USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1100 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 31 TYR OH : rot -104:sc= -6.01! USER MOD Set 1.2: A 94 THR OG1 : rot -71:sc= -0.513 USER MOD Set 2.1: A 15 ASN : amide:sc= -12.5! C(o=-19!,f=-2.8!) USER MOD Set 2.2: A 107 ASN : amide:sc= -6.15! K(o=-19!,f=-4.7) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -128:sc= 0.403 (180deg=-1.12) USER MOD Single : A 3 THR OG1 : rot -27:sc= 0.356! USER MOD Single : A 4 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.251) USER MOD Single : A 7 LYS NZ :NH3+ 149:sc= -0.0907 (180deg=-0.621) USER MOD Single : A 10 CYS SG : rot -97:sc= -0.821! USER MOD Single : A 14 TYR OH : rot 98:sc= -2.56! USER MOD Single : A 22 SER OG : rot -105:sc= -0.393! USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.138 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -7.53! C(o=-7.5!,f=-6.4!) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 1.1 K(o=1.1,f=-0.48) USER MOD Single : A 47 HIS : no HD1:sc= -0.376 X(o=-0.38,f=-0.095) USER MOD Single : A 50 GLN : amide:sc= -4.61! C(o=-4.6!,f=-7.9!) USER MOD Single : A 51 GLN : amide:sc= -9.38! C(o=-9.4!,f=-7.4!) USER MOD Single : A 52 CYS SG : rot -64:sc= -3.36! USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.034 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot -67:sc= 1.13 USER MOD Single : A 70 MET CE :methyl -146:sc= -4.34! (180deg=-8.14!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -166:sc= -0.0529 (180deg=-0.406) USER MOD Single : A 74 SER OG : rot -70:sc= -0.636! USER MOD Single : A 75 LYS NZ :NH3+ 138:sc= 0.863 (180deg=-2.74!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -2.75! C(o=-2.8!,f=-5.2!) USER MOD Single : A 93 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0382) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0875) USER MOD Single : A 99 THR OG1 : rot -170:sc=-0.00359 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=-0.00084) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 159:sc= -0.181 (180deg=-1.12) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 147:sc= -0.683 (180deg=-3.84!) USER MOD Single : A 131 LYS NZ :NH3+ 156:sc= -0.159 (180deg=-0.969) USER MOD Single : A 136 ASN : amide:sc= -3.29! C(o=-3.3!,f=-1.6!) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc=-0.00201 K(o=-0.002,f=-1.1!) USER MOD Single : A 141 SER OG : rot 180:sc= -0.579 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.566 -22.157 1.687 1.00 0.00 N ATOM 2 CA MET A 1 -9.720 -21.215 1.665 1.00 0.00 C ATOM 3 C MET A 1 -9.702 -20.355 2.930 1.00 0.00 C ATOM 4 O MET A 1 -8.799 -20.443 3.739 1.00 0.00 O ATOM 5 CB MET A 1 -11.027 -22.009 1.607 1.00 0.00 C ATOM 6 CG MET A 1 -10.914 -23.102 0.542 1.00 0.00 C ATOM 7 SD MET A 1 -10.658 -24.703 1.345 1.00 0.00 S ATOM 8 CE MET A 1 -11.668 -25.689 0.212 1.00 0.00 C ATOM 0 H1 MET A 1 -8.035 -22.076 0.796 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.942 -21.922 2.485 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.915 -23.131 1.795 1.00 0.00 H new ATOM 0 HA MET A 1 -9.646 -20.572 0.788 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.238 -22.454 2.579 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.859 -21.344 1.374 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.819 -23.128 -0.065 1.00 0.00 H new ATOM 0 HG3 MET A 1 -10.085 -22.884 -0.131 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.652 -26.733 0.525 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.694 -25.322 0.226 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.267 -25.607 -0.798 1.00 0.00 H new ATOM 20 N ALA A 2 -10.691 -19.523 3.108 1.00 0.00 N ATOM 21 CA ALA A 2 -10.730 -18.659 4.321 1.00 0.00 C ATOM 22 C ALA A 2 -9.732 -17.511 4.160 1.00 0.00 C ATOM 23 O ALA A 2 -8.807 -17.584 3.373 1.00 0.00 O ATOM 24 CB ALA A 2 -10.357 -19.489 5.550 1.00 0.00 C ATOM 0 H ALA A 2 -11.474 -19.404 2.465 1.00 0.00 H new ATOM 0 HA ALA A 2 -11.734 -18.254 4.447 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -10.385 -18.857 6.438 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -11.067 -20.308 5.665 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -9.353 -19.894 5.425 1.00 0.00 H new ATOM 30 N THR A 3 -9.909 -16.450 4.899 1.00 0.00 N ATOM 31 CA THR A 3 -8.969 -15.299 4.788 1.00 0.00 C ATOM 32 C THR A 3 -9.034 -14.463 6.067 1.00 0.00 C ATOM 33 O THR A 3 -10.067 -14.355 6.697 1.00 0.00 O ATOM 34 CB THR A 3 -9.366 -14.429 3.591 1.00 0.00 C ATOM 35 OG1 THR A 3 -9.576 -15.257 2.456 1.00 0.00 O ATOM 36 CG2 THR A 3 -8.250 -13.427 3.295 1.00 0.00 C ATOM 0 H THR A 3 -10.664 -16.331 5.575 1.00 0.00 H new ATOM 0 HA THR A 3 -7.954 -15.671 4.647 1.00 0.00 H new ATOM 0 HB THR A 3 -10.284 -13.889 3.822 1.00 0.00 H new ATOM 0 HG1 THR A 3 -9.031 -16.067 2.537 1.00 0.00 H new ATOM 0 HG21 THR A 3 -8.533 -12.808 2.443 1.00 0.00 H new ATOM 0 HG22 THR A 3 -8.090 -12.793 4.167 1.00 0.00 H new ATOM 0 HG23 THR A 3 -7.330 -13.964 3.063 1.00 0.00 H new ATOM 44 N LYS A 4 -7.938 -13.868 6.452 1.00 0.00 N ATOM 45 CA LYS A 4 -7.933 -13.036 7.688 1.00 0.00 C ATOM 46 C LYS A 4 -7.212 -11.717 7.405 1.00 0.00 C ATOM 47 O LYS A 4 -6.045 -11.697 7.074 1.00 0.00 O ATOM 48 CB LYS A 4 -7.207 -13.785 8.807 1.00 0.00 C ATOM 49 CG LYS A 4 -7.660 -13.244 10.163 1.00 0.00 C ATOM 50 CD LYS A 4 -8.757 -14.145 10.732 1.00 0.00 C ATOM 51 CE LYS A 4 -9.522 -13.392 11.823 1.00 0.00 C ATOM 52 NZ LYS A 4 -8.569 -12.941 12.875 1.00 0.00 N ATOM 0 H LYS A 4 -7.045 -13.922 5.963 1.00 0.00 H new ATOM 0 HA LYS A 4 -8.959 -12.834 7.996 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -7.418 -14.852 8.741 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.129 -13.666 8.698 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -6.815 -13.203 10.851 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.032 -12.225 10.054 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.440 -14.450 9.939 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.319 -15.055 11.142 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.039 -12.534 11.394 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.284 -14.038 12.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -9.095 -12.693 13.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -7.898 -13.707 13.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -8.047 -12.108 12.536 1.00 0.00 H new ATOM 66 N ILE A 5 -7.902 -10.616 7.532 1.00 0.00 N ATOM 67 CA ILE A 5 -7.264 -9.295 7.269 1.00 0.00 C ATOM 68 C ILE A 5 -7.115 -8.528 8.587 1.00 0.00 C ATOM 69 O ILE A 5 -7.990 -8.549 9.428 1.00 0.00 O ATOM 70 CB ILE A 5 -8.142 -8.499 6.303 1.00 0.00 C ATOM 71 CG1 ILE A 5 -7.519 -7.123 6.059 1.00 0.00 C ATOM 72 CG2 ILE A 5 -9.542 -8.329 6.899 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.275 -6.937 4.562 1.00 0.00 C ATOM 0 H ILE A 5 -8.883 -10.575 7.807 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.278 -9.442 6.828 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.216 -9.036 5.358 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.180 -6.341 6.431 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.580 -7.034 6.606 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -10.165 -7.761 6.208 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -9.987 -9.310 7.067 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.472 -7.795 7.847 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.831 -5.957 4.385 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.597 -7.712 4.205 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -8.222 -7.008 4.027 1.00 0.00 H new ATOM 85 N ASP A 6 -6.010 -7.855 8.778 1.00 0.00 N ATOM 86 CA ASP A 6 -5.816 -7.096 10.047 1.00 0.00 C ATOM 87 C ASP A 6 -6.137 -5.617 9.814 1.00 0.00 C ATOM 88 O ASP A 6 -5.283 -4.762 9.940 1.00 0.00 O ATOM 89 CB ASP A 6 -4.365 -7.240 10.510 1.00 0.00 C ATOM 90 CG ASP A 6 -3.453 -7.403 9.294 1.00 0.00 C ATOM 91 OD1 ASP A 6 -3.516 -6.560 8.414 1.00 0.00 O ATOM 92 OD2 ASP A 6 -2.707 -8.367 9.263 1.00 0.00 O ATOM 0 H ASP A 6 -5.238 -7.799 8.114 1.00 0.00 H new ATOM 0 HA ASP A 6 -6.482 -7.493 10.813 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -4.068 -6.363 11.086 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -4.267 -8.102 11.169 1.00 0.00 H new ATOM 97 N LYS A 7 -7.360 -5.305 9.477 1.00 0.00 N ATOM 98 CA LYS A 7 -7.722 -3.877 9.242 1.00 0.00 C ATOM 99 C LYS A 7 -7.104 -3.014 10.342 1.00 0.00 C ATOM 100 O LYS A 7 -6.924 -1.823 10.183 1.00 0.00 O ATOM 101 CB LYS A 7 -9.243 -3.716 9.266 1.00 0.00 C ATOM 102 CG LYS A 7 -9.907 -5.068 9.002 1.00 0.00 C ATOM 103 CD LYS A 7 -9.844 -5.924 10.267 1.00 0.00 C ATOM 104 CE LYS A 7 -11.237 -6.021 10.891 1.00 0.00 C ATOM 105 NZ LYS A 7 -12.142 -6.768 9.970 1.00 0.00 N ATOM 0 H LYS A 7 -8.121 -5.974 9.355 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.343 -3.564 8.269 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -9.562 -3.325 10.232 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.554 -2.993 8.512 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -10.944 -4.923 8.700 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -9.404 -5.578 8.180 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -9.472 -6.920 10.026 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -9.145 -5.487 10.980 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.181 -6.528 11.854 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.634 -5.023 11.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -12.854 -7.284 10.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -12.618 -6.098 9.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.585 -7.444 9.409 1.00 0.00 H new ATOM 119 N GLU A 8 -6.771 -3.607 11.457 1.00 0.00 N ATOM 120 CA GLU A 8 -6.159 -2.818 12.561 1.00 0.00 C ATOM 121 C GLU A 8 -4.959 -2.047 12.014 1.00 0.00 C ATOM 122 O GLU A 8 -4.834 -0.853 12.207 1.00 0.00 O ATOM 123 CB GLU A 8 -5.697 -3.765 13.672 1.00 0.00 C ATOM 124 CG GLU A 8 -5.648 -3.009 15.000 1.00 0.00 C ATOM 125 CD GLU A 8 -4.468 -3.515 15.833 1.00 0.00 C ATOM 126 OE1 GLU A 8 -4.365 -4.718 16.009 1.00 0.00 O ATOM 127 OE2 GLU A 8 -3.687 -2.690 16.278 1.00 0.00 O ATOM 0 H GLU A 8 -6.896 -4.601 11.649 1.00 0.00 H new ATOM 0 HA GLU A 8 -6.892 -2.120 12.966 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -6.378 -4.612 13.749 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -4.713 -4.168 13.435 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -5.546 -1.939 14.818 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -6.580 -3.152 15.546 1.00 0.00 H new ATOM 134 N ALA A 9 -4.076 -2.718 11.327 1.00 0.00 N ATOM 135 CA ALA A 9 -2.888 -2.023 10.762 1.00 0.00 C ATOM 136 C ALA A 9 -3.353 -0.996 9.728 1.00 0.00 C ATOM 137 O ALA A 9 -3.206 0.195 9.913 1.00 0.00 O ATOM 138 CB ALA A 9 -1.969 -3.045 10.090 1.00 0.00 C ATOM 0 H ALA A 9 -4.127 -3.718 11.133 1.00 0.00 H new ATOM 0 HA ALA A 9 -2.343 -1.519 11.561 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.099 -2.535 9.676 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.643 -3.780 10.826 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.509 -3.549 9.289 1.00 0.00 H new ATOM 144 N CYS A 10 -3.914 -1.447 8.639 1.00 0.00 N ATOM 145 CA CYS A 10 -4.388 -0.496 7.598 1.00 0.00 C ATOM 146 C CYS A 10 -5.190 0.629 8.253 1.00 0.00 C ATOM 147 O CYS A 10 -4.771 1.768 8.273 1.00 0.00 O ATOM 148 CB CYS A 10 -5.276 -1.239 6.599 1.00 0.00 C ATOM 149 SG CYS A 10 -4.634 -2.913 6.350 1.00 0.00 S ATOM 0 H CYS A 10 -4.064 -2.433 8.427 1.00 0.00 H new ATOM 0 HA CYS A 10 -3.529 -0.071 7.079 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -6.300 -1.282 6.969 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -5.302 -0.703 5.650 1.00 0.00 H new ATOM 0 HG CYS A 10 -3.892 -2.939 5.283 1.00 0.00 H new ATOM 155 N ARG A 11 -6.341 0.329 8.786 1.00 0.00 N ATOM 156 CA ARG A 11 -7.162 1.394 9.426 1.00 0.00 C ATOM 157 C ARG A 11 -6.270 2.267 10.312 1.00 0.00 C ATOM 158 O ARG A 11 -6.237 3.474 10.179 1.00 0.00 O ATOM 159 CB ARG A 11 -8.254 0.749 10.283 1.00 0.00 C ATOM 160 CG ARG A 11 -9.389 1.751 10.501 1.00 0.00 C ATOM 161 CD ARG A 11 -9.891 1.647 11.943 1.00 0.00 C ATOM 162 NE ARG A 11 -10.972 2.648 12.166 1.00 0.00 N ATOM 163 CZ ARG A 11 -11.748 2.549 13.210 1.00 0.00 C ATOM 164 NH1 ARG A 11 -11.578 1.573 14.059 1.00 0.00 N ATOM 165 NH2 ARG A 11 -12.695 3.426 13.406 1.00 0.00 N ATOM 0 H ARG A 11 -6.748 -0.606 8.806 1.00 0.00 H new ATOM 0 HA ARG A 11 -7.620 2.011 8.653 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -8.635 -0.147 9.792 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -7.841 0.436 11.242 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -9.039 2.763 10.299 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -10.204 1.551 9.805 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -10.266 0.642 12.137 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -9.070 1.821 12.639 1.00 0.00 H new ATOM 0 HE ARG A 11 -11.105 3.411 11.502 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -10.838 0.887 13.906 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -12.185 1.496 14.875 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -12.829 4.189 12.743 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -13.301 3.348 14.222 1.00 0.00 H new ATOM 179 N ALA A 12 -5.554 1.665 11.220 1.00 0.00 N ATOM 180 CA ALA A 12 -4.671 2.459 12.121 1.00 0.00 C ATOM 181 C ALA A 12 -3.649 3.249 11.298 1.00 0.00 C ATOM 182 O ALA A 12 -3.514 4.445 11.453 1.00 0.00 O ATOM 183 CB ALA A 12 -3.933 1.512 13.071 1.00 0.00 C ATOM 0 H ALA A 12 -5.542 0.657 11.378 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.282 3.157 12.693 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -3.286 2.090 13.731 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.658 0.957 13.667 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -3.329 0.814 12.492 1.00 0.00 H new ATOM 189 N ALA A 13 -2.921 2.596 10.432 1.00 0.00 N ATOM 190 CA ALA A 13 -1.904 3.322 9.618 1.00 0.00 C ATOM 191 C ALA A 13 -2.597 4.263 8.632 1.00 0.00 C ATOM 192 O ALA A 13 -2.001 5.192 8.120 1.00 0.00 O ATOM 193 CB ALA A 13 -1.055 2.310 8.844 1.00 0.00 C ATOM 0 H ALA A 13 -2.986 1.594 10.253 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.267 3.906 10.282 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.311 2.839 8.248 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.552 1.645 9.546 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -1.697 1.724 8.186 1.00 0.00 H new ATOM 199 N TYR A 14 -3.849 4.030 8.355 1.00 0.00 N ATOM 200 CA TYR A 14 -4.577 4.906 7.395 1.00 0.00 C ATOM 201 C TYR A 14 -4.815 6.281 8.021 1.00 0.00 C ATOM 202 O TYR A 14 -4.544 7.302 7.421 1.00 0.00 O ATOM 203 CB TYR A 14 -5.924 4.271 7.053 1.00 0.00 C ATOM 204 CG TYR A 14 -5.792 3.444 5.797 1.00 0.00 C ATOM 205 CD1 TYR A 14 -4.662 2.642 5.598 1.00 0.00 C ATOM 206 CD2 TYR A 14 -6.804 3.478 4.831 1.00 0.00 C ATOM 207 CE1 TYR A 14 -4.547 1.873 4.436 1.00 0.00 C ATOM 208 CE2 TYR A 14 -6.687 2.711 3.668 1.00 0.00 C ATOM 209 CZ TYR A 14 -5.559 1.908 3.469 1.00 0.00 C ATOM 210 OH TYR A 14 -5.446 1.148 2.323 