATOM 0 HH12 ARG A 107 12.303 11.798 -20.051 1.00 0.00 H new ATOM 0 HH21 ARG A 107 10.906 9.902 -22.673 1.00 0.00 H new ATOM 0 HH22 ARG A 107 12.387 10.349 -21.819 1.00 0.00 H new ATOM 1762 N PRO A 108 4.534 15.342 -18.096 1.00 0.00 N ATOM 1763 CA PRO A 108 4.007 16.709 -18.011 1.00 0.00 C ATOM 1764 C PRO A 108 4.982 17.749 -18.558 1.00 0.00 C ATOM 1765 O PRO A 108 6.192 17.645 -18.357 1.00 0.00 O ATOM 1766 CB PRO A 108 3.800 16.924 -16.512 1.00 0.00 C ATOM 1767 CG PRO A 108 3.628 15.557 -15.946 1.00 0.00 C ATOM 1768 CD PRO A 108 4.451 14.635 -16.804 1.00 0.00 C ATOM 0 HA PRO A 108 3.100 16.824 -18.605 1.00 0.00 H new ATOM 0 HB2 PRO A 108 4.654 17.432 -16.065 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.924 17.544 -16.320 1.00 0.00 H new ATOM 0 HG2 PRO A 108 3.960 15.522 -14.908 1.00 0.00 H new ATOM 0 HG3 PRO A 108 2.579 15.262 -15.955 1.00 0.00 H new ATOM 0 HD2 PRO A 108 5.439 14.465 -16.376 1.00 0.00 H new ATOM 0 HD3 PRO A 108 3.978 13.659 -16.911 1.00 0.00 H new ATOM 1776 N ASP A 109 4.444 18.763 -19.236 1.00 0.00 N ATOM 1777 CA ASP A 109 5.262 19.837 -19.797 1.00 0.00 C ATOM 1778 C ASP A 109 5.605 20.875 -18.730 1.00 0.00 C ATOM 1779 O ASP A 109 5.931 22.020 -19.043 1.00 0.00 O ATOM 1780 CB ASP A 109 4.523 20.515 -20.949 1.00 0.00 C ATOM 1781 CG ASP A 109 4.341 19.600 -22.142 1.00 0.00 C ATOM 1782 OD1 ASP A 109 5.294 19.463 -22.937 1.00 0.00 O ATOM 1783 OD2 ASP A 109 3.244 19.022 -22.282 1.00 0.00 O ATOM 0 H ASP A 109 3.444 18.863 -19.410 1.00 0.00 H new ATOM 0 HA ASP A 109 6.188 19.397 -20.168 1.00 0.00 H new ATOM 0 HB2 ASP A 109 3.546 20.852 -20.601 1.00 0.00 H new ATOM 0 HB3 ASP A 109 5.075 21.403 -21.257 1.00 0.00 H new ATOM 1788 N THR A 110 5.520 20.462 -17.473 1.00 0.00 N ATOM 1789 CA THR A 110 5.805 21.330 -16.343 1.00 0.00 C ATOM 1790 C THR A 110 6.989 20.793 -15.553 1.00 0.00 C ATOM 1791 O THR A 110 7.534 19.737 -15.878 1.00 0.00 O ATOM 1792 CB THR A 110 4.578 21.443 -15.445 1.00 0.00 C ATOM 1793 OG1 THR A 110 3.771 20.287 -15.575 1.00 0.00 O ATOM 1794 CG2 THR A 110 3.718 22.645 -15.765 1.00 0.00 C ATOM 0 H THR A 110 5.251 19.514 -17.210 1.00 0.00 H new ATOM 0 HA THR A 110 6.057 22.322 -16.717 1.00 0.00 H new ATOM 0 HB THR A 110 4.958 21.552 -14.429 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.138 20.411 -16.313 1.00 0.00 H new ATOM 0 HG21 THR A 110 2.861 22.669 -15.092 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.304 23.555 -15.639 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.368 22.578 -16.795 1.00 0.00 H new ATOM 1802 N ARG A 111 7.394 21.526 -14.526 1.00 0.00 N ATOM 1803 CA ARG A 111 8.527 21.120 -13.710 1.00 0.00 C ATOM 1804 C ARG A 111 8.082 20.202 -12.574 1.00 0.00 C ATOM 1805 O ARG A 111 7.605 20.657 -11.534 1.00 0.00 O ATOM 1806 CB ARG A 111 9.213 22.361 -13.137 1.00 0.00 C ATOM 1807 CG ARG A 111 10.643 22.119 -12.691 1.00 0.00 C ATOM 1808 CD ARG A 111 11.070 23.127 -11.636 1.00 0.00 C ATOM 1809 NE ARG A 111 10.595 24.477 -11.943 1.00 0.00 N ATOM 1810 CZ ARG A 111 9.941 25.255 -11.080 1.00 0.00 C ATOM 1811 NH1 ARG A 111 9.682 24.830 -9.848 1.00 0.00 N ATOM 1812 NH2 ARG A 111 9.542 26.464 -11.452 1.00 0.00 N ATOM 0 H ARG A 111 6.956 22.402 -14.239 1.00 0.00 H new ATOM 0 HA ARG A 111 9.227 20.569 -14.338 1.00 0.00 H new ATOM 0 HB2 ARG A 111 9.206 23.149 -13.890 1.00 0.00 H new ATOM 0 HB3 ARG A 111 8.634 22.725 -12.288 1.00 0.00 H new ATOM 0 HG2 ARG A 111 10.736 21.109 -12.291 1.00 0.00 H new ATOM 0 HG3 ARG A 111 11.310 22.184 -13.550 1.00 0.00 H new ATOM 0 HD2 ARG A 111 10.685 22.819 -10.664 1.00 0.00 H new ATOM 0 HD3 ARG A 111 12.157 23.134 -11.560 1.00 0.00 H new ATOM 0 HE ARG A 111 10.776 24.846 -12.877 1.00 0.00 H new ATOM 0 HH11 ARG A 111 9.984 23.901 -9.555 1.00 0.00 H new ATOM 0 HH12 ARG A 111 9.181 25.433 -9.195 1.00 0.00 H new ATOM 0 HH21 ARG A 111 9.736 26.797 -12.397 1.00 0.00 H new ATOM 0 HH22 ARG A 111 9.042 27.061 -10.794 1.00 0.00 H new ATOM 1826 N ILE A 112 8.250 18.900 -12.792 1.00 0.00 N ATOM 1827 CA ILE A 112 7.877 17.894 -11.806 1.00 0.00 C ATOM 1828 C ILE A 112 9.063 17.539 -10.919 1.00 0.00 C ATOM 1829 O ILE A 112 10.208 17.539 -11.369 1.00 0.00 O ATOM 1830 CB ILE A 112 7.357 16.607 -12.481 1.00 0.00 C ATOM 1831 CG1 ILE A 112 6.246 16.930 -13.487 1.00 0.00 C ATOM 1832 CG2 ILE A 112 6.861 15.622 -11.435 1.00 0.00 C ATOM 1833 CD1 ILE A 112 5.130 17.776 -12.916 1.00 0.00 C ATOM 0 H ILE A 112 8.645 18.517 -13.651 1.00 0.00 H new ATOM 0 HA ILE A 112 7.080 18.324 -11.199 1.00 0.00 H new ATOM 0 HB ILE A 112 8.183 16.148 -13.024 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.682 17.449 -14.341 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.826 15.997 -13.862 1.00 0.00 H new ATOM 0 HG21 ILE A 112 6.498 14.720 -11.928 1.00 0.00 H new ATOM 0 HG22 ILE A 112 7.679 15.364 -10.762 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.050 16.075 -10.864 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.383 17.962 -13.688 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.666 17.251 -12.081 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.535 18.726 -12.567 1.00 0.00 H new ATOM 1845 N ILE A 113 8.781 17.238 -9.655 1.00 0.00 N ATOM 1846 CA ILE A 113 9.826 16.881 -8.702 1.00 0.00 C ATOM 1847 C ILE A 113 9.290 15.926 -7.641 1.00 0.00 C ATOM 1848 O ILE A 113 8.236 16.166 -7.058 1.00 0.00 O ATOM 1849 CB ILE A 113 10.400 18.134 -8.011 1.00 0.00 C ATOM 1850 CG1 ILE A 113 10.684 19.229 -9.043 1.00 0.00 C ATOM 1851 CG2 ILE A 113 11.666 17.786 -7.242 1.00 0.00 C ATOM 1852 CD1 ILE A 113 11.235 20.503 -8.437 1.00 0.00 C ATOM 0 H ILE A 113 7.838 17.234 -9.267 1.00 0.00 H new ATOM 0 HA ILE A 113 10.621 16.388 -9.262 1.00 0.00 H new ATOM 0 HB ILE A 113 9.660 18.508 -7.304 1.00 0.00 H new ATOM 0 HG12 ILE A 113 11.394 18.849 -9.778 1.00 0.00 H new ATOM 0 HG13 ILE A 113 9.763 19.460 -9.579 1.00 0.00 H new ATOM 0 HG21 ILE A 113 12.057 18.682 -6.761 1.00 0.00 H new ATOM 0 HG22 ILE A 113 11.437 17.037 -6.484 1.00 0.00 H new ATOM 0 HG23 ILE A 113 12.412 17.389 -7.930 1.00 0.00 H new ATOM 0 HD11 ILE A 113 11.412 21.234 -9.226 1.00 0.00 H new ATOM 0 HD12 ILE A 113 10.517 20.907 -7.723 1.00 0.00 H new ATOM 0 HD13 ILE A 113 12.173 20.287 -7.925 1.00 0.00 H new ATOM 1864 N ARG A 114 10.022 14.839 -7.397 1.00 0.00 N ATOM 1865 CA ARG A 114 9.616 13.844 -6.405 1.00 0.00 C ATOM 1866 C ARG A 114 10.755 13.549 -5.433 1.00 0.00 C ATOM 1867 O ARG A 114 11.833 13.115 -5.838 1.00 0.00 O ATOM 1868 CB ARG A 114 9.167 12.551 -7.098 1.00 0.00 C ATOM 1869 CG ARG A 114 7.873 11.978 -6.540 1.00 