1.00 0.00 O ATOM 0 H TYR A 14 -4.401 3.270 8.752 1.00 0.00 H new ATOM 0 HA TYR A 14 -3.979 5.020 6.491 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.262 3.645 7.879 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -6.677 5.046 6.912 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.879 2.617 6.342 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -7.676 4.097 4.984 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.677 1.252 4.284 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -7.468 2.738 2.923 1.00 0.00 H new ATOM 0 HH TYR A 14 -5.956 0.318 2.429 1.00 0.00 H new ATOM 220 N ASN A 15 -5.334 6.317 9.217 1.00 0.00 N ATOM 221 CA ASN A 15 -5.606 7.627 9.872 1.00 0.00 C ATOM 222 C ASN A 15 -4.323 8.177 10.503 1.00 0.00 C ATOM 223 O ASN A 15 -4.240 9.341 10.840 1.00 0.00 O ATOM 224 CB ASN A 15 -6.673 7.442 10.953 1.00 0.00 C ATOM 225 CG ASN A 15 -7.173 5.996 10.941 1.00 0.00 C ATOM 226 OD1 ASN A 15 -7.272 5.368 11.976 1.00 0.00 O ATOM 227 ND2 ASN A 15 -7.495 5.438 9.806 1.00 0.00 N ATOM 0 H ASN A 15 -5.582 5.496 9.769 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.962 8.335 9.123 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -6.259 7.686 11.932 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -7.504 8.126 10.779 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.830 4.475 9.788 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -7.412 5.965 8.937 1.00 0.00 H new ATOM 234 N LEU A 16 -3.319 7.358 10.668 1.00 0.00 N ATOM 235 CA LEU A 16 -2.052 7.854 11.276 1.00 0.00 C ATOM 236 C LEU A 16 -1.397 8.861 10.329 1.00 0.00 C ATOM 237 O LEU A 16 -1.023 9.948 10.723 1.00 0.00 O ATOM 238 CB LEU A 16 -1.095 6.683 11.509 1.00 0.00 C ATOM 239 CG LEU A 16 -0.364 6.876 12.839 1.00 0.00 C ATOM 240 CD1 LEU A 16 -1.361 6.751 13.993 1.00 0.00 C ATOM 241 CD2 LEU A 16 0.720 5.806 12.984 1.00 0.00 C ATOM 0 H LEU A 16 -3.322 6.371 10.409 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.274 8.333 12.229 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.649 5.744 11.519 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.376 6.620 10.693 1.00 0.00 H new ATOM 0 HG LEU A 16 0.095 7.865 12.861 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.840 6.889 14.940 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.134 7.513 13.890 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.820 5.763 13.972 1.00 0.00 H new ATOM 0 HD21 LEU A 16 1.242 5.943 13.931 1.00 0.00 H new ATOM 0 HD22 LEU A 16 0.261 4.818 12.962 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.431 5.895 12.162 1.00 0.00 H new ATOM 253 N VAL A 17 -1.257 8.507 9.081 1.00 0.00 N ATOM 254 CA VAL A 17 -0.627 9.442 8.107 1.00 0.00 C ATOM 255 C VAL A 17 -1.425 10.745 8.056 1.00 0.00 C ATOM 256 O VAL A 17 -1.070 11.677 7.362 1.00 0.00 O ATOM 257 CB VAL A 17 -0.613 8.798 6.721 1.00 0.00 C ATOM 258 CG1 VAL A 17 0.371 7.628 6.714 1.00 0.00 C ATOM 259 CG2 VAL A 17 -2.015 8.286 6.383 1.00 0.00 C ATOM 0 H VAL A 17 -1.552 7.611 8.694 1.00 0.00 H new ATOM 0 HA VAL A 17 0.395 9.657 8.420 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.307 9.536 5.980 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.382 7.168 5.726 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.370 7.991 6.956 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.064 6.890 7.455 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.006 7.827 5.395 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.321 7.547 7.124 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.718 9.119 6.389 1.00 0.00 H new ATOM 269 N ARG A 18 -2.501 10.820 8.792 1.00 0.00 N ATOM 270 CA ARG A 18 -3.318 12.066 8.787 1.00 0.00 C ATOM 271 C ARG A 18 -2.655 13.104 9.694 1.00 0.00 C ATOM 272 O ARG A 18 -3.057 14.251 9.741 1.00 0.00 O ATOM 273 CB ARG A 18 -4.731 11.754 9.297 1.00 0.00 C ATOM 274 CG ARG A 18 -4.827 12.063 10.795 1.00 0.00 C ATOM 275 CD ARG A 18 -6.108 11.447 11.363 1.00 0.00 C ATOM 276 NE ARG A 18 -5.755 10.370 12.329 1.00 0.00 N ATOM 277 CZ ARG A 18 -6.658 9.912 13.154 1.00 0.00 C ATOM 278 NH1 ARG A 18 -7.868 10.399 13.133 1.00 0.00 N ATOM 279 NH2 ARG A 18 -6.349 8.968 14.001 1.00 0.00 N ATOM 0 H ARG A 18 -2.848 10.074 9.395 1.00 0.00 H new ATOM 0 HA ARG A 18 -3.384 12.460 7.773 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -5.464 12.345 8.748 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -4.968 10.705 9.118 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -3.957 11.663 11.316 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -4.827 13.141 10.955 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -6.704 12.213 11.858 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -6.718 11.041 10.556 1.00 0.00 H new ATOM 0 HE ARG A 18 -4.809 9.990 12.346 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -8.109 11.138 12.472 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -8.573 10.041 13.777 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -5.402 8.588 14.018 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -7.054 8.610 14.645 1.00 0.00 H new ATOM 293 N ASP A 19 -1.640 12.712 10.416 1.00 0.00 N ATOM 294 CA ASP A 19 -0.950 13.674 11.317 1.00 0.00 C ATOM 295 C ASP A 19 0.222 14.318 10.573 1.00 0.00 C ATOM 296 O ASP A 19 0.719 13.784 9.601 1.00 0.00 O ATOM 297 CB ASP A 19 -0.425 12.934 12.549 1.00 0.00 C ATOM 298 CG ASP A 19 -1.037 13.544 13.812 1.00 0.00 C ATOM 299 OD1 ASP A 19 -2.153 13.180 14.141 1.00 0.00 O ATOM 300 OD2 ASP A 19 -0.378 14.366 14.428 1.00 0.00 O ATOM 0 H ASP A 19 -1.260 11.766 10.419 1.00 0.00 H new ATOM 0 HA ASP A 19 -1.653 14.447 11.629 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -0.677 11.875 12.485 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.662 13.001 12.590 1.00 0.00 H new ATOM 305 N ASP A 20 0.663 15.464 11.014 1.00 0.00 N ATOM 306 CA ASP A 20 1.798 16.141 10.326 1.00 0.00 C ATOM 307 C ASP A 20 3.065 15.292 10.457 1.00 0.00 C ATOM 308 O ASP A 20 4.152 15.808 10.632 1.00 0.00 O ATOM 309 CB ASP A 20 2.034 17.511 10.964 1.00 0.00 C ATOM 310 CG ASP A 20 1.056 18.527 10.371 1.00 0.00 C ATOM 311 OD1 ASP A 20 1.077 18.706 9.164 1.00 0.00 O ATOM 312 OD2 ASP A 20 0.302 19.108 11.134 1.00 0.00 O ATOM 0 H ASP A 20 0.286 15.961 11.821 1.00 0.00 H new ATOM 0 HA ASP A 20 1.557 16.265 9.270 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.900 17.449 12.044 1.00 0.00 H new ATOM 0 HB3 ASP A 20 3.060 17.833 10.789 1.00 0.00 H new ATOM 317 N GLY A 21 2.939 13.995 10.376 1.00 0.00 N ATOM 318 CA GLY A 21 4.138 13.118 10.496 1.00 0.00 C ATOM 319 C GLY A 21 3.693 11.655 10.507 1.00 0.00 C ATOM 320 O GLY A 21 3.558 11.030 9.474 1.00 0.00 O ATOM 0 H GLY A 21 2.056 13.505 10.232 1.00 0.00 H new ATOM 0 HA2 GLY A 21 4.819 13.297 9.664 1.00 0.00 H new ATOM 0 HA3 GLY A 21 4.684 13.351 11.410 1.00 0.00 H new ATOM 324 N SER A 22 3.463 11.106 11.669 1.00 0.00 N ATOM 325 CA SER A 22 3.026 9.682 11.748 1.00 0.00 C ATOM 326 C SER A 22 4.217 8.765 11.454 1.00 0.00 C ATOM 327 O SER A 22 4.546 7.894 12.233 1.00 0.00 O ATOM 328 CB SER A 22 1.926 9.431 10.716 1.00 0.00 C ATOM 329 OG SER A 22 1.214 10.639 10.484 1.00 0.00 O ATOM 0 H SER A 22 3.559 11.581 12.566 1.00 0.00 H new ATOM 0 HA SER A 22 2.644 9.474 12.748 1.00 0.00 H new ATOM 0 HB2 SER A 22 2.361 9.068 9.785 1.00 0.00 H new ATOM 0 HB3 SER A 22 1.246 8.658 11.073 1.00 0.00 H new ATOM 0 HG SER A 22 0.341 10.595 10.927 1.00 0.00 H new ATOM 335 N ALA A 23 4.851 8.958 10.328 1.00 0.00 N ATOM 336 CA ALA A 23 6.020 8.106 9.954 1.00 0.00 C ATOM 337 C ALA A 23 5.522 6.818 9.297 1.00 0.00 C ATOM 338 O ALA A 23 5.879 5.726 9.691 1.00 0.00 O ATOM 339 CB ALA A 23 6.842 7.766 11.200 1.00 0.00 C ATOM 0 H ALA A 23 4.608 9.675 9.645 1.00 0.00 H new ATOM 0 HA ALA A 23 6.651 8.652 9.253 1.00 0.00 H new ATOM 0 HB1 ALA A 23 7.692 7.145 10.917 1.00 0.00 H new ATOM 0 HB2 ALA A 23 7.202 8.686 11.660 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.218 7.225 11.911 1.00 0.00 H new ATOM 345 N VAL A 24 4.700 6.946 8.294 1.00 0.00 N ATOM 346 CA VAL A 24 4.166 5.746 7.591 1.00 0.00 C ATOM 347 C VAL A 24 3.270 6.215 6.445 1.00 0.00 C ATOM 348 O VAL A 24 2.128 5.818 6.334 1.00 0.00 O ATOM 349 CB VAL A 24 3.345 4.899 8.567 1.00 0.00 C ATOM 350 CG1 VAL A 24 2.305 5.781 9.260 1.00 0.00 C ATOM 351 CG2 VAL A 24 2.632 3.784 7.800 1.00 0.00 C ATOM 0 H VAL A 24 4.372 7.839 7.927 1.00 0.00 H new ATOM 0 HA VAL A 24 4.988 5.144 7.204 1.00 0.00 H new ATOM 0 HB VAL A 24 4.009 4.463 9.313 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.721 5.177 9.955 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.810 6.577 9.807 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.642 6.218 8.513 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.047 3.181 8.495 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.970 4.222 7.053 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.370 3.154 7.305 1.00 0.00 H new ATOM 361 N ILE A 25 3.778 7.083 5.609 1.00 0.00 N ATOM 362 CA ILE A 25 2.959 7.615 4.483 1.00 0.00 C ATOM 363 C ILE A 25 2.067 6.508 3.891 1.00 0.00 C ATOM 364 O ILE A 25 0.923 6.751 3.562 1.00 0.00 O ATOM 365 CB ILE A 25 3.882 8.228 3.420 1.00 0.00 C ATOM 366 CG1 ILE A 25 3.049 8.674 2.220 1.00 0.00 C ATOM 367 CG2 ILE A 25 4.928 7.211 2.968 1.00 0.00 C ATOM 368 CD1 ILE A 25 3.920 9.486 1.261 1.00 0.00 C ATOM 0 H ILE A 25 4.730 7.447 5.659 1.00 0.00 H new ATOM 0 HA ILE A 25 2.298 8.398 4.855 1.00 0.00 H new ATOM 0 HB ILE A 25 4.395 9.087 3.853 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.639 7.804 1.706 1.00 0.00 H new ATOM 0 HG13 ILE A 25 2.203 9.274 2.555 1.00 0.00 H new ATOM 0 HG21 ILE A 25 5.573 7.663 2.215 1.00 0.00 H new ATOM 0 HG22 ILE A 25 5.529 6.903 3.823 1.00 0.00 H new ATOM 0 HG23 ILE A 25 4.429 6.340 2.543 1.00 0.00 H new ATOM 0 HD11 ILE A 25 3.322 9.802 0.406 1.00 0.00 H new ATOM 0 HD12 ILE A 25 4.308 10.364 1.777 1.00 0.00 H new ATOM 0 HD13 ILE A 25 4.751 8.871 0.915 1.00 0.00 H new ATOM 380 N TRP A 26 2.549 5.292 3.771 1.00 0.00 N ATOM 381 CA TRP A 26 1.672 4.213 3.228 1.00 0.00 C ATOM 382 C TRP A 26 2.076 2.859 3.810 1.00 0.00 C ATOM 383 O TRP A 26 3.152 2.700 4.354 1.00 0.00 O ATOM 384 CB TRP A 26 1.766 4.156 1.710 1.00 0.00 C ATOM 385 CG TRP A 26 3.177 3.925 1.278 1.00 0.00 C ATOM 386 CD1 TRP A 26 4.026 4.880 0.831 1.00 0.00 C ATOM 387 CD2 TRP A 26 3.909 2.670 1.231 1.00 0.00 C ATOM 388 NE1 TRP A 26 5.234 4.288 0.513 1.00 0.00 N ATOM 389 CE2 TRP A 26 5.212 2.925 0.744 1.00 0.00 C ATOM 390 CE3 TRP A 26 3.569 1.352 1.564 1.00 0.00 C ATOM 391 CZ2 TRP A 26 6.145 1.900 0.592 1.00 0.00 C ATOM 392 CZ3 TRP A 26 4.504 0.318 1.414 1.00 0.00 C ATOM 393 CH2 TRP A 26 5.788 0.589 0.928 1.00 0.00 C ATOM 0 H TRP A 26 3.496 5.007 4.022 1.00 0.00 H new ATOM 0 HA TRP A 26 0.644 4.439 3.512 1.00 0.00 H new ATOM 0 HB2 TRP A 26 1.129 3.357 1.331 1.00 0.00 H new ATOM 0 HB3 TRP A 26 1.397 5.088 1.282 1.00 0.00 H new ATOM 0 HD1 TRP A 26 3.797 5.931 0.738 1.00 0.00 H new ATOM 0 HE1 TRP A 26 6.042 4.795 0.152 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.580 1.131 1.939 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 7.135 2.116 0.218 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 4.232 -0.694 1.675 1.00 0.00 H new ATOM 0 HH2 TRP A 26 6.503 -0.212 0.812 1.00 0.00 H new ATOM 404 N VAL A 27 1.222 1.879 3.695 1.00 0.00 N ATOM 405 CA VAL A 27 1.554 0.532 4.235 1.00 0.00 C ATOM 406 C VAL A 27 1.057 -0.539 3.263 1.00 0.00 C ATOM 407 O VAL A 27 -0.061 -0.487 2.790 1.00 0.00 O ATOM 408 CB VAL A 27 0.873 0.343 5.592 1.00 0.00 C ATOM 409 CG1 VAL A 27 1.352 1.426 6.559 1.00 0.00 C ATOM 410 CG2 VAL A 27 -0.644 0.449 5.419 1.00 0.00 C ATOM 0 H VAL A 27 0.307 1.954 3.250 1.00 0.00 H new ATOM 0 HA VAL A 27 2.634 0.444 4.356 1.00 0.00 H new ATOM 0 HB VAL A 27 1.127 -0.639 5.992 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.867 1.291 7.526 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.433 1.352 6.682 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.099 2.408 6.160 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.131 0.315 6.385 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.897 1.431 5.019 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.986 -0.323 4.730 1.00 0.00 H new ATOM 420 N THR A 28 1.873 -1.519 2.973 1.00 0.00 N ATOM 421 CA THR A 28 1.441 -2.605 2.044 1.00 0.00 C ATOM 422 C THR A 28 1.491 -3.940 2.789 1.00 0.00 C ATOM 423 O THR A 28 2.435 -4.221 3.501 1.00 0.00 O ATOM 424 CB THR A 28 2.387 -2.674 0.838 1.00 0.00 C ATOM 425 OG1 THR A 28 3.717 -2.875 1.292 1.00 0.00 O ATOM 426 CG2 THR A 28 2.308 -1.373 0.033 1.00 0.00 C ATOM 0 H THR A 28 2.820 -1.614 3.340 1.00 0.00 H new ATOM 0 HA THR A 28 0.429 -2.400 1.695 1.00 0.00 H new ATOM 0 HB THR A 28 2.090 -3.505 0.198 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.322 -2.921 0.522 1.00 0.00 H new ATOM 0 HG21 THR A 28 2.983 -1.432 -0.821 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.288 -1.225 -0.321 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.597 -0.535 0.667 1.00 0.00 H new ATOM 434 N PHE A 29 0.497 -4.772 2.615 1.00 0.00 N ATOM 435 CA PHE A 29 0.505 -6.093 3.297 1.00 0.00 C ATOM 436 C PHE A 29 0.435 -7.176 2.237 1.00 0.00 C ATOM 437 O PHE A 29 0.039 -6.938 1.114 1.00 0.00 O ATOM 438 CB PHE A 29 -0.683 -6.234 4.250 1.00 0.00 C ATOM 439 CG PHE A 29 -1.763 -5.238 3.916 1.00 0.00 C ATOM 440 CD1 PHE A 29 -1.725 -3.955 4.473 1.00 0.00 C ATOM 441 CD2 PHE A 29 -2.814 -5.605 3.070 1.00 0.00 C ATOM 442 CE1 PHE A 29 -2.739 -3.038 4.182 1.00 0.00 C ATOM 443 CE2 PHE A 29 -3.830 -4.689 2.781 1.00 0.00 C ATOM 444 CZ PHE A 29 -3.791 -3.406 3.338 1.00 0.00 C ATOM 0 H PHE A 29 -0.318 -4.591 2.029 1.00 0.00 H new ATOM 0 HA PHE A 29 1.418 -6.184 3.886 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -1.085 -7.246 4.189 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -0.350 -6.084 5.277 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -0.913 -3.674 5.127 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -2.841 -6.595 2.640 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -2.710 -2.046 4.609 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -4.643 -4.971 2.129 1.00 0.00 H new ATOM 0 HZ PHE A 29 -4.576 -2.698 3.115 1.00 0.00 H new ATOM 454 N ARG A 30 0.832 -8.360 2.579 1.00 0.00 N ATOM 455 CA ARG A 30 0.807 -9.455 1.584 1.00 0.00 C ATOM 456 C ARG A 30 0.350 -10.748 2.253 1.00 0.00 C ATOM 457 O ARG A 30 0.612 -10.989 3.414 1.00 0.00 O ATOM 458 CB ARG A 30 2.209 -9.625 1.006 1.00 0.00 C ATOM 459 CG ARG A 30 3.233 -9.660 2.145 1.00 0.00 C ATOM 460 CD ARG A 30 4.647 -9.674 1.562 1.00 0.00 C ATOM 461 NE ARG A 30 5.342 -10.927 1.972 1.00 0.00 N ATOM 462 CZ ARG A 30 6.434 -11.297 1.362 1.00 0.00 C ATOM 463 NH1 ARG A 30 6.918 -10.570 0.392 1.00 0.00 N ATOM 464 NH2 ARG A 30 7.043 -12.393 1.722 1.00 0.00 N ATOM 0 H ARG A 30 1.173 -8.618 3.505 1.00 0.00 H new ATOM 0 HA ARG A 30 0.110 -9.215 0.781 1.00 0.00 H new ATOM 0 HB2 ARG A 30 2.265 -10.545 0.425 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.435 -8.804 0.325 1.00 0.00 H new ATOM 0 HG2 ARG A 30 3.104 -8.792 2.791 1.00 0.00 H new ATOM 0 HG3 ARG A 30 3.075 -10.544 