0.00 C ATOM 1870 CD ARG A 114 7.638 10.556 -7.014 1.00 0.00 C ATOM 1871 NE ARG A 114 7.657 10.458 -8.471 1.00 0.00 N ATOM 1872 CZ ARG A 114 6.844 9.676 -9.179 1.00 0.00 C ATOM 1873 NH1 ARG A 114 5.931 8.925 -8.576 1.00 0.00 N ATOM 1874 NH2 ARG A 114 6.942 9.648 -10.500 1.00 0.00 N ATOM 0 H ARG A 114 10.899 14.625 -7.873 1.00 0.00 H new ATOM 0 HA ARG A 114 8.778 14.252 -5.840 1.00 0.00 H new ATOM 0 HB2 ARG A 114 9.039 12.745 -8.163 1.00 0.00 H new ATOM 0 HB3 ARG A 114 9.956 11.805 -7.003 1.00 0.00 H new ATOM 0 HG2 ARG A 114 7.906 11.998 -5.451 1.00 0.00 H new ATOM 0 HG3 ARG A 114 7.036 12.606 -6.845 1.00 0.00 H new ATOM 0 HD2 ARG A 114 8.404 9.903 -6.596 1.00 0.00 H new ATOM 0 HD3 ARG A 114 6.678 10.202 -6.639 1.00 0.00 H new ATOM 0 HE ARG A 114 8.336 11.025 -8.979 1.00 0.00 H new ATOM 0 HH11 ARG A 114 5.846 8.943 -7.560 1.00 0.00 H new ATOM 0 HH12 ARG A 114 5.314 8.330 -9.129 1.00 0.00 H new ATOM 0 HH21 ARG A 114 7.639 10.224 -10.972 1.00 0.00 H new ATOM 0 HH22 ARG A 114 6.321 9.050 -11.045 1.00 0.00 H new ATOM 1888 N GLU A 115 10.508 13.787 -4.150 1.00 0.00 N ATOM 1889 CA GLU A 115 11.517 13.548 -3.122 1.00 0.00 C ATOM 1890 C GLU A 115 10.956 12.694 -1.988 1.00 0.00 C ATOM 1891 O GLU A 115 9.814 12.875 -1.566 1.00 0.00 O ATOM 1892 CB GLU A 115 12.029 14.879 -2.565 1.00 0.00 C ATOM 1893 CG GLU A 115 13.097 14.720 -1.495 1.00 0.00 C ATOM 1894 CD GLU A 115 14.027 15.915 -1.418 1.00 0.00 C ATOM 1895 OE1 GLU A 115 14.872 16.069 -2.325 1.00 0.00 O ATOM 1896 OE2 GLU A 115 13.910 16.696 -0.451 1.00 0.00 O ATOM 0 H GLU A 115 9.621 14.144 -3.796 1.00 0.00 H new ATOM 0 HA GLU A 115 12.344 13.007 -3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 115 12.433 15.475 -3.384 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.190 15.436 -2.149 1.00 0.00 H new ATOM 0 HG2 GLU A 115 12.618 14.574 -0.527 1.00 0.00 H new ATOM 0 HG3 GLU A 115 13.681 13.823 -1.700 1.00 0.00 H new ATOM 1903 N GLY A 116 11.774 11.768 -1.493 1.00 0.00 N ATOM 1904 CA GLY A 116 11.350 10.904 -0.406 1.00 0.00 C ATOM 1905 C GLY A 116 11.078 9.479 -0.850 1.00 0.00 C ATOM 1906 O GLY A 116 10.271 8.778 -0.240 1.00 0.00 O ATOM 0 H GLY A 116 12.723 11.601 -1.826 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.119 10.897 0.366 1.00 0.00 H new ATOM 0 HA3 GLY A 116 10.448 11.316 0.047 1.00 0.00 H new ATOM 1910 N ARG A 117 11.751 9.043 -1.910 1.00 0.00 N ATOM 1911 CA ARG A 117 11.570 7.687 -2.422 1.00 0.00 C ATOM 1912 C ARG A 117 10.121 7.461 -2.856 1.00 0.00 C ATOM 1913 O ARG A 117 9.499 6.463 -2.492 1.00 0.00 O ATOM 1914 CB ARG A 117 11.970 6.662 -1.357 1.00 0.00 C ATOM 1915 CG ARG A 117 13.333 6.033 -1.599 1.00 0.00 C ATOM 1916 CD ARG A 117 14.429 7.085 -1.693 1.00 0.00 C ATOM 1917 NE ARG A 117 15.505 6.843 -0.733 1.00 0.00 N ATOM 1918 CZ ARG A 117 15.639 7.496 0.421 1.00 0.00 C ATOM 1919 NH1 ARG A 117 14.767 8.434 0.774 1.00 0.00 N ATOM 1920 NH2 ARG A 117 16.650 7.208 1.229 1.00 0.00 N ATOM 0 H ARG A 117 12.424 9.605 -2.430 1.00 0.00 H new ATOM 0 HA ARG A 117 12.213 7.560 -3.293 1.00 0.00 H new ATOM 0 HB2 ARG A 117 11.971 7.147 -0.381 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.217 5.875 -1.321 1.00 0.00 H new ATOM 0 HG2 ARG A 117 13.563 5.339 -0.790 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.307 5.451 -2.520 1.00 0.00 H new ATOM 0 HD2 ARG A 117 14.839 7.092 -2.703 1.00 0.00 H new ATOM 0 HD3 ARG A 117 14.001 8.072 -1.516 1.00 0.00 H new ATOM 0 HE ARG A 117 16.197 6.129 -0.961 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.985 8.661 0.159 1.00 0.00 H new ATOM 0 HH12 ARG A 117 14.879 8.927 1.660 1.00 0.00 H new ATOM 0 HH21 ARG A 117 17.323 6.488 0.967 1.00 0.00 H new ATOM 0 HH22 ARG A 117 16.755 7.707 2.113 1.00 0.00 H new ATOM 1934 N ILE A 118 9.593 8.397 -3.638 1.00 0.00 N ATOM 1935 CA ILE A 118 8.221 8.306 -4.127 1.00 0.00 C ATOM 1936 C ILE A 118 7.214 8.548 -3.004 1.00 0.00 C ATOM 1937 O ILE A 118 6.246 7.804 -2.855 1.00 0.00 O ATOM 1938 CB ILE A 118 7.935 6.933 -4.773 1.00 0.00 C ATOM 1939 CG1 ILE A 118 9.091 6.515 -5.689 1.00 0.00 C ATOM 1940 CG2 ILE A 118 6.629 6.978 -5.554 1.00 0.00 C ATOM 1941 CD1 ILE A 118 9.450 7.559 -6.726 1.00 0.00 C ATOM 0 H ILE A 118 10.095 9.229 -3.947 1.00 0.00 H new ATOM 0 HA ILE A 118 8.110 9.082 -4.884 1.00 0.00 H new ATOM 0 HB ILE A 118 7.842 6.192 -3.979 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.969 6.304 -5.079 1.00 0.00 H new ATOM 0 HG13 ILE A 118 8.825 5.588 -6.196 1.00 0.00 H new ATOM 0 HG21 ILE A 118 6.440 6.003 -6.004 1.00 0.00 H new ATOM 0 HG22 ILE A 118 5.811 7.231 -4.880 1.00 0.00 H new ATOM 0 HG23 ILE A 118 6.700 7.732 -6.338 1.00 0.00 H new ATOM 0 HD11 ILE A 118 10.275 7.195 -7.338 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.586 7.753 -7.361 1.00 0.00 H new ATOM 0 HD13 ILE A 118 9.748 8.481 -6.226 1.00 0.00 H new ATOM 1953 N SER A 119 7.446 9.595 -2.215 1.00 0.00 N ATOM 1954 CA SER A 119 6.550 9.924 -1.111 1.00 0.00 C ATOM 1955 C SER A 119 6.030 11.361 -1.226 1.00 0.00 C ATOM 1956 O SER A 119 4.891 11.643 -0.854 1.00 0.00 O ATOM 1957 CB SER A 119 7.256 9.710 0.232 1.00 0.00 C ATOM 1958 OG SER A 119 6.427 9.009 1.146 1.00 0.00 O ATOM 0 H SER A 119 8.241 10.225 -2.319 1.00 0.00 H new ATOM 0 HA SER A 119 5.691 9.255 -1.164 1.00 0.00 H new ATOM 0 HB2 SER A 119 8.180 9.153 0.075 1.00 0.00 H new ATOM 0 HB3 SER A 119 7.534 10.675 0.657 1.00 0.00 H new ATOM 0 HG SER A 119 6.953 8.746 1.930 1.00 0.00 H new ATOM 1964 N LEU A 120 6.861 12.263 -1.759 1.00 0.00 N ATOM 1965 CA LEU A 120 6.467 13.663 -1.937 1.00 0.00 C ATOM 1966 C LEU A 120 6.730 14.114 -3.372 1.00 0.00 C ATOM 1967 O LEU A 120 7.627 13.596 -4.036 1.00 0.00 O ATOM 1968 CB LEU A 120 7.232 14.593 -0.986 1.00 0.00 C ATOM 1969 CG LEU A 120 6.986 14.396 0.514 1.00 0.00 C ATOM 1970 CD1 LEU A 120 5.501 14.261 0.820 1.00 0.00 C ATOM 1971 CD2 LEU A 120 7.757 13.192 1.026 1.00 0.00 C ATOM 0 H LEU A 120 7.807 12.049 -2.073 1.00 0.00 H new ATOM 0 HA LEU A 120 5.402 13.724 -1.712 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.298 14.471 -1.175 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.979 15.622 -1.240 1.00 0.00 H new ATOM 0 HG LEU A 120 7.348 15.283 1.033 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.362 14.123 1.892 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.980 15.163 0.500 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.097 13.400 0.287 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.571 13.067 2.093 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.431 12.298 0.494 