2.763 1.00 0.00 H new ATOM 0 HD2 ARG A 30 4.604 -9.609 0.475 1.00 0.00 H new ATOM 0 HD3 ARG A 30 5.205 -8.805 1.912 1.00 0.00 H new ATOM 0 HE ARG A 30 4.964 -11.495 2.730 1.00 0.00 H new ATOM 0 HH11 ARG A 30 6.442 -9.713 0.111 1.00 0.00 H new ATOM 0 HH12 ARG A 30 7.772 -10.859 -0.085 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.665 -12.961 2.481 1.00 0.00 H new ATOM 0 HH22 ARG A 30 7.897 -12.682 1.245 1.00 0.00 H new ATOM 478 N TYR A 31 -0.343 -11.576 1.527 1.00 0.00 N ATOM 479 CA TYR A 31 -0.838 -12.854 2.107 1.00 0.00 C ATOM 480 C TYR A 31 0.337 -13.703 2.577 1.00 0.00 C ATOM 481 O TYR A 31 0.981 -14.369 1.792 1.00 0.00 O ATOM 482 CB TYR A 31 -1.612 -13.627 1.040 1.00 0.00 C ATOM 483 CG TYR A 31 -2.128 -12.660 0.002 1.00 0.00 C ATOM 484 CD1 TYR A 31 -1.310 -12.291 -1.072 1.00 0.00 C ATOM 485 CD2 TYR A 31 -3.417 -12.130 0.116 1.00 0.00 C ATOM 486 CE1 TYR A 31 -1.780 -11.390 -2.033 1.00 0.00 C ATOM 487 CE2 TYR A 31 -3.888 -11.229 -0.847 1.00 0.00 C ATOM 488 CZ TYR A 31 -3.070 -10.859 -1.921 1.00 0.00 C ATOM 489 OH TYR A 31 -3.535 -9.969 -2.867 1.00 0.00 O ATOM 0 H TYR A 31 -0.590 -11.422 0.549 1.00 0.00 H new ATOM 0 HA TYR A 31 -1.487 -12.632 2.954 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -0.966 -14.370 0.572 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -2.442 -14.167 1.496 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -0.315 -12.702 -1.159 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -4.048 -12.415 0.945 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -1.148 -11.104 -2.861 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -4.883 -10.819 -0.761 1.00 0.00 H new ATOM 0 HH TYR A 31 -3.515 -9.061 -2.499 1.00 0.00 H new ATOM 499 N ASP A 32 0.617 -13.708 3.850 1.00 0.00 N ATOM 500 CA ASP A 32 1.743 -14.545 4.333 1.00 0.00 C ATOM 501 C ASP A 32 1.173 -15.857 4.873 1.00 0.00 C ATOM 502 O ASP A 32 0.778 -15.928 6.013 1.00 0.00 O ATOM 503 CB ASP A 32 2.464 -13.801 5.460 1.00 0.00 C ATOM 504 CG ASP A 32 3.875 -13.423 5.003 1.00 0.00 C ATOM 505 OD1 ASP A 32 4.515 -14.250 4.376 1.00 0.00 O ATOM 506 OD2 ASP A 32 4.290 -12.311 5.287 1.00 0.00 O ATOM 0 H ASP A 32 0.122 -13.176 4.566 1.00 0.00 H new ATOM 0 HA ASP A 32 2.443 -14.749 3.523 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.907 -12.905 5.733 1.00 0.00 H new ATOM 0 HB3 ASP A 32 2.515 -14.428 6.350 1.00 0.00 H new ATOM 511 N GLY A 33 1.168 -16.881 4.042 1.00 0.00 N ATOM 512 CA GLY A 33 0.648 -18.249 4.413 1.00 0.00 C ATOM 513 C GLY A 33 -0.012 -18.274 5.796 1.00 0.00 C ATOM 514 O GLY A 33 0.237 -19.161 6.588 1.00 0.00 O ATOM 0 H GLY A 33 1.516 -16.823 3.085 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.074 -18.574 3.664 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.471 -18.964 4.394 1.00 0.00 H new ATOM 518 N ALA A 34 -0.858 -17.330 6.097 1.00 0.00 N ATOM 519 CA ALA A 34 -1.528 -17.331 7.422 1.00 0.00 C ATOM 520 C ALA A 34 -2.491 -16.147 7.490 1.00 0.00 C ATOM 521 O ALA A 34 -3.697 -16.289 7.463 1.00 0.00 O ATOM 522 CB ALA A 34 -0.478 -17.202 8.527 1.00 0.00 C ATOM 0 H ALA A 34 -1.113 -16.558 5.481 1.00 0.00 H new ATOM 0 HA ALA A 34 -2.077 -18.263 7.558 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.971 -17.203 9.499 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.215 -18.042 8.471 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.072 -16.269 8.400 1.00 0.00 H new ATOM 528 N THR A 35 -1.930 -14.975 7.603 1.00 0.00 N ATOM 529 CA THR A 35 -2.758 -13.740 7.707 1.00 0.00 C ATOM 530 C THR A 35 -2.181 -12.627 6.828 1.00 0.00 C ATOM 531 O THR A 35 -0.988 -12.542 6.614 1.00 0.00 O ATOM 532 CB THR A 35 -2.758 -13.271 9.162 1.00 0.00 C ATOM 533 OG1 THR A 35 -3.078 -14.365 10.010 1.00 0.00 O ATOM 534 CG2 THR A 35 -3.789 -12.157 9.347 1.00 0.00 C ATOM 0 H THR A 35 -0.922 -14.818 7.628 1.00 0.00 H new ATOM 0 HA THR A 35 -3.771 -13.963 7.372 1.00 0.00 H new ATOM 0 HB THR A 35 -1.770 -12.888 9.419 1.00 0.00 H new ATOM 0 HG1 THR A 35 -3.077 -14.067 10.943 1.00 0.00 H new ATOM 0 HG21 THR A 35 -3.785 -11.826 10.386 1.00 0.00 H new ATOM 0 HG22 THR A 35 -3.538 -11.318 8.698 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.780 -12.532 9.089 1.00 0.00 H new ATOM 542 N ILE A 36 -3.025 -11.759 6.340 1.00 0.00 N ATOM 543 CA ILE A 36 -2.545 -10.628 5.499 1.00 0.00 C ATOM 544 C ILE A 36 -1.972 -9.556 6.429 1.00 0.00 C ATOM 545 O ILE A 36 -2.705 -8.765 6.988 1.00 0.00 O ATOM 546 CB ILE A 36 -3.733 -10.048 4.720 1.00 0.00 C ATOM 547 CG1 ILE A 36 -4.190 -11.054 3.660 1.00 0.00 C ATOM 548 CG2 ILE A 36 -3.327 -8.740 4.040 1.00 0.00 C ATOM 549 CD1 ILE A 36 -5.601 -11.548 3.990 1.00 0.00 C ATOM 0 H ILE A 36 -4.034 -11.786 6.490 1.00 0.00 H new ATOM 0 HA ILE A 36 -1.782 -10.965 4.797 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.550 -9.850 5.414 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.179 -10.588 2.674 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.499 -11.896 3.623 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.177 -8.337 3.490 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.009 -8.021 4.795 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.505 -8.929 3.350 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -5.922 -12.264 3.233 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.598 -12.030 4.967 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -6.288 -10.702 4.005 1.00 0.00 H new ATOM 561 N VAL A 37 -0.674 -9.535 6.622 1.00 0.00 N ATOM 562 CA VAL A 37 -0.079 -8.522 7.545 1.00 0.00 C ATOM 563 C VAL A 37 0.924 -7.626 6.801 1.00 0.00 C ATOM 564 O VAL A 37 1.593 -8.061 5.884 1.00 0.00 O ATOM 565 CB VAL A 37 0.646 -9.247 8.680 1.00 0.00 C ATOM 566 CG1 VAL A 37 -0.025 -10.599 8.928 1.00 0.00 C ATOM 567 CG2 VAL A 37 2.111 -9.472 8.293 1.00 0.00 C ATOM 0 H VAL A 37 -0.008 -10.171 6.183 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.879 -7.897 7.940 1.00 0.00 H new ATOM 0 HB VAL A 37 0.599 -8.642 9.585 1.00 0.00 H new ATOM 0 HG11 VAL A 37 0.490 -11.118 9.737 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.068 -10.442 9.203 1.00 0.00 H new ATOM 0 HG13 VAL A 37 0.024 -11.201 8.021 1.00 0.00 H new ATOM 0 HG21 VAL A 37 2.626 -9.989 9.103 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.159 -10.077 7.388 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.591 -8.510 8.113 1.00 0.00 H new ATOM 577 N PRO A 38 1.039 -6.381 7.212 1.00 0.00 N ATOM 578 CA PRO A 38 1.985 -5.408 6.599 1.00 0.00 C ATOM 579 C PRO A 38 3.336 -6.041 6.256 1.00 0.00 C ATOM 580 O PRO A 38 4.083 -6.438 7.127 1.00 0.00 O ATOM 581 CB PRO A 38 2.167 -4.352 7.687 1.00 0.00 C ATOM 582 CG PRO A 38 0.920 -4.391 8.511 1.00 0.00 C ATOM 583 CD PRO A 38 0.270 -5.763 8.305 1.00 0.00 C ATOM 0 HA PRO A 38 1.602 -5.015 5.657 1.00 0.00 H new ATOM 0 HB2 PRO A 38 3.045 -4.567 8.297 1.00 0.00 H new ATOM 0 HB3 PRO A 38 2.316 -3.364 7.251 1.00 0.00 H new ATOM 0 HG2 PRO A 38 1.152 -4.232 9.564 1.00 0.00 H new ATOM 0 HG3 PRO A 38 0.238 -3.595 8.211 1.00 0.00 H new ATOM 0 HD2 PRO A 38 0.319 -6.364 9.213 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -0.784 -5.667 8.043 1.00 0.00 H new ATOM 591 N GLY A 39 3.662 -6.134 4.995 1.00 0.00 N ATOM 592 CA GLY A 39 4.968 -6.734 4.609 1.00 0.00 C ATOM 593 C GLY A 39 6.010 -5.628 4.496 1.00 0.00 C ATOM 594 O GLY A 39 7.194 -5.847 4.664 1.00 0.00 O ATOM 0 H GLY A 39 3.080 -5.821 4.218 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.279 -7.469 5.352 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.874 -7.261 3.659 1.00 0.00 H new ATOM 598 N ASP A 40 5.570 -4.439 4.213 1.00 0.00 N ATOM 599 CA ASP A 40 6.510 -3.297 4.085 1.00 0.00 C ATOM 600 C ASP A 40 5.853 -2.034 4.632 1.00 0.00 C ATOM 601 O ASP A 40 4.738 -2.053 5.115 1.00 0.00 O ATOM 602 CB ASP A 40 6.876 -3.077 2.621 1.00 0.00 C ATOM 603 CG ASP A 40 8.379 -3.292 2.434 1.00 0.00 C ATOM 604 OD1 ASP A 40 9.119 -2.336 2.599 1.00 0.00 O ATOM 605 OD2 ASP A 40 8.764 -4.409 2.128 1.00 0.00 O ATOM 0 H ASP A 40 4.588 -4.207 4.063 1.00 0.00 H new ATOM 0 HA ASP A 40 7.415 -3.520 4.651 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.318 -3.766 1.988 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.601 -2.068 2.314 1.00 0.00 H new ATOM 610 N GLN A 41 6.548 -0.941 4.563 1.00 0.00 N ATOM 611 CA GLN A 41 5.989 0.339 5.083 1.00 0.00 C ATOM 612 C GLN A 41 6.223 1.464 4.089 1.00 0.00 C ATOM 613 O GLN A 41 6.811 1.279 3.049 1.00 0.00 O ATOM 614 CB GLN A 41 6.680 0.708 6.384 1.00 0.00 C ATOM 615 CG GLN A 41 8.122 1.158 6.096 1.00 0.00 C ATOM 616 CD GLN A 41 8.796 0.183 5.117 1.00 0.00 C ATOM 617 OE1 GLN A 41 9.322 -0.833 5.523 1.00 0.00 O ATOM 618 NE2 GLN A 41 8.804 0.454 3.834 1.00 0.00 N ATOM 0 H GLN A 41 7.486 -0.874 4.167 1.00 0.00 H new ATOM 0 HA GLN A 41 4.919 0.204 5.242 1.00 0.00 H new ATOM 0 HB2 GLN A 41 6.132 1.507 6.884 1.00 0.00 H new ATOM 0 HB3 GLN A 41 6.684 -0.147 7.060 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.120 2.164 5.676 1.00 0.00 H new ATOM 0 HG3 GLN A 41 8.690 1.202 7.026 1.00 0.00 H new ATOM 0 HE21 GLN A 41 8.363 1.307 3.490 1.00 0.00 H new ATOM 0 HE22 GLN A 41 9.251 -0.188 3.180 1.00 0.00 H new ATOM 627 N GLY A 42 5.772 2.641 4.412 1.00 0.00 N ATOM 628 CA GLY A 42 5.969 3.788 3.492 1.00 0.00 C ATOM 629 C GLY A 42 6.468 5.001 4.271 1.00 0.00 C ATOM 630 O GLY A 42 5.768 5.576 5.080 1.00 0.00 O ATOM 0 H GLY A 42 5.274 2.857 5.276 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.687 3.523 2.716 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.031 4.028 2.990 1.00 0.00 H new ATOM 634 N ALA A 43 7.671 5.409 3.988 1.00 0.00 N ATOM 635 CA ALA A 43 8.247 6.608 4.652 1.00 0.00 C ATOM 636 C ALA A 43 8.516 7.629 3.552 1.00 0.00 C ATOM 637 O ALA A 43 8.371 8.822 3.732 1.00 0.00 O ATOM 638 CB ALA A 43 9.556 6.238 5.353 1.00 0.00 C ATOM 0 H ALA A 43 8.289 4.956 3.315 1.00 0.00 H new ATOM 0 HA ALA A 43 7.566 7.008 5.403 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.972 7.122 5.837 1.00 0.00 H new ATOM 0 HB2 ALA A 43 9.363 5.471 6.103 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.267 5.858 4.619 1.00 0.00 H new ATOM 644 N ASP A 44 8.882 7.143 2.399 1.00 0.00 N ATOM 645 CA ASP A 44 9.143 8.032 1.240 1.00 0.00 C ATOM 646 C ASP A 44 8.319 7.517 0.058 1.00 0.00 C ATOM 647 O ASP A 44 8.217 6.327 -0.165 1.00 0.00 O ATOM 648 CB ASP A 44 10.631 7.998 0.887 1.00 0.00 C ATOM 649 CG ASP A 44 11.345 9.171 1.563 1.00 0.00 C ATOM 650 OD1 ASP A 44 11.088 9.398 2.734 1.00 0.00 O ATOM 651 OD2 ASP A 44 12.133 9.822 0.898 1.00 0.00 O ATOM 0 H ASP A 44 9.013 6.149 2.211 1.00 0.00 H new ATOM 0 HA ASP A 44 8.866 9.059 1.478 1.00 0.00 H new ATOM 0 HB2 ASP A 44 11.071 7.055 1.212 1.00 0.00 H new ATOM 0 HB3 ASP A 44 10.760 8.054 -0.194 1.00 0.00 H new ATOM 656 N TYR A 45 7.725 8.394 -0.697 1.00 0.00 N ATOM 657 CA TYR A 45 6.903 7.941 -1.856 1.00 0.00 C ATOM 658 C TYR A 45 7.795 7.208 -2.858 1.00 0.00 C ATOM 659 O TYR A 45 7.323 6.547 -3.760 1.00 0.00 O ATOM 660 CB TYR A 45 6.264 9.159 -2.517 1.00 0.00 C ATOM 661 CG TYR A 45 6.517 9.133 -4.004 1.00 0.00 C ATOM 662 CD1 TYR A 45 7.676 9.716 -4.528 1.00 0.00 C ATOM 663 CD2 TYR A 45 5.589 8.527 -4.858 1.00 0.00 C ATOM 664 CE1 TYR A 45 7.907 9.693 -5.909 1.00 0.00 C ATOM 665 CE2 TYR A 45 5.819 8.503 -6.239 1.00 0.00 C ATOM 666 CZ TYR A 45 6.979 9.087 -6.764 1.00 0.00 C ATOM 667 OH TYR A 45 7.207 9.064 -8.125 1.00 0.00 O ATOM 0 H TYR A 45 7.771 9.404 -0.564 1.00 0.00 H new ATOM 0 HA TYR A 45 6.121 7.262 -1.516 1.00 0.00 H new ATOM 0 HB2 TYR A 45 5.191 9.167 -2.323 1.00 0.00 H new ATOM 0 HB3 TYR A 45 6.673 10.073 -2.086 1.00 0.00 H new ATOM 0 HD1 TYR A 45 8.392 10.183 -3.868 1.00 0.00 H new ATOM 0 HD2 TYR A 45 4.695 8.078 -4.452 1.00 0.00 H new ATOM 0 HE1 TYR A 45 8.801 10.143 -6.314 1.00 0.00 H new ATOM 0 HE2 TYR A 45 5.103 8.035 -6.898 1.00 0.00 H new ATOM 0 HH TYR A 45 6.466 8.605 -8.573 1.00 0.00 H new ATOM 677 N GLN A 46 9.082 7.319 -2.708 1.00 0.00 N ATOM 678 CA GLN A 46 10.001 6.626 -3.649 1.00 0.00 C ATOM 679 C GLN A 46 10.184 5.172 -3.206 1.00 0.00 C ATOM 680 O GLN A 46 10.370 4.286 -4.017 1.00 0.00 O ATOM 681 CB GLN A 46 11.353 7.338 -3.647 1.00 0.00 C ATOM 682 CG GLN A 46 11.270 8.586 -4.527 1.00 0.00 C ATOM 683 CD GLN A 46 11.389 8.187 -5.999 1.00 0.00 C ATOM 684 OE1 GLN A 46 12.457 7.840 -6.462 1.00 0.00 O ATOM 685 NE2 GLN A 46 10.328 8.222 -6.761 1.00 0.00 N ATOM 0 H GLN A 46 9.539 7.860 -1.974 1.00 0.00 H new ATOM 0 HA GLN A 46 9.581 6.645 -4.654 1.00 0.00 H new ATOM 0 HB2 GLN A 46 11.629 7.615 -2.630 1.00 0.00 H new ATOM 0 HB3 GLN A 46 12.130 6.669 -4.018 1.00 0.00 H new ATOM 0 HG2 GLN A 46 10.325 9.102 -4.355 1.00 0.00 H new ATOM 0 HG3 GLN A 46 12.066 9.282 -4.263 1.00 0.00 H new ATOM 0 HE21 GLN A 46 9.431 8.513 -6.373 1.00 0.00 H new ATOM 0 HE22 GLN A 46 10.397 7.958 -7.744 1.00 0.00 H new ATOM 694 N HIS A 47 10.130 4.917 -1.926 1.00 0.00 N ATOM 695 CA HIS A 47 10.298 3.518 -1.437 1.00 0.00 C ATOM 696 C HIS A 47 9.150 2.658 -1.966 1.00 0.00 C ATOM 697 O HIS A 47 9.345 1.539 -2.394 1.00 0.00 O ATOM 698 CB HIS A 47 10.280 3.502 0.091 1.00 0.00 C ATOM 699 CG HIS A 47 11.672 3.257 0.608 1.00 0.00 C ATOM 700 ND1 HIS A 47 12.203 3.971 1.673 1.00 0.00 N ATOM 701 CD2 HIS A 47 12.655 2.381 0.215 1.00 0.00 C ATOM 702 CE1 HIS A 47 13.453 3.517 1.882 1.00 0.00 C ATOM 703 NE2 HIS A 47 13.774 2.550 1.022 1.00 0.00 N ATOM 0 H HIS A 47 9.977 5.616 -1.199 1.00 0.00 H new ATOM 0 HA HIS A 47 11.249 3.121 -1.791 1.00 0.00 H new ATOM 0 HB2 HIS A 47 9.902 4.451 0.471 1.00 0.00 H new ATOM 0 HB3 HIS A 47 9.606 2.724 0.449 1.00 0.00 H new ATOM 0 HD2 HIS A 47 12.571 1.672 -0.595 1.00 0.00 H new ATOM 0 HE1 HIS A 47 14.114 3.890 2.651 1.00 0.00 H new ATOM 0 HE2 HIS A 47 14.656 2.041 0.968 1.00 0.00 H new ATOM 712 N PHE A 48 7.953 3.175 -1.950 1.00 0.00 N ATOM 713 CA PHE A 48 6.799 2.390 -2.461 1.00 0.00 C ATOM 714 C PHE A 48 7.087 1.998 -3.915 1.00 0.00 C ATOM 715 O PHE A 48 6.779 0.906 -4.351 1.00 0.00 O ATOM 716 CB PHE A 48 5.524 3.253 -2.350 1.00 0.00 C ATOM 717 CG PHE A 48 4.950 3.573 -3.715 1.00 0.00 C ATOM 718 CD1 PHE A 48 4.486 2.549 -4.551 1.00 0.00 C ATOM 719 CD2 PHE A 48 4.879 4.905 -4.139 1.00 0.00 C ATOM 720 CE1 PHE A 48 3.957 2.860 -5.810 1.00 0.00 C ATOM 721 CE2 PHE A 48 4.349 5.214 -5.397 1.00 0.00 C ATOM 722 CZ PHE A 48 3.891 4.193 -6.231 1.00 0.00 C ATOM 0 H PHE A 48 7.726 4.107 -1.605 1.00 0.00 H new ATOM 0 HA PHE A 48 6.648 1.481 -1.879 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.778 2.727 -1.755 1.00 0.00 H new ATOM 0 HB3 PHE A 48 5.755 4.180 -1.825 1.00 0.00 H new ATOM 0 HD1 PHE A 48 4.536 1.521 -4.225 1.00 0.00 H new ATOM 0 HD2 PHE A 48 5.234 5.696 -3.494 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.600 2.071 -6.456 1.00 0.00 H new ATOM 0 HE2 PHE A 48 4.294 6.242 -5.722 1.00 0.00 H new ATOM 0 HZ PHE A 48 3.485 4.432 -7.203 1.00 0.00 H new ATOM 732 N ILE A 49 7.653 2.898 -4.671 1.00 0.00 N ATOM 733 CA ILE A 49 7.945 2.612 -6.107 1.00 0.00 C ATOM 734 C ILE A 49 8.983 1.491 -6.269 1.00 0.00 C ATOM 735 O ILE A 49 8.928 0.732 -7.217 1.00 0.00 O ATOM 736 CB ILE A 49 8.460 3.885 -6.775 1.00 0.00 C ATOM 737 CG1 ILE A 49 7.352 4.936 -6.740 1.00 0.00 C ATOM 738 CG2 ILE A 49 8.842 3.589 -8.225 1.00 0.00 C ATOM 739 CD1 ILE A 49 6.480 4.803 -7.988 1.00 0.00 C ATOM 0 H ILE A 49 7.929 3.828 -4.354 1.00 0.00 H new ATOM 0 HA ILE A 49 7.022 2.278 -6.580 1.00 0.00 H new ATOM 0 HB ILE A 49 9.340 4.252 -6.246 1.00 0.00 H new ATOM 0 HG12 ILE A 49 6.744 4.809 -5.844 1.00 0.00 H new ATOM 0 HG13 ILE A 49 7.786 5.935 -6.692 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.209 4.500 -8.698 1.00 0.00 H new ATOM 0 HG22 ILE A 49 9.623 2.829 -8.248 1.00 0.00 H new ATOM 0 HG23 ILE A 49 7.967 3.227 -8.765 1.00 0.00 H new ATOM 0 HD11 ILE A 49 5.690 5.553 -7.962 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.092 4.952 -8.877 1.00 0.00 H new ATOM 0 HD13 ILE A 49 6.035 3.808 -8.017 1.00 0.00 H new ATOM 751 N GLN A 50 9.925 1.361 -5.370 1.00 0.00 N ATOM 752 CA GLN A 50 10.929 0.270 -5.524 1.00 0.00 C ATOM 753 C GLN A 50 10.366 -0.985 -4.875 1.00 0.00 C ATOM 754 O GLN A 50 10.801 -2.092 -5.121 1.00 0.00 O ATOM 755 CB GLN A 50 12.247 0.673 -4.848 1.00 0.00 C ATOM 756 CG GLN A 50 12.233 0.263 -3.372 1.00 0.00 C ATOM 757 CD GLN A 50 12.626 -1.210 -3.244 1.00 0.00 C ATOM 758 OE1 GLN A 50 12.992 -1.840 -4.218 1.00 0.00 O ATOM 759 NE2 GLN A 50 12.566 -1.790 -2.077 1.00 0.00 N ATOM 0 H GLN A 50 10.041 1.954 -4.548 1.00 0.00 H new ATOM 0 HA GLN A 50 11.130 0.086 -6.579 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.085 0.197 -5.357 1.00 0.00 H new ATOM 0 HB3 GLN A 50 12.393 1.750 -4.932 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.926 0.885 -2.805 1.00 0.00 H new ATOM 0 HG3 GLN A 50 11.241 0.423 -2.949 1.00 0.00 H new ATOM 0 HE21 GLN A 50 12.259 -1.262 -1.260 1.00 0.00 H new ATOM 0 HE22 GLN A 50 12.826 -2.772 -1.981 1.00 0.00 H new ATOM 768 N GLN A 51 9.401 -0.795 -4.030 1.00 0.00 N ATOM 769 CA GLN A 51 8.773 -1.930 -3.315 1.00 0.00 C ATOM 770 C GLN A 51 7.855 -2.713 -4.255 1.00 0.00 C ATOM 771 O GLN A 51 8.164 -3.816 -4.659 1.00 0.00 O ATOM 772 CB GLN A 51 7.960 -1.360 -2.161 1.00 0.00 C ATOM 773 CG GLN A 51 8.864 -1.201 -0.948 1.00 0.00 C ATOM 774 CD GLN A 51 8.941 -2.536 -0.209 1.00 0.00 C ATOM 775 OE1 GLN A 51 9.983 -2.911 0.290 1.00 0.00 O ATOM 776 NE2 GLN A 51 7.865 -3.275 -0.119 1.00 0.00 N ATOM 0 H GLN A 51 9.013 0.120 -3.800 1.00 0.00 H new ATOM 0 HA GLN A 51 9.541 -2.610 -2.948 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.533 -0.397 -2.441 1.00 0.00 H new ATOM 0 HB3 GLN A 51 7.126 -2.022 -1.925 1.00 0.00 H new ATOM 0 HG2 GLN A 51 9.860 -0.884 -1.259 1.00 0.00 H new ATOM 0 HG3 GLN A 51 8.475 -0.426 -0.287 1.00 0.00 H new ATOM 0 HE21 GLN A 51 6.992 -2.957 -0.539 1.00 0.00 H new ATOM 0 HE22 GLN A 51 7.900 -4.169 0.371 1.00 0.00 H new ATOM 785 N CYS A 52 6.722 -2.160 -4.590 1.00 0.00 N ATOM 786 CA CYS A 52 5.773 -2.879 -5.489 1.00 0.00 C ATOM 787 C CYS A 52 6.434 -3.145 -6.844 1.00 0.00 C ATOM 788 O CYS A 52 6.034 -2.602 -7.854 1.00 0.00 O ATOM 789 CB CYS A 52 4.527 -2.019 -5.694 1.00 0.00 C ATOM 790 SG CYS A 52 5.026 -0.311 -6.024 1.00 0.00 S ATOM 0 H CYS A 52 6.411 -1.239 -4.280 1.00 0.00 H new ATOM 0 HA CYS A 52 5.497 -3.830 -5.034 1.00 0.00 H new ATOM 0 HB2 CYS A 52 3.938 -2.405 -6.526 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.893 -2.060 -4.808 1.00 0.00 H new ATOM 0 HG CYS A 52 5.636 0.172 -4.982 1.00 0.00 H new ATOM 796 N THR A 53 7.440 -3.975 -6.877 1.00 0.00 N ATOM 797 CA THR A 53 8.119 -4.269 -8.171 1.00 0.00 C ATOM 798 C THR A 53 7.317 -5.316 -8.950 1.00 0.00 C ATOM 799 O THR A 53 6.324 -5.831 -8.477 1.00 0.00 O ATOM 800 CB THR A 53 9.526 -4.806 -7.897 1.00 0.00 C ATOM 801 OG1 THR A 53 9.472 -5.753 -6.840 1.00 0.00 O ATOM 802 CG2 THR A 53 10.448 -3.651 -7.504 1.00 0.00 C ATOM 0 H THR A 53 7.821 -4.462 -6.066 1.00 0.00 H new ATOM 0 HA THR A 53 8.185 -3.354 -8.760 1.00 0.00 H new ATOM 0 HB THR A 53 9.913 -5.286 -8.796 1.00 0.00 H new ATOM 0 HG1 THR A 53 10.372 -6.099 -6.664 1.00 0.00 H new ATOM 0 HG21 THR A 53 11.449 -4.035 -7.309 1.00 0.00 H new ATOM 0 HG22 THR A 53 10.489 -2.926 -8.317 1.00 0.00 H new ATOM 0 HG23 THR A 53 10.064 -3.168 -6.606 1.00 0.00 H new ATOM 810 N ASP A 54 7.741 -5.630 -10.146 1.00 0.00 N ATOM 811 CA ASP A 54 7.007 -6.638 -10.964 1.00 0.00 C ATOM 812 C ASP A 54 6.950 -7.973 -10.220 1.00 0.00 C ATOM 813 O ASP A 54 5.924 -8.622 -10.172 1.00 0.00 O ATOM 814 CB ASP A 54 7.731 -6.831 -12.298 1.00 0.00 C ATOM 815 CG ASP A 54 6.755 -6.585 -13.450 1.00 0.00 C ATOM 816 OD1 ASP A 54 6.582 -5.435 -13.819 1.00 0.00 O ATOM 817 OD2 ASP A 54 6.197 -7.551 -13.945 1.00 0.00 O ATOM 0 H ASP A 54 8.567 -5.230 -10.592 1.00 0.00 H new ATOM 0 HA ASP A 54 5.991 -6.284 -11.142 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.574 -6.144 -12.369 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.137 -7.841 -12.361 1.00 0.00 H new ATOM 822 N ASP A 55 8.042 -8.395 -9.647 1.00 0.00 N ATOM 823 CA ASP A 55 8.043 -9.693 -8.915 1.00 0.00 C ATOM 824 C ASP A 55 7.402 -9.513 -7.537 1.00 0.00 C ATOM 825 O ASP A 55 7.815 -10.118 -6.568 1.00 0.00 O ATOM 826 CB ASP A 55 9.483 -10.182 -8.746 1.00 0.00 C ATOM 827 CG ASP A 55 9.486 -11.691 -8.497 1.00 0.00 C ATOM 828 OD1 ASP A 55 8.410 -12.256 -8.395 1.00 0.00 O ATOM 829 OD2 ASP A 55 10.563 -12.256 -8.414 1.00 0.00 O ATOM 0 H ASP A 55 8.933 -7.899 -9.653 1.00 0.00 H new ATOM 0 HA ASP A 55 7.472 -10.426 -9.484 1.00 0.00 H new ATOM 0 HB2 ASP A 55 10.064 -9.949 -9.638 1.00 0.00 H new ATOM 0 HB3 ASP A 55 9.958 -9.665 -7.912 1.00 0.00 H new ATOM 834 N VAL A 56 6.396 -8.686 -7.439 1.00 0.00 N ATOM 835 CA VAL A 56 5.739 -8.478 -6.117 1.00 0.00 C ATOM 836 C VAL A 56 4.252 -8.174 -6.316 1.00 0.00 C ATOM 837 O VAL A 56 3.857 -7.555 -7.284 1.00 0.00 O ATOM 838 CB VAL A 56 6.408 -7.307 -5.396 1.00 0.00 C ATOM 839 CG1 VAL A 56 5.549 -6.879 -4.206 1.00 0.00 C ATOM 840 CG2 VAL A 56 7.787 -7.743 -4.895 1.00 0.00 C ATOM 0 H VAL A 56 6.003 -8.149 -8.212 1.00 0.00 H new ATOM 0 HA VAL A 56 5.841 -9.383 -5.519 1.00 0.00 H new ATOM 0 HB VAL A 56 6.515 -6.469 -6.085 1.00 0.00 H new ATOM 0 HG11 VAL A 56 6.027 -6.044 -3.693 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.565 -6.572 -4.560 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.442 -7.715 -3.515 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.267 -6.911 -4.380 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.676 -8.580 -4.206 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.402 -8.049 -5.742 1.00 0.00 H new ATOM 850 N ARG A 57 3.426 -8.612 -5.403 1.00 0.00 N ATOM 851 CA ARG A 57 1.962 -8.352 -5.529 1.00 0.00 C ATOM 852 C ARG A 57 1.401 -7.897 -4.176 1.00 0.00 C ATOM 853 O ARG A 57 1.523 -8.580 -3.181 1.00 0.00 O ATOM 854 CB ARG A 57 1.233 -9.626 -5.989 1.00 0.00 C ATOM 855 CG ARG A 57 2.129 -10.861 -5.812 1.00 0.00 C ATOM 856 CD ARG A 57 2.335 -11.150 -4.324 1.00 0.00 C ATOM 857 NE ARG A 57 3.183 -12.366 -4.171 1.00 0.00 N ATOM 858 CZ ARG A 57 3.723 -12.645 -3.015 1.00 0.00 C ATOM 859 NH1 ARG A 57 3.513 -11.863 -1.992 1.00 0.00 N ATOM 860 NH2 ARG A 57 4.471 -13.706 -2.883 1.00 0.00 N ATOM 0 H ARG A 57 3.702 -9.139 -4.575 1.00 0.00 H new ATOM 0 HA ARG A 57 1.805 -7.568 -6.270 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.315 -9.752 -5.415 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.944 -9.528 -7.035 1.00 0.00 H new ATOM 0 HG2 ARG A 57 1.674 -11.723 -6.299 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.092 -10.694 -6.295 1.00 0.00 H new ATOM 0 HD2 ARG A 57 2.811 -10.298 -3.839 1.00 0.00 H new ATOM 0 HD3 ARG A 57 1.373 -11.300 -3.834 1.00 0.00 H new ATOM 0 HE ARG A 57 3.342 -12.981 -4.969 1.00 0.00 H new ATOM 0 HH11 ARG A 57 2.927 -11.034 -2.095 1.00 0.00 H new ATOM 0 HH12 ARG A 57 3.934 -12.080 -1.089 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.634 -14.318 -3.683 1.00 0.00 H new ATOM 0 HH22 ARG A 57 4.893 -13.924 -1.980 1.00 0.00 H new ATOM 874 N LEU A 58 0.786 -6.742 -4.127 1.00 0.00 N ATOM 875 CA LEU A 58 0.227 -6.258 -2.829 1.00 0.00 C ATOM 876 C LEU A 58 -0.600 -4.982 -3.038 1.00 0.00 C ATOM 877 O LEU A 58 -0.756 -4.502 -4.141 1.00 0.00 O ATOM 878 CB LEU A 58 1.384 -5.978 -1.861 1.00 0.00 C ATOM 879 CG LEU A 58 2.386 -4.989 -2.478 1.00 0.00 C ATOM 880 CD1 LEU A 58 1.780 -3.585 -2.557 1.00 0.00 C ATOM 881 CD2 LEU A 58 3.642 -4.941 -1.604 1.00 0.00 C ATOM 0 H LEU A 58 0.648 -6.118 -4.922 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.428 -7.024 -2.413 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.993 -5.572 -0.928 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.892 -6.911 -1.615 1.00 0.00 H new ATOM 0 HG LEU A 58 2.635 -5.323 -3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.505 -2.900 -2.997 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.883 -3.610 -3.176 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.520 -3.244 -1.555 1.00 0.00 H new ATOM 0 HD21 LEU A 58 4.358 -4.241 -2.035 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.374 -4.614 -0.600 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.089 -5.934 -1.555 1.00 0.00 H new ATOM 893 N PHE A 59 -1.122 -4.427 -1.974 1.00 0.00 N ATOM 894 CA PHE A 59 -1.929 -3.175 -2.092 1.00 0.00 C ATOM 895 C PHE A 59 -1.172 -2.043 -1.397 1.00 0.00 C ATOM 896 O PHE A 59 -0.421 -2.278 -0.474 1.00 0.00 O ATOM 897 CB PHE A 59 -3.288 -3.363 -1.409 1.00 0.00 C ATOM 898 CG PHE A 59 -3.773 -4.778 -1.609 1.00 0.00 C ATOM 899 CD1 PHE A 59 -3.252 -5.815 -0.826 1.00 0.00 C ATOM 900 CD2 PHE A 59 -4.751 -5.052 -2.572 1.00 0.00 C ATOM 901 CE1 PHE A 59 -3.708 -7.126 -1.007 1.00 0.00 C ATOM 902 CE2 PHE A 59 -5.208 -6.362 -2.752 1.00 0.00 C ATOM 903 CZ PHE A 59 -4.687 -7.399 -1.969 1.00 0.00 C ATOM 0 H PHE A 59 -1.024 -4.788 -1.025 1.00 0.00 H new ATOM 0 HA PHE A 59 -2.088 -2.938 -3.144 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.203 -3.146 -0.344 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -4.012 -2.660 -1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -2.498 -5.603 -0.082 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -5.153 -4.252 -3.176 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -3.304 -7.926 -0.405 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.963 -6.573 -3.495 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.041 -8.410 -2.107 1.00 0.00 H new ATOM 913 N ALA A 60 -1.366 -0.818 -1.816 1.00 0.00 N ATOM 914 CA ALA A 60 -0.650 0.317 -1.160 1.00 0.00 C ATOM 915 C ALA A 60 -1.641 1.451 -0.884 1.00 0.00 C ATOM 916 O ALA A 60 -2.678 1.545 -1.509 1.00 0.00 O ATOM 917 CB ALA A 60 0.458 0.822 -2.085 1.00 0.00 C ATOM 0 H ALA A 60 -1.987 -0.556 -2.581 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.213 -0.021 -0.221 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.981 1.650 -1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.162 0.014 -2.284 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.021 1.162 -3.024 1.00 0.00 H new ATOM 923 N PHE A 61 -1.334 2.313 0.046 1.00 0.00 N ATOM 924 CA PHE A 61 -2.261 3.438 0.362 1.00 0.00 C ATOM 925 C PHE A 61 -1.443 4.638 0.844 1.00 0.00 C ATOM 926 O PHE A 61 -1.025 4.694 1.981 1.00 0.00 O ATOM 927 CB PHE A 61 -3.226 2.978 1.456 1.00 0.00 C ATOM 928 CG PHE A 61 -3.962 4.151 2.055 1.00 0.00 C ATOM 929 CD1 PHE A 61 -5.154 4.598 1.477 1.00 0.00 C ATOM 930 CD2 PHE A 61 -3.461 4.778 3.203 1.00 0.00 C ATOM 931 CE1 PHE A 61 -5.845 5.673 2.045 1.00 0.00 C ATOM 932 CE2 PHE A 61 -4.154 5.851 3.772 1.00 0.00 C ATOM 933 CZ PHE A 61 -5.345 6.299 3.195 1.00 0.00 C ATOM 0 H PHE A 61 -0.479 2.287 0.602 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.828 3.730 -0.522 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.942 2.269 1.040 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.674 2.454 2.236 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.541 4.114 0.593 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.540 4.433 3.649 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.764 6.021 1.597 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.768 6.334 4.658 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.880 7.127 3.635 1.00 0.00 H new ATOM 943 N VAL A 62 -1.204 5.594 -0.013 1.00 0.00 N ATOM 944 CA VAL A 62 -0.404 6.788 0.393 1.00 0.00 C ATOM 945 C VAL A 62 -1.256 8.044 0.225 1.00 0.00 C ATOM 946 O VAL A 62 -2.158 8.089 -0.589 1.00 0.00 O ATOM 947 CB VAL A 62 0.857 6.871 -0.487 1.00 0.00 C ATOM 948 CG1 VAL A 62 0.741 5.868 -1.631 1.00 0.00 C ATOM 949 CG2 VAL A 62 1.022 8.276 -1.058 1.00 0.00 C ATOM 0 H VAL A 62 -1.529 5.600 -0.980 1.00 0.00 H new ATOM 0 HA VAL A 62 -0.103 6.704 1.437 1.00 0.00 H new ATOM 0 HB VAL A 62 1.728 6.639 0.125 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.632 5.924 -2.256 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.646 4.861 -1.224 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -0.138 6.101 -2.231 1.00 0.00 H new ATOM 0 HG21 VAL A 62 1.918 8.314 -1.677 1.00 0.00 H new ATOM 0 HG22 VAL A 62 0.152 8.527 -1.664 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.114 8.992 -0.241 1.00 0.00 H new ATOM 959 N ARG A 63 -0.975 9.065 0.982 1.00 0.00 N ATOM 960 CA ARG A 63 -1.766 10.320 0.861 1.00 0.00 C ATOM 961 C ARG A 63 -1.124 11.223 -0.192 1.00 0.00 C ATOM 962 O ARG A 63 0.050 11.529 -0.130 1.00 0.00 O ATOM 963 CB ARG A 63 -1.784 11.041 2.212 1.00 0.00 C ATOM 964 CG ARG A 63 -1.836 12.553 1.989 1.00 0.00 C ATOM 965 CD ARG A 63 -2.255 13.246 3.286 1.00 0.00 C ATOM 966 NE ARG A 63 -2.121 14.722 3.128 1.00 0.00 N ATOM 967 CZ ARG A 63 -2.692 15.524 3.983 1.00 0.00 C ATOM 968 NH1 ARG A 63 -3.378 15.036 4.980 1.00 0.00 N ATOM 969 NH2 ARG A 63 -2.575 16.817 3.843 1.00 0.00 N ATOM 0 H ARG A 63 -0.231 9.086 1.680 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.787 10.083 0.563 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -2.647 10.720 2.795 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.896 10.779 2.787 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -0.860 12.918 1.668 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.542 12.790 1.193 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -3.285 12.988 3.532 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -1.634 12.900 4.112 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.583 15.105 2.351 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.468 14.026 5.091 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.824 15.664 5.648 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.037 17.199 3.065 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.021 17.445 4.512 1.00 0.00 H new ATOM 983 N PHE A 64 -1.888 11.648 -1.160 1.00 0.00 N ATOM 984 CA PHE A 64 -1.334 12.530 -2.225 1.00 0.00 C ATOM 985 C PHE A 64 -1.870 13.950 -2.041 1.00 0.00 C ATOM 986 O PHE A 64 -2.897 14.161 -1.429 1.00 0.00 O ATOM 987 CB PHE A 64 -1.750 12.002 -3.597 1.00 0.00 C ATOM 988 CG PHE A 64 -0.896 10.811 -3.960 1.00 0.00 C ATOM 989 CD1 PHE A 64 0.410 11.003 -4.427 1.00 0.00 C ATOM 990 CD2 PHE A 64 -1.409 9.516 -3.829 1.00 0.00 C ATOM 991 CE1 PHE A 64 1.203 9.900 -4.763 1.00 0.00 C ATOM 992 CE2 PHE A 64 -0.616 8.411 -4.166 1.00 0.00 C ATOM 993 CZ PHE A 64 0.690 8.604 -4.633 1.00 0.00 C ATOM 0 H PHE A 64 -2.877 11.421 -1.259 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.246 