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.823 13.345 0.860 1.00 0.00 H new ATOM 1983 N LEU A 121 5.957 15.092 -3.841 1.00 0.00 N ATOM 1984 CA LEU A 121 6.128 15.617 -5.193 1.00 0.00 C ATOM 1985 C LEU A 121 5.171 16.777 -5.458 1.00 0.00 C ATOM 1986 O LEU A 121 4.203 16.968 -4.724 1.00 0.00 O ATOM 1987 CB LEU A 121 5.943 14.493 -6.225 1.00 0.00 C ATOM 1988 CG LEU A 121 4.636 14.506 -7.028 1.00 0.00 C ATOM 1989 CD1 LEU A 121 4.846 15.161 -8.389 1.00 0.00 C ATOM 1990 CD2 LEU A 121 4.101 13.088 -7.190 1.00 0.00 C ATOM 0 H LEU A 121 5.209 15.535 -3.307 1.00 0.00 H new ATOM 0 HA LEU A 121 7.142 16.005 -5.288 1.00 0.00 H new ATOM 0 HB2 LEU A 121 6.775 14.536 -6.928 1.00 0.00 H new ATOM 0 HB3 LEU A 121 6.014 13.538 -5.705 1.00 0.00 H new ATOM 0 HG LEU A 121 3.899 15.093 -6.480 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.907 15.160 -8.942 1.00 0.00 H new ATOM 0 HD12 LEU A 121 5.184 16.188 -8.250 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.597 14.604 -8.949 1.00 0.00 H new ATOM 0 HD21 LEU A 121 3.173 13.112 -7.762 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.836 12.480 -7.717 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.910 12.657 -6.207 1.00 0.00 H new ATOM 2002 N LYS A 122 5.452 17.549 -6.507 1.00 0.00 N ATOM 2003 CA LYS A 122 4.617 18.695 -6.861 1.00 0.00 C ATOM 2004 C LYS A 122 3.953 18.498 -8.227 1.00 0.00 C ATOM 2005 O LYS A 122 4.590 18.034 -9.175 1.00 0.00 O ATOM 2006 CB LYS A 122 5.452 19.980 -6.858 1.00 0.00 C ATOM 2007 CG LYS A 122 6.450 20.076 -8.003 1.00 0.00 C ATOM 2008 CD LYS A 122 7.092 21.456 -8.067 1.00 0.00 C ATOM 2009 CE LYS A 122 8.310 21.556 -7.158 1.00 0.00 C ATOM 2010 NZ LYS A 122 8.281 22.792 -6.325 1.00 0.00 N ATOM 0 H LYS A 122 6.250 17.402 -7.125 1.00 0.00 H new ATOM 0 HA LYS A 122 3.829 18.781 -6.113 1.00 0.00 H new ATOM 0 HB2 LYS A 122 4.780 20.837 -6.903 1.00 0.00 H new ATOM 0 HB3 LYS A 122 5.992 20.048 -5.913 1.00 0.00 H new ATOM 0 HG2 LYS A 122 7.224 19.319 -7.878 1.00 0.00 H new ATOM 0 HG3 LYS A 122 5.946 19.864 -8.946 1.00 0.00 H new ATOM 0 HD2 LYS A 122 7.386 21.673 -9.094 1.00 0.00 H new ATOM 0 HD3 LYS A 122 6.360 22.211 -7.779 1.00 0.00 H new ATOM 0 HE2 LYS A 122 8.351 20.681 -6.509 1.00 0.00 H new ATOM 0 HE3 LYS A 122 9.217 21.547 -7.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 9.127 22.823 -5.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 8.267 23.628 -6.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 7.429 22.789 -5.729 1.00 0.00 H new ATOM 2024 N CYS A 123 2.667 18.858 -8.316 1.00 0.00 N ATOM 2025 CA CYS A 123 1.909 18.727 -9.563 1.00 0.00 C ATOM 2026 C CYS A 123 1.127 20.003 -9.865 1.00 0.00 C ATOM 2027 O CYS A 123 -0.056 19.953 -10.204 1.00 0.00 O ATOM 2028 CB CYS A 123 0.941 17.543 -9.487 1.00 0.00 C ATOM 2029 SG CYS A 123 1.737 15.927 -9.642 1.00 0.00 S ATOM 0 H CYS A 123 2.131 19.242 -7.538 1.00 0.00 H new ATOM 0 HA CYS A 123 2.625 18.553 -10.366 1.00 0.00 H new ATOM 0 HB2 CYS A 123 0.408 17.584 -8.537 1.00 0.00 H new ATOM 0 HB3 CYS A 123 0.195 17.646 -10.276 1.00 0.00 H new ATOM 2034 N GLU A 124 1.792 21.146 -9.744 1.00 0.00 N ATOM 2035 CA GLU A 124 1.153 22.432 -10.010 1.00 0.00 C ATOM 2036 C GLU A 124 0.452 22.423 -11.367 1.00 0.00 C ATOM 2037 O GLU A 124 -0.531 23.134 -11.573 1.00 