12.540 -2.156 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.802 11.718 -3.585 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.640 12.784 -4.348 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.806 12.003 -4.528 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.416 9.368 -3.468 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.211 10.049 -5.123 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.012 7.411 -4.066 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.302 7.753 -4.893 1.00 0.00 H new ATOM 1003 N THR A 65 -1.184 14.924 -2.566 1.00 0.00 N ATOM 1004 CA THR A 65 -1.659 16.329 -2.422 1.00 0.00 C ATOM 1005 C THR A 65 -2.538 16.687 -3.623 1.00 0.00 C ATOM 1006 O THR A 65 -2.320 16.224 -4.723 1.00 0.00 O ATOM 1007 CB THR A 65 -0.454 17.272 -2.371 1.00 0.00 C ATOM 1008 OG1 THR A 65 0.356 16.942 -1.253 1.00 0.00 O ATOM 1009 CG2 THR A 65 -0.940 18.717 -2.243 1.00 0.00 C ATOM 0 H THR A 65 -0.315 14.810 -3.088 1.00 0.00 H new ATOM 0 HA THR A 65 -2.236 16.430 -1.502 1.00 0.00 H new ATOM 0 HB THR A 65 0.129 17.167 -3.286 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.129 17.544 -1.220 1.00 0.00 H new ATOM 0 HG21 THR A 65 -0.082 19.388 -2.207 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.562 18.969 -3.102 1.00 0.00 H new ATOM 0 HG23 THR A 65 -1.524 18.825 -1.329 1.00 0.00 H new ATOM 1017 N THR A 66 -3.532 17.511 -3.415 1.00 0.00 N ATOM 1018 CA THR A 66 -4.430 17.903 -4.540 1.00 0.00 C ATOM 1019 C THR A 66 -4.183 19.370 -4.901 1.00 0.00 C ATOM 1020 O THR A 66 -4.949 20.244 -4.547 1.00 0.00 O ATOM 1021 CB THR A 66 -5.890 17.724 -4.114 1.00 0.00 C ATOM 1022 OG1 THR A 66 -6.691 18.709 -4.753 1.00 0.00 O ATOM 1023 CG2 THR A 66 -6.004 17.876 -2.597 1.00 0.00 C ATOM 0 H THR A 66 -3.760 17.929 -2.513 1.00 0.00 H new ATOM 0 HA THR A 66 -4.223 17.274 -5.406 1.00 0.00 H new ATOM 0 HB THR A 66 -6.234 16.731 -4.403 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.456 19.596 -4.408 1.00 0.00 H new ATOM 0 HG21 THR A 66 -7.044 17.748 -2.296 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.389 17.120 -2.108 1.00 0.00 H new ATOM 0 HG23 THR A 66 -5.661 18.868 -2.304 1.00 0.00 H new ATOM 1031 N GLY A 67 -3.118 19.648 -5.602 1.00 0.00 N ATOM 1032 CA GLY A 67 -2.824 21.057 -5.985 1.00 0.00 C ATOM 1033 C GLY A 67 -1.966 21.713 -4.902 1.00 0.00 C ATOM 1034 O GLY A 67 -2.274 21.648 -3.729 1.00 0.00 O ATOM 0 H GLY A 67 -2.439 18.960 -5.926 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.303 21.083 -6.942 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.754 21.612 -6.113 1.00 0.00 H new ATOM 1038 N ASP A 68 -0.890 22.344 -5.286 1.00 0.00 N ATOM 1039 CA ASP A 68 -0.013 23.004 -4.277 1.00 0.00 C ATOM 1040 C ASP A 68 -0.628 24.342 -3.864 1.00 0.00 C ATOM 1041 O ASP A 68 -0.384 25.363 -4.475 1.00 0.00 O ATOM 1042 CB ASP A 68 1.371 23.243 -4.883 1.00 0.00 C ATOM 1043 CG ASP A 68 1.688 22.134 -5.888 1.00 0.00 C ATOM 1044 OD1 ASP A 68 0.850 21.265 -6.065 1.00 0.00 O ATOM 1045 OD2 ASP A 68 2.762 22.173 -6.465 1.00 0.00 O ATOM 0 H ASP A 68 -0.580 22.431 -6.254 1.00 0.00 H new ATOM 0 HA ASP A 68 0.080 22.362 -3.401 1.00 0.00 H new ATOM 0 HB2 ASP A 68 1.401 24.214 -5.376 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.125 23.262 -4.097 1.00 0.00 H new ATOM 1050 N ALA A 69 -1.425 24.346 -2.830 1.00 0.00 N ATOM 1051 CA ALA A 69 -2.053 25.620 -2.379 1.00 0.00 C ATOM 1052 C ALA A 69 -3.205 25.309 -1.422 1.00 0.00 C ATOM 1053 O ALA A 69 -4.041 24.471 -1.692 1.00 0.00 O ATOM 1054 CB ALA A 69 -2.590 26.381 -3.593 1.00 0.00 C ATOM 0 H ALA A 69 -1.668 23.523 -2.279 1.00 0.00 H new ATOM 0 HA ALA A 69 -1.310 26.231 -1.867 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -3.050 27.313 -3.264 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.770 26.602 -4.276 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.334 25.771 -4.105 1.00 0.00 H new ATOM 1060 N MET A 70 -3.255 25.979 -0.302 1.00 0.00 N ATOM 1061 CA MET A 70 -4.353 25.723 0.671 1.00 0.00 C ATOM 1062 C MET A 70 -4.388 24.233 1.020 1.00 0.00 C ATOM 1063 O MET A 70 -3.852 23.808 2.023 1.00 0.00 O ATOM 1064 CB MET A 70 -5.691 26.133 0.052 1.00 0.00 C ATOM 1065 CG MET A 70 -6.809 25.939 1.077 1.00 0.00 C ATOM 1066 SD MET A 70 -6.505 27.000 2.512 1.00 0.00 S ATOM 1067 CE MET A 70 -5.551 25.806 3.480 1.00 0.00 C ATOM 0 H MET A 70 -2.583 26.692 -0.020 1.00 0.00 H new ATOM 0 HA MET A 70 -4.179 26.305 1.576 1.00 0.00 H new ATOM 0 HB2 MET A 70 -5.652 27.175 -0.267 1.00 0.00 H new ATOM 0 HB3 MET A 70 -5.891 25.535 -0.837 1.00 0.00 H new ATOM 0 HG2 MET A 70 -7.773 26.182 0.630 1.00 0.00 H new ATOM 0 HG3 MET A 70 -6.855 24.895 1.387 1.00 0.00 H new ATOM 0 HE1 MET A 70 -5.757 25.950 4.541 1.00 0.00 H new ATOM 0 HE2 MET A 70 -5.833 24.794 3.190 1.00 0.00 H new ATOM 0 HE3 MET A 70 -4.487 25.953 3.293 1.00 0.00 H new ATOM 1077 N SER A 71 -5.016 23.437 0.199 1.00 0.00 N ATOM 1078 CA SER A 71 -5.085 21.976 0.484 1.00 0.00 C ATOM 1079 C SER A 71 -5.649 21.758 1.889 1.00 0.00 C ATOM 1080 O SER A 71 -4.920 21.527 2.833 1.00 0.00 O ATOM 1081 CB SER A 71 -3.682 21.374 0.400 1.00 0.00 C ATOM 1082 OG SER A 71 -2.980 21.969 -0.683 1.00 0.00 O ATOM 0 H SER A 71 -5.484 23.735 -0.657 1.00 0.00 H new ATOM 0 HA SER A 71 -5.733 21.493 -0.248 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.145 21.543 1.333 1.00 0.00 H new ATOM 0 HB3 SER A 71 -3.745 20.295 0.259 1.00 0.00 H new ATOM 0 HG SER A 71 -2.079 21.586 -0.739 1.00 0.00 H new ATOM 1088 N LYS A 72 -6.944 21.832 2.036 1.00 0.00 N ATOM 1089 CA LYS A 72 -7.554 21.629 3.380 1.00 0.00 C ATOM 1090 C LYS A 72 -7.795 20.136 3.613 1.00 0.00 C ATOM 1091 O LYS A 72 -8.092 19.710 4.711 1.00 0.00 O ATOM 1092 CB LYS A 72 -8.887 22.377 3.452 1.00 0.00 C ATOM 1093 CG LYS A 72 -9.851 21.804 2.411 1.00 0.00 C ATOM 1094 CD LYS A 72 -11.116 22.664 2.360 1.00 0.00 C ATOM 1095 CE LYS A 72 -12.160 21.981 1.474 1.00 0.00 C ATOM 1096 NZ LYS A 72 -11.610 21.806 0.101 1.00 0.00 N ATOM 0 H LYS A 72 -7.605 22.024 1.284 1.00 0.00 H new ATOM 0 HA LYS A 72 -6.879 22.011 4.146 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -9.315 22.283 4.450 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -8.730 23.440 3.271 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.374 21.781 1.431 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -10.108 20.775 2.664 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -11.513 22.806 3.365 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -10.881 23.653 1.967 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -12.431 21.013 1.894 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -13.070 22.580 1.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -12.381 21.567 -0.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -11.156 22.690 -0.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -10.907 21.039 0.104 1.00 0.00 H new ATOM 1110 N ARG A 73 -7.669 19.338 2.589 1.00 0.00 N ATOM 1111 CA ARG A 73 -7.893 17.875 2.754 1.00 0.00 C ATOM 1112 C ARG A 73 -7.210 17.118 1.612 1.00 0.00 C ATOM 1113 O ARG A 73 -7.757 16.973 0.537 1.00 0.00 O ATOM 1114 CB ARG A 73 -9.394 17.583 2.733 1.00 0.00 C ATOM 1115 CG ARG A 73 -9.811 16.949 4.061 1.00 0.00 C ATOM 1116 CD ARG A 73 -11.324 16.728 4.070 1.00 0.00 C ATOM 1117 NE ARG A 73 -11.804 16.632 5.477 1.00 0.00 N ATOM 1118 CZ ARG A 73 -13.078 16.742 5.741 1.00 0.00 C ATOM 1119 NH1 ARG A 73 -13.931 16.937 4.772 1.00 0.00 N ATOM 1120 NH2 ARG A 73 -13.499 16.658 6.973 1.00 0.00 N ATOM 0 H ARG A 73 -7.421 19.636 1.646 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.472 17.550 3.706 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.952 18.505 2.567 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -9.633 16.913 1.907 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.294 16.000 4.201 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.522 17.595 4.890 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.825 17.550 3.559 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -11.572 15.816 3.527 1.00 0.00 H new ATOM 0 HE ARG A 73 -11.137 16.480 6.234 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -13.602 17.003 3.809 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -14.926 17.023 4.978 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -12.833 16.506 7.730 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -14.494 16.744 7.179 1.00 0.00 H new ATOM 1134 N SER A 74 -6.020 16.634 1.837 1.00 0.00 N ATOM 1135 CA SER A 74 -5.304 15.885 0.766 1.00 0.00 C ATOM 1136 C SER A 74 -6.227 14.807 0.196 1.00 0.00 C ATOM 1137 O SER A 74 -7.363 14.673 0.608 1.00 0.00 O ATOM 1138 CB SER A 74 -4.057 15.225 1.357 1.00 0.00 C ATOM 1139 OG SER A 74 -3.014 15.244 0.392 1.00 0.00 O ATOM 0 H SER A 74 -5.512 16.725 2.717 1.00 0.00 H new ATOM 0 HA SER A 74 -5.013 16.572 -0.028 1.00 0.00 H new ATOM 0 HB2 SER A 74 -3.744 15.753 2.258 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.279 14.199 1.650 1.00 0.00 H new ATOM 0 HG SER A 74 -3.232 14.627 -0.338 1.00 0.00 H new ATOM 1145 N LYS A 75 -5.748 14.030 -0.741 1.00 0.00 N ATOM 1146 CA LYS A 75 -6.596 12.953 -1.328 1.00 0.00 C ATOM 1147 C LYS A 75 -6.079 11.595 -0.848 1.00 0.00 C ATOM 1148 O LYS A 75 -4.900 11.308 -0.921 1.00 0.00 O ATOM 1149 CB LYS A 75 -6.543 13.027 -2.858 1.00 0.00 C ATOM 1150 CG LYS A 75 -5.162 12.599 -3.356 1.00 0.00 C ATOM 1151 CD LYS A 75 -5.041 12.910 -4.850 1.00 0.00 C ATOM 1152 CE LYS A 75 -5.068 14.424 -5.068 1.00 0.00 C ATOM 1153 NZ LYS A 75 -4.032 14.800 -6.070 1.00 0.00 N ATOM 0 H LYS A 75 -4.805 14.096 -1.124 1.00 0.00 H new ATOM 0 HA LYS A 75 -7.630 13.081 -1.008 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.309 12.382 -3.288 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.759 14.043 -3.189 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.384 13.123 -2.800 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -5.015 11.533 -3.182 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.114 12.493 -5.244 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.859 12.440 -5.396 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -6.054 14.735 -5.414 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.883 14.941 -4.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.422 15.510 -6.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.204 15.196 -5.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.746 13.957 -6.607 1.00 0.00 H new ATOM 1167 N PHE A 76 -6.948 10.765 -0.336 1.00 0.00 N ATOM 1168 CA PHE A 76 -6.510 9.433 0.174 1.00 0.00 C ATOM 1169 C PHE A 76 -7.018 8.322 -0.758 1.00 0.00 C ATOM 1170 O PHE A 76 -8.192 8.236 -1.053 1.00 0.00 O ATOM 1171 CB PHE A 76 -7.084 9.240 1.576 1.00 0.00 C ATOM 1172 CG PHE A 76 -6.525 10.293 2.502 1.00 0.00 C ATOM 1173 CD1 PHE A 76 -7.180 11.523 2.636 1.00 0.00 C ATOM 1174 CD2 PHE A 76 -5.356 10.041 3.231 1.00 0.00 C ATOM 1175 CE1 PHE A 76 -6.668 12.501 3.499 1.00 0.00 C ATOM 1176 CE2 PHE A 76 -4.844 11.019 4.092 1.00 0.00 C ATOM 1177 CZ PHE A 76 -5.500 12.248 4.226 1.00 0.00 C ATOM 0 H PHE A 76 -7.947 10.953 -0.249 1.00 0.00 H new ATOM 0 HA PHE A 76 -5.422 9.386 0.207 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.172 9.307 1.547 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -6.836 8.246 1.948 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -8.081 11.718 2.074 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -4.850 9.093 3.129 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -7.175 13.449 3.603 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.942 10.825 4.653 1.00 0.00 H new ATOM 0 HZ PHE A 76 -5.104 13.001 4.891 1.00 0.00 H new ATOM 1187 N ALA A 77 -6.132 7.489 -1.247 1.00 0.00 N ATOM 1188 CA ALA A 77 -6.565 6.411 -2.184 1.00 0.00 C ATOM 1189 C ALA A 77 -5.747 5.136 -1.966 1.00 0.00 C ATOM 1190 O ALA A 77 -4.729 5.136 -1.301 1.00 0.00 O ATOM 1191 CB ALA A 77 -6.371 6.891 -3.624 1.00 0.00 C ATOM 0 H ALA A 77 -5.134 7.510 -1.038 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.615 6.187 -1.996 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.685 6.108 -4.314 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.970 7.786 -3.793 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.319 7.122 -3.792 1.00 0.00 H new ATOM 1197 N LEU A 78 -6.191 4.050 -2.541 1.00 0.00 N ATOM 1198 CA LEU A 78 -5.460 2.757 -2.403 1.00 0.00 C ATOM 1199 C LEU A 78 -5.083 2.259 -3.802 1.00 0.00 C ATOM 1200 O LEU A 78 -5.710 2.616 -4.780 1.00 0.00 O ATOM 1201 CB LEU A 78 -6.377 1.735 -1.721 1.00 0.00 C ATOM 1202 CG LEU A 78 -5.718 0.353 -1.729 1.00 0.00 C ATOM 1203 CD1 LEU A 78 -5.982 -0.345 -0.394 1.00 0.00 C ATOM 1204 CD2 LEU A 78 -6.307 -0.487 -2.866 1.00 0.00 C ATOM 0 H LEU A 78 -7.039 4.004 -3.107 1.00 0.00 H new ATOM 0 HA LEU A 78 -4.560 2.891 -1.803 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.581 2.044 -0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.336 1.693 -2.238 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.644 0.464 -1.877 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -5.513 -1.329 -0.399 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -5.565 0.252 0.417 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.056 -0.456 -0.248 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -5.838 -1.471 -2.872 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -7.381 -0.598 -2.718 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -6.122 0.009 -3.819 1.00 0.00 H new ATOM 1216 N ILE A 79 -4.072 1.438 -3.916 1.00 0.00 N ATOM 1217 CA ILE A 79 -3.673 0.928 -5.260 1.00 0.00 C ATOM 1218 C ILE A 79 -3.387 -0.572 -5.158 1.00 0.00 C ATOM 1219 O ILE A 79 -2.744 -1.028 -4.234 1.00 0.00 O ATOM 1220 CB ILE A 79 -2.422 1.673 -5.736 1.00 0.00 C ATOM 1221 CG1 ILE A 79 -2.833 3.057 -6.244 1.00 0.00 C ATOM 1222 CG2 ILE A 79 -1.745 0.897 -6.871 1.00 0.00 C ATOM 1223 CD1 ILE A 79 -1.585 3.874 -6.576 1.00 0.00 C ATOM 0 H ILE A 79 -3.506 1.099 -3.138 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.477 1.094 -5.977 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.721 1.769 -4.907 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.461 2.958 -7.129 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.426 3.571 -5.488 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -0.857 1.436 -7.201 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.457 -0.092 -6.514 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.438 0.794 -7.706 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.880 4.859 -6.937 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -0.974 3.985 -5.680 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.010 3.362 -7.347 1.00 0.00 H new ATOM 1235 N THR A 80 -3.864 -1.346 -6.094 1.00 0.00 N ATOM 1236 CA THR A 80 -3.620 -2.816 -6.040 1.00 0.00 C ATOM 1237 C THR A 80 -2.407 -3.170 -6.904 1.00 0.00 C ATOM 1238 O THR A 80 -2.373 -2.883 -8.084 1.00 0.00 O ATOM 1239 CB THR A 80 -4.853 -3.554 -6.567 1.00 0.00 C ATOM 1240 OG1 THR A 80 -6.025 -2.948 -6.040 1.00 0.00 O ATOM 1241 CG2 THR A 80 -4.796 -5.021 -6.135 1.00 0.00 C ATOM 0 H THR A 80 -4.411 -1.025 -6.893 1.00 0.00 H new ATOM 0 HA THR A 80 -3.427 -3.113 -5.009 1.00 0.00 H new ATOM 0 HB THR A 80 -4.873 -3.500 -7.655 1.00 0.00 H new ATOM 0 HG1 THR A 80 -6.816 -3.418 -6.377 1.00 0.00 H new ATOM 0 HG21 THR A 80 -5.675 -5.545 -6.511 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.896 -5.485 -6.539 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.777 -5.079 -5.047 1.00 0.00 H new ATOM 1249 N TRP A 81 -1.411 -3.790 -6.329 1.00 0.00 N ATOM 1250 CA TRP A 81 -0.208 -4.156 -7.129 1.00 0.00 C ATOM 1251 C TRP A 81 -0.267 -5.635 -7.505 1.00 0.00 C ATOM 1252 O TRP A 81 -0.143 -6.500 -6.661 1.00 0.00 O ATOM 1253 CB TRP A 81 1.062 -3.912 -6.307 1.00 0.00 C ATOM 1254 CG TRP A 81 2.264 -4.187 -7.154 1.00 0.00 C ATOM 1255 CD1 TRP A 81 3.199 -5.122 -6.873 1.00 0.00 C ATOM 1256 CD2 TRP A 81 2.681 -3.555 -8.403 1.00 0.00 C ATOM 1257 NE1 TRP A 81 4.157 -5.113 -7.867 1.00 0.00 N ATOM 1258 CE2 TRP A 81 3.885 -4.165 -8.832 1.00 0.00 C ATOM 1259 CE3 TRP A 81 2.141 -2.526 -9.200 1.00 0.00 C ATOM 1260 CZ2 TRP A 81 4.528 -3.773 -10.005 1.00 0.00 C ATOM 1261 CZ3 TRP A 81 2.789 -2.129 -10.382 1.00 0.00 C ATOM 1262 CH2 TRP A 81 3.979 -2.751 -10.783 1.00 0.00 C ATOM 0 H TRP A 81 -1.379 -4.057 -5.345 1.00 0.00 H new ATOM 0 HA TRP A 81 -0.189 -3.542 -8.030 1.00 0.00 H new ATOM 0 HB2 TRP A 81 1.084 -2.883 -5.949 1.00 0.00 H new ATOM 0 HB3 TRP A 81 1.068 -4.556 -5.428 1.00 0.00 H new ATOM 0 HD1 TRP A 81 3.197 -5.771 -6.010 1.00 0.00 H new ATOM 0 HE1 TRP A 81 4.967 -5.732 -7.886 1.00 0.00 H new ATOM 0 HE3 TRP A 81 1.224 -2.040 -8.901 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 5.444 -4.256 -10.310 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 2.367 -1.339 -10.986 1.00 0.00 H new ATOM 0 HH2 TRP A 81 4.471 -2.440 -11.693 1.00 0.00 H new ATOM 1273 N ILE A 82 -0.439 -5.934 -8.763 1.00 0.00 N ATOM 1274 CA ILE A 82 -0.482 -7.361 -9.193 1.00 0.00 C ATOM 1275 C ILE A 82 0.777 -7.661 -10.008 1.00 0.00 C ATOM 1276 O ILE A 82 0.819 -7.452 -11.204 1.00 0.00 O ATOM 1277 CB ILE A 82 -1.722 -7.606 -10.054 1.00 0.00 C ATOM 1278 CG1 ILE A 82 -2.955 -7.029 -9.354 1.00 0.00 C ATOM 1279 CG2 ILE A 82 -1.908 -9.111 -10.256 1.00 0.00 C ATOM 1280 CD1 ILE A 82 -3.037 -7.567 -7.923 1.00 0.00 C ATOM 0 H ILE A 82 -0.552 -5.252 -9.513 1.00 0.00 H new ATOM 0 HA ILE A 82 -0.527 -8.011 -8.319 1.00 0.00 H new ATOM 0 HB ILE A 82 -1.595 -7.120 -11.021 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -2.901 -5.940 -9.341 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -3.856 -7.297 -9.905 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.791 -9.289 -10.869 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.031 -9.522 -10.755 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -2.035 -9.595 -9.288 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.916 -7.154 -7.429 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -3.112 -8.654 -7.947 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -2.142 -7.277 -7.373 1.00 0.00 H new ATOM 1292 N GLY A 83 1.807 -8.142 -9.368 1.00 0.00 N ATOM 1293 CA GLY A 83 3.067 -8.445 -10.101 1.00 0.00 C ATOM 1294 C GLY A 83 2.773 -9.391 -11.265 1.00 0.00 C ATOM 1295 O GLY A 83 1.806 -10.127 -11.254 1.00 0.00 O ATOM 0 H GLY A 83 1.830 -8.338 -8.367 1.00 0.00 H new ATOM 0 HA2 GLY A 83 3.513 -7.523 -10.473 1.00 0.00 H new ATOM 0 HA3 GLY A 83 3.792 -8.899 -9.425 1.00 0.00 H new ATOM 1299 N GLU A 84 3.600 -9.376 -12.275 1.00 0.00 N ATOM 1300 CA GLU A 84 3.369 -10.273 -13.442 1.00 0.00 C ATOM 1301 C GLU A 84 4.113 -11.594 -13.230 1.00 0.00 C ATOM 1302 O GLU A 84 3.835 -12.584 -13.878 1.00 0.00 O ATOM 1303 CB GLU A 84 3.884 -9.597 -14.714 1.00 0.00 C ATOM 1304 CG GLU A 84 3.434 -10.397 -15.937 1.00 0.00 C ATOM 1305 CD GLU A 84 2.476 -9.552 -16.777 1.00 0.00 C ATOM 1306 OE1 GLU A 84 1.303 -9.511 -16.443 1.00 0.00 O ATOM 1307 OE2 GLU A 84 2.931 -8.958 -17.742 1.00 0.00 O ATOM 0 H GLU A 84 4.426 -8.781 -12.342 1.00 0.00 H new ATOM 0 HA GLU A 84 2.302 -10.471 -13.541 1.00 0.00 H new ATOM 0 HB2 GLU A 84 3.505 -8.577 -14.775 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.972 -9.532 -14.689 1.00 0.00 H new ATOM 0 HG2 GLU A 84 4.299 -10.686 -16.534 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.942 -11.317 -15.622 1.00 0.00 H new ATOM 1314 N ASP A 85 5.059 -11.619 -12.329 1.00 0.00 N ATOM 1315 CA ASP A 85 5.819 -12.876 -12.080 1.00 0.00 C ATOM 1316 C ASP A 85 5.316 -13.532 -10.791 1.00 0.00 C ATOM 1317 O ASP A 85 6.088 -14.052 -10.009 1.00 0.00 O ATOM 1318 CB ASP A 85 7.308 -12.552 -11.941 1.00 0.00 C ATOM 1319 CG ASP A 85 7.946 -12.474 -13.330 1.00 0.00 C ATOM 1320 OD1 ASP A 85 7.609 -11.560 -14.063 1.00 0.00 O ATOM 1321 OD2 ASP A 85 8.759 -13.330 -13.635 1.00 0.00 O ATOM 0 H ASP A 85 5.337 -10.823 -11.755 1.00 0.00 H new ATOM 0 HA ASP A 85 5.672 -13.560 -12.916 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.438 -11.606 -11.416 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.803 -13.318 -11.344 1.00 0.00 H new ATOM 1326 N VAL A 86 4.031 -13.508 -10.562 1.00 0.00 N ATOM 1327 CA VAL A 86 3.481 -14.127 -9.320 1.00 0.00 C ATOM 1328 C VAL A 86 2.776 -15.439 -9.671 1.00 0.00 C ATOM 1329 O VAL A 86 2.359 -15.652 -10.792 1.00 0.00 O ATOM 1330 CB VAL A 86 2.485 -13.165 -8.667 1.00 0.00 C ATOM 1331 CG1 VAL A 86 2.981 -11.724 -8.818 1.00 0.00 C ATOM 1332 CG2 VAL A 86 1.120 -13.302 -9.343 1.00 0.00 C ATOM 0 H VAL A 86 3.338 -13.087 -11.180 1.00 0.00 H new ATOM 0 HA VAL A 86 4.295 -14.330 -8.624 1.00 0.00 H new ATOM 0 HB VAL A 86 2.395 -13.409 -7.608 1.00 0.00 H new ATOM 0 HG11 VAL A 86 2.269 -11.043 -8.352 1.00 0.00 H new ATOM 0 HG12 VAL A 86 3.952 -11.621 -8.334 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.076 -11.481 -9.876 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.413 -12.616 -8.877 1.00 0.00 H new ATOM 0 HG22 VAL A 86 1.213 -13.062 -10.402 1.00 0.00 H new ATOM 0 HG23 VAL A 86 0.760 -14.325 -9.233 1.00 0.00 H new ATOM 1342 N SER A 87 2.642 -16.324 -8.719 1.00 0.00 N ATOM 1343 CA SER A 87 1.969 -17.625 -8.995 1.00 0.00 C ATOM 1344 C SER A 87 0.452 -17.425 -9.025 1.00 0.00 C ATOM 1345 O SER A 87 -0.039 -16.317 -8.936 1.00 0.00 O ATOM 1346 CB SER A 87 2.329 -18.628 -7.899 1.00 0.00 C ATOM 1347 OG SER A 87 2.792 -19.831 -8.497 1.00 0.00 O ATOM 0 H SER A 87 2.970 -16.201 -7.761 1.00 0.00 H new ATOM 0 HA SER A 87 2.302 -18.005 -9.961 1.00 0.00 H new ATOM 0 HB2 SER A 87 3.098 -18.212 -7.248 1.00 0.00 H new ATOM 0 HB3 SER A 87 1.459 -18.830 -7.275 1.00 0.00 H new ATOM 0 HG SER A 87 3.025 -20.476 -7.797 1.00 0.00 H new ATOM 1353 N GLY A 88 -0.294 -18.489 -9.151 1.00 0.00 N ATOM 1354 CA GLY A 88 -1.779 -18.360 -9.189 1.00 0.00 C ATOM 1355 C GLY A 88 -2.329 -18.298 -7.762 1.00 0.00 C ATOM 1356 O GLY A 88 -3.444 -17.872 -7.535 1.00 0.00 O ATOM 0 H GLY A 88 0.061 -19.442 -9.229 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -2.062 -17.461 -9.737 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.214 -19.207 -9.720 1.00 0.00 H new ATOM 1360 N LEU A 89 -1.559 -18.722 -6.797 1.00 0.00 N ATOM 1361 CA LEU A 89 -2.045 -18.686 -5.389 1.00 0.00 C ATOM 1362 C LEU A 89 -2.677 -17.323 -5.111 1.00 0.00 C ATOM 1363 O LEU A 89 -3.788 -17.228 -4.630 1.00 0.00 O ATOM 1364 CB LEU A 89 -0.869 -18.910 -4.435 1.00 0.00 C ATOM 1365 CG LEU A 89 -0.666 -20.411 -4.219 1.00 0.00 C ATOM 1366 CD1 LEU A 89 -0.391 -21.088 -5.562 1.00 0.00 C ATOM 1367 CD2 LEU A 89 0.524 -20.633 -3.284 1.00 0.00 C ATOM 0 H LEU A 89 -0.616 -19.091 -6.923 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.786 -19.471 -5.237 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.037 -18.465 -4.847 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -1.061 -18.417 -3.482 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.564 -20.839 -3.774 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.246 -22.157 -5.408 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.238 -20.929 -6.230 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.508 -20.661 -6.007 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.670 -21.702 -3.129 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.422 -20.205 -3.730 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.329 -20.151 -2.326 1.00 0.00 H new ATOM 1379 N GLN A 90 -1.980 -16.263 -5.418 1.00 0.00 N ATOM 1380 CA GLN A 90 -2.549 -14.906 -5.180 1.00 0.00 C ATOM 1381 C GLN A 90 -3.834 -14.759 -5.998 1.00 0.00 C ATOM 1382 O GLN A 90 -4.753 -14.069 -5.608 1.00 0.00 O ATOM 1383 CB GLN A 90 -1.537 -13.844 -5.616 1.00 0.00 C ATOM 1384 CG GLN A 90 -0.121 -14.419 -5.531 1.00 0.00 C ATOM 1385 CD GLN A 90 0.051 -15.166 -4.207 1.00 0.00 C ATOM 1386 OE1 GLN A 90 0.463 -16.309 -4.191 1.00 0.00 O ATOM 1387 NE2 GLN A 90 -0.250 -14.566 -3.089 1.00 0.00 N ATOM 0 H GLN A 90 -1.044 -16.278 -5.822 1.00 0.00 H new ATOM 0 HA GLN A 90 -2.769 -14.776 -4.120 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -1.749 -13.522 -6.636 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -1.622 -12.963 -4.979 1.00 0.00 H new ATOM 0 HG2 GLN A 90 0.059 -15.095 -6.367 1.00 0.00 H new ATOM 0 HG3 GLN A 90 0.613 -13.617 -5.606 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -0.596 -13.607 -3.102 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -0.140 -15.056 -2.201 1.00 0.00 H new ATOM 1396 N ARG A 91 -3.904 -15.396 -7.131 1.00 0.00 N ATOM 1397 CA ARG A 91 -5.128 -15.284 -7.974 1.00 0.00 C ATOM 1398 C ARG A 91 -6.376 -15.500 -7.112 1.00 0.00 C ATOM 1399 O ARG A 91 -7.168 -14.600 -6.912 1.00 0.00 O ATOM 1400 CB ARG A 91 -5.084 -16.343 -9.078 1.00 0.00 C ATOM 1401 CG ARG A 91 -6.060 -15.961 -10.191 1.00 0.00 C ATOM 1402 CD ARG A 91 -5.369 -15.013 -11.174 1.00 0.00 C ATOM 1403 NE ARG A 91 -6.385 -14.119 -11.799 1.00 0.00 N ATOM 1404 CZ ARG A 91 -6.004 -13.045 -12.434 1.00 0.00 C ATOM 1405 NH1 ARG A 91 -4.735 -12.753 -12.522 1.00 0.00 N ATOM 1406 NH2 ARG A 91 -6.893 -12.261 -12.982 1.00 0.00 N ATOM 0 H ARG A 91 -3.167 -15.990 -7.512 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.167 -14.290 -8.419 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.073 -16.424 -9.478 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -5.345 -17.320 -8.670 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.402 -16.855 -10.712 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -6.942 -15.482 -9.767 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -4.616 -14.419 -10.655 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -4.850 -15.585 -11.943 1.00 0.00 H new ATOM 0 HE ARG A 91 -7.377 -14.347 -11.730 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.040 -13.365 -12.094 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.438 -11.913 -13.019 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.885 -12.488 -12.913 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -6.595 -11.421 -13.479 1.00 0.00 H new ATOM 1420 N ALA A 92 -6.563 -16.689 -6.610 1.00 0.00 N ATOM 1421 CA ALA A 92 -7.766 -16.969 -5.775 1.00 0.00 C ATOM 1422 C ALA A 92 -7.705 -16.169 -4.468 1.00 0.00 C ATOM 1423 O ALA A 92 -8.712 -15.721 -3.960 1.00 0.00 O ATOM 1424 CB ALA A 92 -7.822 -18.463 -5.450 1.00 0.00 C ATOM 0 H ALA A 92 -5.934 -17.481 -6.742 1.00 0.00 H new ATOM 0 HA ALA A 92 -8.657 -16.675 -6.330 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.701 -18.670 -4.839 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -7.881 -19.035 -6.376 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.924 -18.750 -4.903 1.00 0.00 H new ATOM 1430 N LYS A 93 -6.536 -15.996 -3.915 1.00 0.00 N ATOM 1431 CA LYS A 93 -6.426 -15.235 -2.637 1.00 0.00 C ATOM 1432 C LYS A 93 -6.595 -13.736 -2.904 1.00 0.00 C ATOM 1433 O LYS A 93 -7.583 -13.137 -2.527 1.00 0.00 O ATOM 1434 CB LYS A 93 -5.051 -15.486 -2.012 1.00 0.00 C ATOM 1435 CG LYS A 93 -5.157 -16.614 -0.985 1.00 0.00 C ATOM 1436 CD LYS A 93 -3.764 -16.946 -0.445 1.00 0.00 C ATOM 1437 CE LYS A 93 -3.769 -18.354 0.150 1.00 0.00 C ATOM 1438 NZ LYS A 93 -4.641 -18.381 1.359 1.00 0.00 N ATOM 0 H LYS A 93 -5.655 -16.347 -4.291 1.00 0.00 H new ATOM 0 HA LYS A 93 -7.208 -15.568 -1.955 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -4.331 -15.751 -2.786 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.686 -14.577 -1.534 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.814 -16.315 -0.168 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -5.601 -17.497 -1.444 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -3.027 -16.881 -1.246 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.474 -16.220 0.315 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.130 -19.071 -0.588 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.754 -18.652 0.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -4.539 -19.297 1.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -4.361 -17.617 2.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.633 -18.248 1.075 1.00 0.00 H new ATOM 1452 N THR A 94 -5.637 -13.127 -3.544 1.00 0.00 N ATOM 1453 CA THR A 94 -5.735 -11.667 -3.829 1.00 0.00 C ATOM 1454 C THR A 94 -7.130 -11.328 -4.356 1.00 0.00 C ATOM 1455 O THR A 94 -7.515 -10.180 -4.412 1.00 0.00 O ATOM 1456 CB THR A 94 -4.692 -11.283 -4.883 1.00 0.00 C ATOM 1457 OG1 THR A 94 -3.402 -11.660 -4.427 1.00 0.00 O ATOM 1458 CG2 THR A 94 -4.733 -9.771 -5.115 1.00 0.00 C ATOM 0 H THR A 94 -4.787 -13.578 -3.883 1.00 0.00 H new ATOM 0 HA THR A 94 -5.554 -11.112 -2.908 1.00 0.00 H new ATOM 0 HB THR A 94 -4.911 -11.797 -5.819 1.00 0.00 H new ATOM 0 HG1 THR A 94 -3.133 -11.076 -3.688 1.00 0.00 H new ATOM 0 HG21 THR A 94 -3.991 -9.498 -5.865 1.00 0.00 H new ATOM 0 HG22 THR A 94 -5.725 -9.483 -5.464 1.00 0.00 H new ATOM 0 HG23 THR A 94 -4.513 -9.254 -4.181 1.00 0.00 H new ATOM 1466 N GLY A 95 -7.892 -12.309 -4.749 1.00 0.00 N ATOM 1467 CA GLY A 95 -9.254 -12.017 -5.276 1.00 0.00 C ATOM 1468 C GLY A 95 -10.225 -11.775 -4.119 1.00 0.00 C ATOM 1469 O GLY A 95 -10.767 -10.703 -3.965 1.00 0.00 O ATOM 0 H GLY A 95 -7.633 -13.295 -4.729 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -9.222 -11.141 -5.923 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -9.603 -12.851 -5.885 1.00 0.00 H new ATOM 1473 N THR A 96 -10.471 -12.771 -3.321 1.00 0.00 N ATOM 1474 CA THR A 96 -11.428 -12.602 -2.191 1.00 0.00 C ATOM 1475 C THR A 96 -10.835 -11.687 -1.115 1.00 0.00 C ATOM 1476 O THR A 96 -11.534 -10.893 -0.516 1.00 0.00 O ATOM 1477 CB THR A 96 -11.733 -13.970 -1.579 1.00 0.00 C ATOM 1478 OG1 THR A 96 -12.323 -13.793 -0.298 1.00 0.00 O ATOM 1479 CG2 THR A 96 -10.438 -14.771 -1.439 1.00 0.00 C ATOM 0 H THR A 96 -10.052 -13.697 -3.400 1.00 0.00 H new ATOM 0 HA THR A 96 -12.344 -12.149 -2.571 1.00 0.00 H new ATOM 0 HB THR A 96 -12.423 -14.511 -2.227 1.00 0.00 H new ATOM 0 HG1 THR A 96 -12.521 -14.669 0.095 1.00 0.00 H new ATOM 0 HG21 THR A 96 -10.658 -15.745 -1.003 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.986 -14.907 -2.422 1.00 0.00 H new ATOM 0 HG23 THR A 96 -9.745 -14.232 -0.793 1.00 0.00 H new ATOM 1487 N ASP A 97 -9.564 -11.802 -0.837 1.00 0.00 N ATOM 1488 CA ASP A 97 -8.955 -10.953 0.224 1.00 0.00 C ATOM 1489 C ASP A 97 -9.095 -9.473 -0.127 1.00 0.00 C ATOM 1490 O ASP A 97 -9.400 -8.658 0.719 1.00 0.00 O ATOM 1491 CB ASP A 97 -7.472 -11.296 0.365 1.00 0.00 C ATOM 1492 CG ASP A 97 -6.707 -10.054 0.825 1.00 0.00 C ATOM 1493 OD1 ASP A 97 -6.380 -9.237 -0.021 1.00 0.00 O ATOM 1494 OD2 ASP A 97 -6.461 -9.940 2.014 1.00 0.00 O ATOM 0 H ASP A 97 -8.923 -12.447 -1.299 1.00 0.00 H new ATOM 0 HA ASP A 97 -9.474 -11.146 1.163 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -7.341 -12.105 1.084 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -7.076 -11.649 -0.587 1.00 0.00 H new ATOM 1499 N LYS A 98 -8.879 -9.106 -1.359 1.00 0.00 N ATOM 1500 CA LYS A 98 -9.016 -7.670 -1.712 1.00 0.00 C ATOM 1501 C LYS A 98 -10.464 -7.241 -1.478 1.00 0.00 C ATOM 1502 O LYS A 98 -10.737 -6.116 -1.113 1.00 0.00 O ATOM 1503 CB LYS A 98 -8.635 -7.454 -3.174 1.00 0.00 C ATOM 1504 CG LYS A 98 -9.867 -7.622 -4.065 1.00 0.00 C ATOM 1505 CD LYS A 98 -9.423 -7.755 -5.522 1.00 0.00 C ATOM 1506 CE LYS A 98 -8.360 -6.699 -5.823 1.00 0.00 C ATOM 1507 NZ LYS A 98 -8.178 -6.582 -7.297 1.00 0.00 N ATOM 0 H LYS A 98 -8.618 -9.728 -2.124 1.00 0.00 H new ATOM 0 HA LYS A 98 -8.351 -7.072 -1.089 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -8.214 -6.457 -3.305 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.864 -8.167 -3.467 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -10.431 -8.504 -3.763 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -10.531 -6.765 -3.952 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.023 -8.753 -5.703 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -10.277 -7.629 -6.188 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -8.659 -5.738 -5.406 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -7.417 -6.972 -5.