0.00 O ATOM 2038 CB GLU A 124 2.190 23.554 -9.958 1.00 0.00 C ATOM 2039 CG GLU A 124 2.750 23.795 -8.565 1.00 0.00 C ATOM 2040 CD GLU A 124 4.204 23.383 -8.442 1.00 0.00 C ATOM 2041 OE1 GLU A 124 4.560 22.306 -8.965 1.00 0.00 O ATOM 2042 OE2 GLU A 124 4.986 24.137 -7.825 1.00 0.00 O ATOM 0 H GLU A 124 2.771 21.210 -9.464 1.00 0.00 H new ATOM 0 HA GLU A 124 0.401 22.607 -9.240 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.010 23.312 -10.634 1.00 0.00 H new ATOM 0 HB3 GLU A 124 1.736 24.475 -10.323 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.653 24.852 -8.316 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.156 23.241 -7.838 1.00 0.00 H new ATOM 2049 N ALA A 125 0.962 21.611 -12.286 1.00 0.00 N ATOM 2050 CA ALA A 125 0.387 21.506 -13.620 1.00 0.00 C ATOM 2051 C ALA A 125 -0.955 20.780 -13.589 1.00 0.00 C ATOM 2052 O ALA A 125 -2.009 21.399 -13.728 1.00 0.00 O ATOM 2053 CB ALA A 125 1.353 20.792 -14.549 1.00 0.00 C ATOM 0 H ALA A 125 1.775 21.015 -12.130 1.00 0.00 H new ATOM 0 HA ALA A 125 0.212 22.515 -13.995 1.00 0.00 H new ATOM 0 HB1 ALA A 125 0.914 20.719 -15.544 1.00 0.00 H new ATOM 0 HB2 ALA A 125 2.286 21.353 -14.605 1.00 0.00 H new ATOM 0 HB3 ALA A 125 1.554 19.791 -14.166 1.00 0.00 H new ATOM 2059 N CYS A 126 -0.908 19.464 -13.404 1.00 0.00 N ATOM 2060 CA CYS A 126 -2.119 18.655 -13.353 1.00 0.00 C ATOM 2061 C CYS A 126 -2.778 18.756 -11.979 1.00 0.00 C ATOM 2062 O CYS A 126 -3.007 17.749 -11.308 1.00 0.00 O ATOM 2063 CB CYS A 126 -1.795 17.194 -13.684 1.00 0.00 C ATOM 2064 SG CYS A 126 -0.732 16.375 -12.472 1.00 0.00 S ATOM 0 H CYS A 126 -0.043 18.936 -13.287 1.00 0.00 H new ATOM 0 HA CYS A 126 -2.819 19.036 -14.097 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -2.728 16.637 -13.767 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -1.312 17.153 -14.660 1.00 0.00 H new ATOM 2069 N GLY A 127 -3.082 19.984 -11.568 1.00 0.00 N ATOM 2070 CA GLY A 127 -3.711 20.205 -10.280 1.00 0.00 C ATOM 2071 C GLY A 127 -2.737 20.717 -9.232 1.00 0.00 C ATOM 2072 O GLY A 127 -2.176 21.803 -9.375 1.00 0.00 O ATOM 0 H GLY A 127 -2.903 20.831 -12.107 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -4.524 20.922 -10.395 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -4.155 19.272 -9.932 1.00 0.00 H new ATOM 2076 N ALA A 128 -2.544 19.935 -8.173 1.00 0.00 N ATOM 2077 CA ALA A 128 -1.641 20.316 -7.092 1.00 0.00 C ATOM 2078 C ALA A 128 -1.067 19.087 -6.389 1.00 0.00 C ATOM 2079 O ALA A 128 -1.683 18.021 -6.386 1.00 0.00 O ATOM 2080 CB ALA A 128 -2.364 21.207 -6.098 1.00 0.00 C ATOM 0 H ALA A 128 -3.002 19.033 -8.041 1.00 0.00 H new ATOM 0 HA ALA A 128 -0.808 20.870 -7.525 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.681 21.486 -5.295 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -2.715 22.106 -6.604 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -3.215 20.670 -5.680 1.00 0.00 H new ATOM 2086 N LYS A 129 0.116 19.240 -5.796 1.00 0.00 N ATOM 2087 CA LYS A 129 0.768 18.137 -5.092 1.00 0.00 C ATOM 2088 C LYS A 129 1.693 18.659 -3.991 1.00 0.00 C ATOM 2089 O LYS A 129 2.315 19.709 -4.138 1.00 0.00 O ATOM 2090 CB LYS A 129 1.557 17.280 -6.086 1.00 0.00 C ATOM 2091 CG LYS A 129 1.295 15.786 -5.970 1.00 0.00 C ATOM 2092 CD LYS A 129 