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -7.586 -5.754 -7.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -7.716 -7.440 -7.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -9.106 -6.470 -7.754 1.00 0.00 H new ATOM 1521 N THR A 99 -11.394 -8.135 -1.673 1.00 0.00 N ATOM 1522 CA THR A 99 -12.821 -7.779 -1.446 1.00 0.00 C ATOM 1523 C THR A 99 -13.018 -7.452 0.034 1.00 0.00 C ATOM 1524 O THR A 99 -13.939 -6.754 0.411 1.00 0.00 O ATOM 1525 CB THR A 99 -13.713 -8.962 -1.833 1.00 0.00 C ATOM 1526 OG1 THR A 99 -13.061 -9.738 -2.829 1.00 0.00 O ATOM 1527 CG2 THR A 99 -15.044 -8.443 -2.379 1.00 0.00 C ATOM 0 H THR A 99 -11.227 -9.094 -1.979 1.00 0.00 H new ATOM 0 HA THR A 99 -13.089 -6.916 -2.055 1.00 0.00 H new ATOM 0 HB THR A 99 -13.900 -9.579 -0.954 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.688 -10.399 -3.191 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.678 -9.286 -2.654 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.543 -7.848 -1.615 1.00 0.00 H new ATOM 0 HG23 THR A 99 -14.861 -7.825 -3.258 1.00 0.00 H new ATOM 1535 N LEU A 100 -12.152 -7.949 0.876 1.00 0.00 N ATOM 1536 CA LEU A 100 -12.281 -7.667 2.333 1.00 0.00 C ATOM 1537 C LEU A 100 -11.684 -6.291 2.637 1.00 0.00 C ATOM 1538 O LEU A 100 -12.323 -5.446 3.233 1.00 0.00 O ATOM 1539 CB LEU A 100 -11.528 -8.737 3.133 1.00 0.00 C ATOM 1540 CG LEU A 100 -12.476 -9.890 3.467 1.00 0.00 C ATOM 1541 CD1 LEU A 100 -11.691 -11.202 3.501 1.00 0.00 C ATOM 1542 CD2 LEU A 100 -13.116 -9.644 4.835 1.00 0.00 C ATOM 0 H LEU A 100 -11.361 -8.538 0.617 1.00 0.00 H new ATOM 0 HA LEU A 100 -13.334 -7.680 2.614 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.679 -9.106 2.557 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.127 -8.305 4.050 1.00 0.00 H new ATOM 0 HG LEU A 100 -13.255 -9.952 2.707 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -12.366 -12.024 3.739 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -11.234 -11.378 2.527 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.912 -11.140 4.261 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -13.792 -10.465 5.074 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -12.337 -9.582 5.595 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -13.676 -8.709 4.812 1.00 0.00 H new ATOM 1554 N VAL A 101 -10.460 -6.060 2.244 1.00 0.00 N ATOM 1555 CA VAL A 101 -9.825 -4.742 2.524 1.00 0.00 C ATOM 1556 C VAL A 101 -10.565 -3.633 1.773 1.00 0.00 C ATOM 1557 O VAL A 101 -10.421 -2.467 2.078 1.00 0.00 O ATOM 1558 CB VAL A 101 -8.366 -4.768 2.064 1.00 0.00 C ATOM 1559 CG1 VAL A 101 -8.301 -4.508 0.558 1.00 0.00 C ATOM 1560 CG2 VAL A 101 -7.583 -3.678 2.801 1.00 0.00 C ATOM 0 H VAL A 101 -9.874 -6.727 1.742 1.00 0.00 H new ATOM 0 HA VAL A 101 -9.873 -4.548 3.596 1.00 0.00 H new ATOM 0 HB VAL A 101 -7.932 -5.744 2.284 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -7.262 -4.526 0.230 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -8.862 -5.280 0.031 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -8.733 -3.532 0.338 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.543 -3.694 2.475 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -8.018 -2.704 2.578 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.630 -3.859 3.875 1.00 0.00 H new ATOM 1570 N LYS A 102 -11.348 -3.979 0.790 1.00 0.00 N ATOM 1571 CA LYS A 102 -12.081 -2.931 0.022 1.00 0.00 C ATOM 1572 C LYS A 102 -13.362 -2.526 0.758 1.00 0.00 C ATOM 1573 O LYS A 102 -13.717 -1.366 0.804 1.00 0.00 O ATOM 1574 CB LYS A 102 -12.442 -3.477 -1.361 1.00 0.00 C ATOM 1575 CG LYS A 102 -12.681 -2.311 -2.322 1.00 0.00 C ATOM 1576 CD LYS A 102 -13.853 -2.644 -3.248 1.00 0.00 C ATOM 1577 CE LYS A 102 -13.980 -1.561 -4.321 1.00 0.00 C ATOM 1578 NZ LYS A 102 -14.807 -2.075 -5.449 1.00 0.00 N ATOM 0 H LYS A 102 -11.513 -4.938 0.485 1.00 0.00 H new ATOM 0 HA LYS A 102 -11.441 -2.055 -0.079 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.638 -4.111 -1.735 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -13.335 -4.099 -1.297 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -12.894 -1.401 -1.761 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -11.783 -2.120 -2.909 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -13.696 -3.617 -3.715 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -14.777 -2.711 -2.673 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -14.438 -0.667 -3.898 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -12.992 -1.273 -4.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -14.894 -1.339 -6.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -14.352 -2.916 -5.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -15.753 -2.328 -5.099 1.00 0.00 H new ATOM 1592 N GLU A 103 -14.073 -3.467 1.316 1.00 0.00 N ATOM 1593 CA GLU A 103 -15.339 -3.121 2.023 1.00 0.00 C ATOM 1594 C GLU A 103 -15.039 -2.537 3.406 1.00 0.00 C ATOM 1595 O GLU A 103 -15.847 -1.830 3.976 1.00 0.00 O ATOM 1596 CB GLU A 103 -16.191 -4.382 2.181 1.00 0.00 C ATOM 1597 CG GLU A 103 -17.671 -4.019 2.049 1.00 0.00 C ATOM 1598 CD GLU A 103 -18.022 -2.929 3.064 1.00 0.00 C ATOM 1599 OE1 GLU A 103 -18.303 -3.274 4.200 1.00 0.00 O ATOM 1600 OE2 GLU A 103 -18.005 -1.770 2.689 1.00 0.00 O ATOM 0 H GLU A 103 -13.833 -4.458 1.313 1.00 0.00 H new ATOM 0 HA GLU A 103 -15.877 -2.377 1.436 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -15.917 -5.116 1.423 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -16.004 -4.841 3.152 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -17.882 -3.671 1.038 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -18.289 -4.901 2.218 1.00 0.00 H new ATOM 1607 N VAL A 104 -13.895 -2.830 3.961 1.00 0.00 N ATOM 1608 CA VAL A 104 -13.569 -2.292 5.313 1.00 0.00 C ATOM 1609 C VAL A 104 -12.641 -1.080 5.189 1.00 0.00 C ATOM 1610 O VAL A 104 -11.784 -0.861 6.021 1.00 0.00 O ATOM 1611 CB VAL A 104 -12.877 -3.378 6.139 1.00 0.00 C ATOM 1612 CG1 VAL A 104 -11.547 -3.749 5.483 1.00 0.00 C ATOM 1613 CG2 VAL A 104 -12.619 -2.854 7.553 1.00 0.00 C ATOM 0 H VAL A 104 -13.174 -3.416 3.539 1.00 0.00 H new ATOM 0 HA VAL A 104 -14.492 -1.985 5.805 1.00 0.00 H new ATOM 0 HB VAL A 104 -13.516 -4.260 6.188 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -11.054 -4.523 6.072 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -11.730 -4.121 4.475 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.907 -2.868 5.434 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -12.126 -3.627 8.143 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -11.980 -1.972 7.503 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -13.567 -2.589 8.022 1.00 0.00 H new ATOM 1623 N VAL A 105 -12.806 -0.289 4.162 1.00 0.00 N ATOM 1624 CA VAL A 105 -11.930 0.909 3.996 1.00 0.00 C ATOM 1625 C VAL A 105 -12.783 2.131 3.661 1.00 0.00 C ATOM 1626 O VAL A 105 -13.571 2.123 2.736 1.00 0.00 O ATOM 1627 CB VAL A 105 -10.926 0.657 2.869 1.00 0.00 C ATOM 1628 CG1 VAL A 105 -11.589 0.918 1.518 1.00 0.00 C ATOM 1629 CG2 VAL A 105 -9.732 1.598 3.035 1.00 0.00 C ATOM 0 H VAL A 105 -13.507 -0.419 3.433 1.00 0.00 H new ATOM 0 HA VAL A 105 -11.392 1.093 4.926 1.00 0.00 H new ATOM 0 HB VAL A 105 -10.589 -0.379 2.912 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -10.870 0.737 0.719 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -12.442 0.251 1.396 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -11.929 1.953 1.473 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -9.015 1.421 2.233 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -10.075 2.632 2.993 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -9.254 1.413 3.997 1.00 0.00 H new ATOM 1639 N GLN A 106 -12.626 3.185 4.411 1.00 0.00 N ATOM 1640 CA GLN A 106 -13.416 4.418 4.150 1.00 0.00 C ATOM 1641 C GLN A 106 -12.487 5.630 4.207 1.00 0.00 C ATOM 1642 O GLN A 106 -12.676 6.605 3.506 1.00 0.00 O ATOM 1643 CB GLN A 106 -14.508 4.561 5.212 1.00 0.00 C ATOM 1644 CG GLN A 106 -15.517 3.420 5.066 1.00 0.00 C ATOM 1645 CD GLN A 106 -16.329 3.287 6.355 1.00 0.00 C ATOM 1646 OE1 GLN A 106 -16.871 4.257 6.848 1.00 0.00 O ATOM 1647 NE2 GLN A 106 -16.437 2.120 6.926 1.00 0.00 N ATOM 0 H GLN A 106 -11.980 3.245 5.198 1.00 0.00 H new ATOM 0 HA GLN A 106 -13.878 4.355 3.165 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -14.066 4.544 6.208 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -15.012 5.522 5.104 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -16.181 3.614 4.224 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -14.997 2.486 4.853 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -15.982 1.306 6.513 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -16.976 2.021 7.786 1.00 0.00 H new ATOM 1656 N ASN A 107 -11.484 5.580 5.040 1.00 0.00 N ATOM 1657 CA ASN A 107 -10.550 6.737 5.138 1.00 0.00 C ATOM 1658 C ASN A 107 -10.103 7.135 3.731 1.00 0.00 C ATOM 1659 O ASN A 107 -9.855 8.291 3.450 1.00 0.00 O ATOM 1660 CB ASN A 107 -9.330 6.359 5.982 1.00 0.00 C ATOM 1661 CG ASN A 107 -9.004 7.506 6.944 1.00 0.00 C ATOM 1662 OD1 ASN A 107 -9.153 8.661 6.599 1.00 0.00 O ATOM 1663 ND2 ASN A 107 -8.564 7.237 8.144 1.00 0.00 N ATOM 0 H ASN A 107 -11.272 4.793 5.653 1.00 0.00 H new ATOM 0 HA ASN A 107 -11.058 7.575 5.615 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.530 5.445 6.542 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.475 6.157 5.336 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -8.346 7.996 8.789 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -8.438 6.268 8.436 1.00 0.00 H new ATOM 1670 N PHE A 108 -10.004 6.185 2.841 1.00 0.00 N ATOM 1671 CA PHE A 108 -9.579 6.506 1.449 1.00 0.00 C ATOM 1672 C PHE A 108 -10.724 7.188 0.701 1.00 0.00 C ATOM 1673 O PHE A 108 -11.872 7.107 1.091 1.00 0.00 O ATOM 1674 CB PHE A 108 -9.199 5.222 0.711 1.00 0.00 C ATOM 1675 CG PHE A 108 -10.439 4.605 0.100 1.00 0.00 C ATOM 1676 CD1 PHE A 108 -11.632 4.540 0.834 1.00 0.00 C ATOM 1677 CD2 PHE A 108 -10.399 4.104 -1.207 1.00 0.00 C ATOM 1678 CE1 PHE A 108 -12.779 3.977 0.262 1.00 0.00 C ATOM 1679 CE2 PHE A 108 -11.546 3.540 -1.778 1.00 0.00 C ATOM 1680 CZ PHE A 108 -12.736 3.477 -1.043 1.00 0.00 C ATOM 0 H PHE A 108 -10.199 5.200 3.018 1.00 0.00 H new ATOM 0 HA PHE A 108 -8.718 7.173 1.491 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -8.467 5.440 -0.067 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.732 4.519 1.400 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -11.666 4.925 1.842 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -9.482 4.153 -1.775 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -13.697 3.929 0.829 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -11.513 3.153 -2.786 1.00 0.00 H new ATOM 0 HZ PHE A 108 -13.621 3.042 -1.484 1.00 0.00 H new ATOM 1690 N ALA A 109 -10.419 7.848 -0.381 1.00 0.00 N ATOM 1691 CA ALA A 109 -11.484 8.525 -1.170 1.00 0.00 C ATOM 1692 C ALA A 109 -11.823 7.658 -2.383 1.00 0.00 C ATOM 1693 O ALA A 109 -12.946 7.627 -2.846 1.00 0.00 O ATOM 1694 CB ALA A 109 -10.983 9.891 -1.640 1.00 0.00 C ATOM 0 H ALA A 109 -9.475 7.948 -0.754 1.00 0.00 H new ATOM 0 HA ALA A 109 -12.372 8.664 -0.553 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -11.764 10.386 -2.218 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -10.729 10.503 -0.774 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -10.099 9.759 -2.263 1.00 0.00 H new ATOM 1700 N LYS A 110 -10.855 6.950 -2.897 1.00 0.00 N ATOM 1701 CA LYS A 110 -11.105 6.076 -4.078 1.00 0.00 C ATOM 1702 C LYS A 110 -9.970 5.058 -4.201 1.00 0.00 C ATOM 1703 O LYS A 110 -8.829 5.350 -3.901 1.00 0.00 O ATOM 1704 CB LYS A 110 -11.164 6.933 -5.343 1.00 0.00 C ATOM 1705 CG LYS A 110 -11.417 6.034 -6.557 1.00 0.00 C ATOM 1706 CD LYS A 110 -12.495 6.662 -7.442 1.00 0.00 C ATOM 1707 CE LYS A 110 -11.984 7.990 -8.004 1.00 0.00 C ATOM 1708 NZ LYS A 110 -12.944 9.077 -7.659 1.00 0.00 N ATOM 0 H LYS A 110 -9.897 6.939 -2.548 1.00 0.00 H new ATOM 0 HA LYS A 110 -12.053 5.552 -3.953 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -11.957 7.676 -5.255 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -10.229 7.479 -5.470 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -10.496 5.904 -7.125 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -11.732 5.043 -6.230 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -12.752 5.985 -8.257 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -13.405 6.825 -6.865 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -11.000 8.216 -7.594 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -11.871 7.920 -9.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -12.597 9.980 -8.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -13.875 8.862 -8.