1.476 15.297 -4.544 1.00 0.00 C ATOM 2093 CE LYS A 129 2.238 13.983 -4.492 1.00 0.00 C ATOM 2094 NZ LYS A 129 1.325 12.807 -4.540 1.00 0.00 N ATOM 0 H LYS A 129 0.641 20.114 -5.789 1.00 0.00 H new ATOM 0 HA LYS A 129 -0.002 17.525 -4.623 1.00 0.00 H new ATOM 0 HB2 LYS A 129 1.314 17.602 -7.099 1.00 0.00 H new ATOM 0 HB3 LYS A 129 2.622 17.463 -5.940 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.281 15.567 -6.305 1.00 0.00 H new ATOM 0 HG3 LYS A 129 1.973 15.245 -6.630 1.00 0.00 H new ATOM 0 HD2 LYS A 129 2.011 16.051 -3.966 1.00 0.00 H new ATOM 0 HD3 LYS A 129 0.500 15.170 -4.076 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.936 13.935 -5.328 1.00 0.00 H new ATOM 0 HE3 LYS A 129 2.832 13.944 -3.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 1.885 11.931 -4.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 0.676 12.838 -3.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 0.776 12.829 -5.423 1.00 0.00 H new ATOM 2108 N ALA A 130 1.767 17.919 -2.886 1.00 0.00 N ATOM 2109 CA ALA A 130 2.600 18.297 -1.747 1.00 0.00 C ATOM 2110 C ALA A 130 4.063 17.872 -1.933 1.00 0.00 C ATOM 2111 O ALA A 130 4.387 16.688 -1.832 1.00 0.00 O ATOM 2112 CB ALA A 130 2.035 17.675 -0.479 1.00 0.00 C ATOM 0 H ALA A 130 1.255 17.047 -2.756 1.00 0.00 H new ATOM 0 HA ALA A 130 2.587 19.384 -1.670 1.00 0.00 H new ATOM 0 HB1 ALA A 130 2.656 17.956 0.372 1.00 0.00 H new ATOM 0 HB2 ALA A 130 1.018 18.033 -0.320 1.00 0.00 H new ATOM 0 HB3 ALA A 130 2.026 16.590 -0.579 1.00 0.00 H new ATOM 2118 N PRO A 131 4.971 18.834 -2.204 1.00 0.00 N ATOM 2119 CA PRO A 131 6.403 18.548 -2.400 1.00 0.00 C ATOM 2120 C PRO A 131 7.122 18.183 -1.101 1.00 0.00 C ATOM 2121 O PRO A 131 8.037 17.361 -1.100 1.00 0.00 O ATOM 2122 CB PRO A 131 6.952 19.865 -2.948 1.00 0.00 C ATOM 2123 CG PRO A 131 6.044 20.904 -2.393 1.00 0.00 C ATOM 2124 CD PRO A 131 4.679 20.275 -2.347 1.00 0.00 C ATOM 0 HA PRO A 131 6.553 17.690 -3.055 1.00 0.00 H new ATOM 0 HB2 PRO A 131 7.982 20.028 -2.632 1.00 0.00 H new ATOM 0 HB3 PRO A 131 6.947 19.874 -4.038 1.00 0.00 H new ATOM 0 HG2 PRO A 131 6.366 21.213 -1.398 1.00 0.00 H new ATOM 0 HG3 PRO A 131 6.042 21.796 -3.019 1.00 0.00 H new ATOM 0 HD2 PRO A 131 4.091 20.651 -1.510 1.00 0.00 H new ATOM 0 HD3 PRO A 131 4.110 20.482 -3.254 1.00 0.00 H new ATOM 2132 N LEU A 132 6.709 18.803 -0.001 1.00 0.00 N ATOM 2133 CA LEU A 132 7.317 18.543 1.303 1.00 0.00 C ATOM 2134 C LEU A 132 6.307 18.778 2.420 1.00 0.00 C ATOM 2135 O LEU A 132 5.772 19.876 2.564 1.00 0.00 O ATOM 2136 CB LEU A 132 8.547 19.434 1.516 1.00 0.00 C ATOM 2137 CG LEU A 132 9.746 19.116 0.617 1.00 0.00 C ATOM 2138 CD1 LEU A 132 9.811 20.090 -0.549 1.00 0.00 C ATOM 2139 CD2 LEU A 132 11.041 19.158 1.418 1.00 0.00 C ATOM 0 H LEU A 132 5.955 19.490 0.016 1.00 0.00 H new ATOM 0 HA LEU A 132 7.633 17.500 1.326 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.256 20.472 1.353 1.00 0.00 H new ATOM 0 HB3 LEU A 132 8.861 19.350 2.556 1.00 0.00 H new ATOM 0 HG LEU A 132 9.619 18.109 0.219 1.00 0.00 H new ATOM 0 HD11 LEU A 132 10.669 19.849 -1.177 1.00 0.00 H new ATOM 0 HD12 LEU A 132 8.897 20.014 -1.138 1.00 0.00 H new ATOM 0 HD13 LEU A 132 9.914 21.106 -0.169 1.00 0.00 H new ATOM 0 HD21 LEU A 132 11.882 18.930 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 132 11.173 20.152 1.844 1.00 0.00 H new ATOM 0 HD23 LEU A 132 10.996 18.422 2.221 1.00 0.00 H new ATOM 2151 N LYS A 133 6.045 17.738 3.202 1.00 0.00 N ATOM 2152 CA LYS A 133 5.091 17.835 4.300 1.00 0.00 C ATOM 2153 C LYS A 133 5.737 18.447 5.540 1.00 0.00 C ATOM 2154 O LYS A 133 6.908 18.826 5.521 1.00 0.00 O ATOM 2155 CB LYS A 133 4.524 16.452 4.628 1.00 0.00 C ATOM 2156 CG LYS A 133 3.073 16.280 4.208 1.00 0.00 C ATOM 2157 CD LYS A 133 2.633 14.828 4.301 1.00 0.00 C ATOM 2158 CE LYS A 133 2.673 14.323 5.734 1.00 0.00 C ATOM 2159 NZ LYS A 133 1.770 15.104 6.625 1.00 0.00 N ATOM 0 H LYS A 133 6.478 16.820 3.097 1.00 0.00 H new ATOM 0 HA LYS A 133 4.278 18.489 3.985 1.00 0.00 H new ATOM 0 HB2 LYS A 133 5.130 15.692 4.134 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.607 16.278 5.701 1.00 0.00 H new ATOM 0 HG2 LYS A 133 2.435 16.896 4.842 1.00 0.00 H new ATOM 0 HG3 LYS A 133 2.945 16.635 3.185 1.00 0.00 H new ATOM 0 HD2 LYS A 133 1.622 14.728 3.907 1.00 0.00 H new ATOM 0 HD3 LYS A 133 3.280 14.210 3.679 1.00 0.00 H new ATOM 0 HE2 LYS A 133 2.385 13.272 5.756 1.00 0.00 H new ATOM 0 HE3 LYS A 133 3.694 14.382 6.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 1.655 14.602 7.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 2.182 16.043 6.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 0.842 15.213 6.169 1.00 0.00 H new ATOM 2173 N ASN A 134 4.965 18.539 6.617 1.00 0.00 N ATOM 2174 CA ASN A 134 5.461 19.104 7.866 1.00 0.00 C ATOM 2175 C ASN A 134 6.533 18.209 8.477 1.00 0.00 C ATOM 2176 O ASN A 134 6.665 17.042 8.106 1.00 0.00 O ATOM 2177 CB ASN A 134 4.310 19.299 8.852 1.00 0.00 C ATOM 2178 CG ASN A 134 3.542 20.582 8.595 1.00 0.00 C ATOM 2179 OD1 ASN A 134 4.135 21.647 8.419 1.00 0.00 O ATOM 2180 ND2 ASN A 134 2.218 20.486 8.569 1.00 0.00 N ATOM 0 H ASN A 134 3.994 18.230 6.650 1.00 0.00 H new ATOM 0 HA ASN A 134 5.908 20.074 7.649 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.629 18.451 8.784 1.00 0.00 H new ATOM 0 HB3 ASN A 134 4.703 19.311 9.868 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.650 21.316 8.398 1.00 0.00 H new ATOM 0 HD22 ASN A 134 1.769 19.583 8.720 1.00 0.00 H new ATOM 2187 N VAL A 135 7.299 18.761 9.413 1.00 0.00 N ATOM 2188 CA VAL A 135 8.360 18.008 10.070 1.00 0.00 C ATOM 2189 C VAL A 135 7.787 16.998 11.060 1.00 0.00 C ATOM 2190 O VAL A 135 6.921 17.387 11.871 1.00 0.00 O ATOM 2191 CB VAL A 135 9.346 18.944 10.799 1.00 0.00 C ATOM 2192 CG1 VAL A 135 8.620 19.816 11.813 1.00 0.00 C ATOM 2193 CG2 VAL A 135 10.453 18.142 11.470 1.00 0.00 C ATOM 2194 OXT VAL A 135 8.208 15.823 11.012 1.00 0.00 O ATOM 0 H VAL A 135 7.205 19.725 9.733 1.00 0.00 H new ATOM 0 HA VAL A 135 8.900 17.471 9.290 1.00 0.00 H new ATOM 0 HB VAL A 135 9.801 19.600 10.057 1.00 0.00 H new ATOM 0 HG11 VAL A 135 9.337 20.467 12.313 1.00 0.00 H new ATOM 0 HG12 VAL A 135 7.874 20.424 11.302 1.00 0.00 H new ATOM 0 HG13 VAL A 135 8.128 19.183 12.551 1.00 0.00 H new ATOM 0 HG21 VAL A 135 11.137 18.821 11.978 1.00 0.00 H new ATOM 0 HG22 VAL A 135 10.017 17.456 12.196 1.00 0.00 H new ATOM 0 HG23 VAL A 135 10.999 17.574 10.717 1.00 0.00 H new TER 2204 VAL A 135 HETATM 2205 ZN ZN A 136 0.674 14.867 -11.403 1.00 0.00 ZN