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -13.031 9.149 -6.625 1.00 0.00 H new ATOM 1722 N GLU A 111 -10.270 3.865 -4.639 1.00 0.00 N ATOM 1723 CA GLU A 111 -9.205 2.831 -4.781 1.00 0.00 C ATOM 1724 C GLU A 111 -8.861 2.660 -6.260 1.00 0.00 C ATOM 1725 O GLU A 111 -9.651 2.971 -7.129 1.00 0.00 O ATOM 1726 CB GLU A 111 -9.704 1.497 -4.218 1.00 0.00 C ATOM 1727 CG GLU A 111 -11.000 1.094 -4.925 1.00 0.00 C ATOM 1728 CD GLU A 111 -10.683 0.111 -6.053 1.00 0.00 C ATOM 1729 OE1 GLU A 111 -9.593 0.194 -6.594 1.00 0.00 O ATOM 1730 OE2 GLU A 111 -11.535 -0.706 -6.358 1.00 0.00 O ATOM 0 H GLU A 111 -11.207 3.562 -4.905 1.00 0.00 H new ATOM 0 HA GLU A 111 -8.318 3.146 -4.231 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -8.947 0.726 -4.358 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -9.875 1.585 -3.145 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.688 0.637 -4.213 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.497 1.977 -5.327 1.00 0.00 H new ATOM 1737 N PHE A 112 -7.685 2.175 -6.554 1.00 0.00 N ATOM 1738 CA PHE A 112 -7.291 1.991 -7.979 1.00 0.00 C ATOM 1739 C PHE A 112 -6.659 0.612 -8.167 1.00 0.00 C ATOM 1740 O PHE A 112 -6.131 0.028 -7.242 1.00 0.00 O ATOM 1741 CB PHE A 112 -6.280 3.072 -8.363 1.00 0.00 C ATOM 1742 CG PHE A 112 -7.018 4.315 -8.797 1.00 0.00 C ATOM 1743 CD1 PHE A 112 -7.384 4.481 -10.137 1.00 0.00 C ATOM 1744 CD2 PHE A 112 -7.338 5.300 -7.856 1.00 0.00 C ATOM 1745 CE1 PHE A 112 -8.070 5.634 -10.537 1.00 0.00 C ATOM 1746 CE2 PHE A 112 -8.024 6.452 -8.256 1.00 0.00 C ATOM 1747 CZ PHE A 112 -8.391 6.620 -9.596 1.00 0.00 C ATOM 0 H PHE A 112 -6.981 1.899 -5.869 1.00 0.00 H new ATOM 0 HA PHE A 112 -8.174 2.069 -8.614 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -5.632 3.297 -7.516 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -5.639 2.716 -9.169 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -7.137 3.720 -10.863 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -7.056 5.171 -6.822 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -8.352 5.763 -11.572 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -8.271 7.212 -7.530 1.00 0.00 H new ATOM 0 HZ PHE A 112 -8.921 7.509 -9.904 1.00 0.00 H new ATOM 1757 N VAL A 113 -6.701 0.094 -9.366 1.00 0.00 N ATOM 1758 CA VAL A 113 -6.096 -1.241 -9.634 1.00 0.00 C ATOM 1759 C VAL A 113 -4.932 -1.061 -10.607 1.00 0.00 C ATOM 1760 O VAL A 113 -5.014 -0.292 -11.544 1.00 0.00 O ATOM 1761 CB VAL A 113 -7.145 -2.164 -10.256 1.00 0.00 C ATOM 1762 CG1 VAL A 113 -6.604 -3.594 -10.306 1.00 0.00 C ATOM 1763 CG2 VAL A 113 -8.418 -2.132 -9.407 1.00 0.00 C ATOM 0 H VAL A 113 -7.131 0.542 -10.175 1.00 0.00 H new ATOM 0 HA VAL A 113 -5.740 -1.683 -8.703 1.00 0.00 H new ATOM 0 HB VAL A 113 -7.371 -1.826 -11.267 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -7.352 -4.251 -10.749 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -5.696 -3.619 -10.909 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -6.377 -3.933 -9.295 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -9.167 -2.789 -9.849 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -8.190 -2.470 -8.396 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -8.805 -1.114 -9.370 1.00 0.00 H new ATOM 1773 N ILE A 114 -3.844 -1.749 -10.392 1.00 0.00 N ATOM 1774 CA ILE A 114 -2.681 -1.590 -11.309 1.00 0.00 C ATOM 1775 C ILE A 114 -2.051 -2.951 -11.607 1.00 0.00 C ATOM 1776 O ILE A 114 -2.073 -3.855 -10.795 1.00 0.00 O ATOM 1777 CB ILE A 114 -1.649 -0.673 -10.652 1.00 0.00 C ATOM 1778 CG1 ILE A 114 -2.089 0.781 -10.839 1.00 0.00 C ATOM 1779 CG2 ILE A 114 -0.282 -0.883 -11.307 1.00 0.00 C ATOM 1780 CD1 ILE A 114 -1.175 1.706 -10.035 1.00 0.00 C ATOM 0 H ILE A 114 -3.711 -2.410 -9.626 1.00 0.00 H new ATOM 0 HA ILE A 114 -3.019 -1.152 -12.248 1.00 0.00 H new ATOM 0 HB ILE A 114 -1.574 -0.904 -9.589 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -2.054 1.048 -11.895 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -3.122 0.903 -10.514 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.451 -0.228 -10.837 1.00 0.00 H new ATOM 0 HG22 ILE A 114 0.026 -1.921 -11.182 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -0.348 -0.650 -12.370 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -1.492 2.740 -10.172 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -1.232 1.445 -8.978 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.148 1.593 -10.381 1.00 0.00 H new ATOM 1792 N SER A 115 -1.476 -3.091 -12.770 1.00 0.00 N ATOM 1793 CA SER A 115 -0.823 -4.376 -13.144 1.00 0.00 C ATOM 1794 C SER A 115 0.468 -4.064 -13.904 1.00 0.00 C ATOM 1795 O SER A 115 1.086 -4.934 -14.485 1.00 0.00 O ATOM 1796 CB SER A 115 -1.761 -5.189 -14.036 1.00 0.00 C ATOM 1797 OG SER A 115 -2.999 -4.502 -14.164 1.00 0.00 O ATOM 0 H SER A 115 -1.431 -2.363 -13.483 1.00 0.00 H new ATOM 0 HA SER A 115 -0.598 -4.954 -12.248 1.00 0.00 H new ATOM 0 HB2 SER A 115 -1.311 -5.337 -15.018 1.00 0.00 H new ATOM 0 HB3 SER A 115 -1.923 -6.178 -13.607 1.00 0.00 H new ATOM 0 HG SER A 115 -3.603 -5.020 -14.737 1.00 0.00 H new ATOM 1803 N ASP A 116 0.874 -2.822 -13.905 1.00 0.00 N ATOM 1804 CA ASP A 116 2.121 -2.441 -14.628 1.00 0.00 C ATOM 1805 C ASP A 116 2.815 -1.302 -13.878 1.00 0.00 C ATOM 1806 O ASP A 116 2.194 -0.561 -13.143 1.00 0.00 O ATOM 1807 CB ASP A 116 1.769 -1.979 -16.044 1.00 0.00 C ATOM 1808 CG ASP A 116 2.434 -2.906 -17.064 1.00 0.00 C ATOM 1809 OD1 ASP A 116 3.636 -3.093 -16.970 1.00 0.00 O ATOM 1810 OD2 ASP A 116 1.730 -3.412 -17.922 1.00 0.00 O ATOM 0 H ASP A 116 0.394 -2.054 -13.435 1.00 0.00 H new ATOM 0 HA ASP A 116 2.788 -3.301 -14.682 1.00 0.00 H new ATOM 0 HB2 ASP A 116 0.688 -1.985 -16.182 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.104 -0.953 -16.197 1.00 0.00 H new ATOM 1815 N ARG A 117 4.099 -1.159 -14.052 1.00 0.00 N ATOM 1816 CA ARG A 117 4.831 -0.070 -13.344 1.00 0.00 C ATOM 1817 C ARG A 117 4.510 1.277 -14.000 1.00 0.00 C ATOM 1818 O ARG A 117 4.476 2.301 -13.349 1.00 0.00 O ATOM 1819 CB ARG A 117 6.337 -0.331 -13.429 1.00 0.00 C ATOM 1820 CG ARG A 117 7.018 0.203 -12.167 1.00 0.00 C ATOM 1821 CD ARG A 117 8.524 0.317 -12.411 1.00 0.00 C ATOM 1822 NE ARG A 117 8.776 1.287 -13.515 1.00 0.00 N ATOM 1823 CZ ARG A 117 9.975 1.766 -13.702 1.00 0.00 C ATOM 1824 NH1 ARG A 117 10.955 1.396 -12.923 1.00 0.00 N ATOM 1825 NH2 ARG A 117 10.194 2.616 -14.668 1.00 0.00 N ATOM 0 H ARG A 117 4.674 -1.749 -14.654 1.00 0.00 H new ATOM 0 HA ARG A 117 4.522 -0.046 -12.299 1.00 0.00 H new ATOM 0 HB2 ARG A 117 6.527 -1.399 -13.533 1.00 0.00 H new ATOM 0 HB3 ARG A 117 6.752 0.154 -14.312 1.00 0.00 H new ATOM 0 HG2 ARG A 117 6.607 1.177 -11.903 1.00 0.00 H new ATOM 0 HG3 ARG A 117 6.824 -0.463 -11.326 1.00 0.00 H new ATOM 0 HD2 ARG A 117 9.027 0.646 -11.502 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.937 -0.659 -12.668 1.00 0.00 H new ATOM 0 HE ARG A 117 8.011 1.576 -14.124 1.00 0.00 H new ATOM 0 HH11 ARG A 117 10.783 0.732 -12.168 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.892 1.771 -13.070 1.00 0.00 H new ATOM 0 HH21 ARG A 117 9.428 2.905 -15.276 1.00 0.00 H new ATOM 0 HH22 ARG A 117 11.131 2.991 -14.815 1.00 0.00 H new ATOM 1839 N LYS A 118 4.283 1.285 -15.284 1.00 0.00 N ATOM 1840 CA LYS A 118 3.974 2.566 -15.979 1.00 0.00 C ATOM 1841 C LYS A 118 2.735 3.189 -15.348 1.00 0.00 C ATOM 1842 O LYS A 118 2.434 4.345 -15.553 1.00 0.00 O ATOM 1843 CB LYS A 118 3.712 2.296 -17.462 1.00 0.00 C ATOM 1844 CG LYS A 118 4.971 1.706 -18.103 1.00 0.00 C ATOM 1845 CD LYS A 118 5.794 2.828 -18.739 1.00 0.00 C ATOM 1846 CE LYS A 118 7.034 2.234 -19.409 1.00 0.00 C ATOM 1847 NZ LYS A 118 6.622 1.139 -20.332 1.00 0.00 N ATOM 0 H LYS A 118 4.298 0.459 -15.883 1.00 0.00 H new ATOM 0 HA LYS A 118 4.819 3.248 -15.883 1.00 0.00 H new ATOM 0 HB2 LYS A 118 2.876 1.606 -17.575 1.00 0.00 H new ATOM 0 HB3 LYS A 118 3.433 3.221 -17.967 1.00 0.00 H new ATOM 0 HG2 LYS A 118 5.565 1.186 -17.351 1.00 0.00 H new ATOM 0 HG3 LYS A 118 4.696 0.969 -18.858 1.00 0.00 H new ATOM 0 HD2 LYS A 118 5.192 3.364 -19.473 1.00 0.00 H new ATOM 0 HD3 LYS A 118 6.089 3.552 -17.980 1.00 0.00 H new ATOM 0 HE2 LYS A 118 7.568 3.007 -19.961 1.00 0.00 H new ATOM 0 HE3 LYS A 118 7.720 1.849 -18.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 7.372 0.976 -21.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 6.463 0.267 -19.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 5.744 1.408 -20.820 1.00 0.00 H new ATOM 1861 N GLU A 119 2.012 2.424 -14.583 1.00 0.00 N ATOM 1862 CA GLU A 119 0.790 2.960 -13.930 1.00 0.00 C ATOM 1863 C GLU A 119 1.154 3.589 -12.579 1.00 0.00 C ATOM 1864 O GLU A 119 0.322 4.160 -11.903 1.00 0.00 O ATOM 1865 CB GLU A 119 -0.197 1.815 -13.721 1.00 0.00 C ATOM 1866 CG GLU A 119 -0.105 0.840 -14.897 1.00 0.00 C ATOM 1867 CD GLU A 119 -1.419 0.066 -15.022 1.00 0.00 C ATOM 1868 OE1 GLU A 119 -1.692 -0.743 -14.150 1.00 0.00 O ATOM 1869 OE2 GLU A 119 -2.130 0.295 -15.986 1.00 0.00 O ATOM 0 H GLU A 119 2.216 1.445 -14.381 1.00 0.00 H new ATOM 0 HA GLU A 119 0.339 3.726 -14.561 1.00 0.00 H new ATOM 0 HB2 GLU A 119 0.023 1.297 -12.787 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -1.211 2.206 -13.637 1.00 0.00 H new ATOM 0 HG2 GLU A 119 0.098 1.384 -15.819 1.00 0.00 H new ATOM 0 HG3 GLU A 119 0.724 0.148 -14.746 1.00 0.00 H new ATOM 1876 N LEU A 120 2.391 3.478 -12.178 1.00 0.00 N ATOM 1877 CA LEU A 120 2.818 4.056 -10.868 1.00 0.00 C ATOM 1878 C LEU A 120 3.326 5.493 -11.054 1.00 0.00 C ATOM 1879 O LEU A 120 4.132 5.977 -10.284 1.00 0.00 O ATOM 1880 CB LEU A 120 3.946 3.198 -10.289 1.00 0.00 C ATOM 1881 CG LEU A 120 3.362 2.115 -9.382 1.00 0.00 C ATOM 1882 CD1 LEU A 120 2.376 1.256 -10.174 1.00 0.00 C ATOM 1883 CD2 LEU A 120 4.493 1.229 -8.858 1.00 0.00 C ATOM 0 H LEU A 120 3.129 3.010 -12.703 1.00 0.00 H new ATOM 0 HA LEU A 120 1.964 4.068 -10.191 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.517 2.740 -11.096 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.638 3.824 -9.725 1.00 0.00 H new ATOM 0 HG LEU A 120 2.844 2.585 -8.546 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.962 0.485 -9.524 1.00 0.00 H new ATOM 0 HD12 LEU A 120 1.569 1.884 -10.553 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.893 0.786 -11.011 1.00 0.00 H new ATOM 0 HD21 LEU A 120 4.079 0.456 -8.211 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.008 0.762 -9.697 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.199 1.837 -8.292 1.00 0.00 H new ATOM 1895 N GLU A 121 2.865 6.184 -12.059 1.00 0.00 N ATOM 1896 CA GLU A 121 3.335 7.586 -12.269 1.00 0.00 C ATOM 1897 C GLU A 121 2.409 8.559 -11.538 1.00 0.00 C ATOM 1898 O GLU A 121 1.213 8.363 -11.471 1.00 0.00 O ATOM 1899 CB GLU A 121 3.325 7.920 -13.762 1.00 0.00 C ATOM 1900 CG GLU A 121 3.106 6.647 -14.575 1.00 0.00 C ATOM 1901 CD GLU A 121 4.196 5.630 -14.233 1.00 0.00 C ATOM 1902 OE1 GLU A 121 5.331 5.852 -14.625 1.00 0.00 O ATOM 1903 OE2 GLU A 121 3.881 4.647 -13.584 1.00 0.00 O ATOM 0 H GLU A 121 2.187 5.843 -12.741 1.00 0.00 H new ATOM 0 HA GLU A 121 4.348 7.678 -11.878 1.00 0.00 H new ATOM 0 HB2 GLU A 121 2.536 8.640 -13.978 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.268 8.386 -14.046 1.00 0.00 H new ATOM 0 HG2 GLU A 121 2.123 6.229 -14.358 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.128 6.875 -15.641 1.00 0.00 H new ATOM 1910 N GLU A 122 2.952 9.611 -10.992 1.00 0.00 N ATOM 1911 CA GLU A 122 2.094 10.595 -10.276 1.00 0.00 C ATOM 1912 C GLU A 122 1.105 11.209 -11.269 1.00 0.00 C ATOM 1913 O GLU A 122 -0.089 11.217 -11.048 1.00 0.00 O ATOM 1914 CB GLU A 122 2.962 11.703 -9.670 1.00 0.00 C ATOM 1915 CG GLU A 122 4.445 11.357 -9.832 1.00 0.00 C ATOM 1916 CD GLU A 122 4.851 11.516 -11.299 1.00 0.00 C ATOM 1917 OE1 GLU A 122 3.987 11.830 -12.101 1.00 0.00 O ATOM 1918 OE2 GLU A 122 6.018 11.322 -11.595 1.00 0.00 O ATOM 0 H GLU A 122 3.948 9.831 -11.010 1.00 0.00 H new ATOM 0 HA GLU A 122 1.553 10.090 -9.476 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.747 12.653 -10.159 1.00 0.00 H new ATOM 0 HB3 GLU A 122 2.723 11.827 -8.614 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.052 12.009 -9.203 1.00 0.00 H new ATOM 0 HG3 GLU A 122 4.629 10.335 -9.502 1.00 0.00 H new ATOM 1925 N ASP A 123 1.597 11.729 -12.362 1.00 0.00 N ATOM 1926 CA ASP A 123 0.691 12.350 -13.371 1.00 0.00 C ATOM 1927 C ASP A 123 -0.310 11.311 -13.884 1.00 0.00 C ATOM 1928 O ASP A 123 -1.306 11.646 -14.496 1.00 0.00 O ATOM 1929 CB ASP A 123 1.522 12.876 -14.544 1.00 0.00 C ATOM 1930 CG ASP A 123 2.877 12.167 -14.569 1.00 0.00 C ATOM 1931 OD1 ASP A 123 2.903 10.996 -14.907 1.00 0.00 O ATOM 1932 OD2 ASP A 123 3.865 12.807 -14.248 1.00 0.00 O ATOM 0 H ASP A 123 2.589 11.750 -12.600 1.00 0.00 H new ATOM 0 HA ASP A 123 0.147 13.172 -12.906 1.00 0.00 H new ATOM 0 HB2 ASP A 123 0.994 12.707 -15.482 1.00 0.00 H new ATOM 0 HB3 ASP A 123 1.665 13.952 -14.448 1.00 0.00 H new ATOM 1937 N PHE A 124 -0.062 10.054 -13.635 1.00 0.00 N ATOM 1938 CA PHE A 124 -1.010 9.004 -14.103 1.00 0.00 C ATOM 1939 C PHE A 124 -2.112 8.844 -13.070 1.00 0.00 C ATOM 1940 O PHE A 124 -3.287 8.833 -13.378 1.00 0.00 O ATOM 1941 CB PHE A 124 -0.276 7.672 -14.239 1.00 0.00 C ATOM 1942 CG PHE A 124 -1.282 6.573 -14.481 1.00 0.00 C ATOM 1943 CD1 PHE A 124 -1.879 6.430 -15.740 1.00 0.00 C ATOM 1944 CD2 PHE A 124 -1.625 5.701 -13.442 1.00 0.00 C ATOM 1945 CE1 PHE A 124 -2.818 5.414 -15.956 1.00 0.00 C ATOM 1946 CE2 PHE A 124 -2.561 4.686 -13.658 1.00 0.00 C ATOM 1947 CZ PHE A 124 -3.158 4.542 -14.915 1.00 0.00 C ATOM 0 H PHE A 124 0.754 9.710 -13.129 1.00 0.00 H new ATOM 0 HA PHE A 124 -1.427 9.295 -15.067 1.00 0.00 H new ATOM 0 HB2 PHE A 124 0.436 7.718 -15.063 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.296 7.465 -13.335 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -1.615 7.102 -16.543 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -1.165 5.813 -12.471 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -3.280 5.303 -16.926 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -2.823 4.013 -12.855 1.00 0.00 H new ATOM 0 HZ PHE A 124 -3.881 3.758 -15.082 1.00 0.00 H new ATOM 1957 N ILE A 125 -1.724 8.726 -11.839 1.00 0.00 N ATOM 1958 CA ILE A 125 -2.727 8.572 -10.749 1.00 0.00 C ATOM 1959 C ILE A 125 -3.376 9.929 -10.481 1.00 0.00 C ATOM 1960 O ILE A 125 -4.478 10.011 -9.978 1.00 0.00 O ATOM 1961 CB ILE A 125 -2.040 8.077 -9.469 1.00 0.00 C ATOM 1962 CG1 ILE A 125 -1.075 6.925 -9.786 1.00 0.00 C ATOM 1963 CG2 ILE A 125 -3.100 7.586 -8.480 1.00 0.00 C ATOM 1964 CD1 ILE A 125 -1.857 5.615 -9.901 1.00 0.00 C ATOM 0 H ILE A 125 -0.751 8.729 -11.534 1.00 0.00 H new ATOM 0 HA ILE A 125 -3.482 7.846 -11.050 1.00 0.00 H new ATOM 0 HB ILE A 125 -1.476 8.902 -9.034 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -0.546 7.127 -10.717 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -0.322 6.843 -9.003 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -2.614 7.234 -7.570 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -3.777 8.405 -8.236 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -3.665 6.769 -8.928 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -1.170 4.800 -10.126 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.366 5.411 -8.959 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.593 5.700 -10.700 1.00 0.00 H new ATOM 1976 N ARG A 126 -2.704 10.995 -10.819 1.00 0.00 N ATOM 1977 CA ARG A 126 -3.286 12.347 -10.589 1.00 0.00 C ATOM 1978 C ARG A 126 -4.482 12.549 -11.523 1.00 0.00 C ATOM 1979 O ARG A 126 -5.574 12.857 -11.090 1.00 0.00 O ATOM 1980 CB ARG A 126 -2.228 13.415 -10.875 1.00 0.00 C ATOM 1981 CG ARG A 126 -2.655 14.739 -10.238 1.00 0.00 C ATOM 1982 CD ARG A 126 -1.571 15.792 -10.476 1.00 0.00 C ATOM 1983 NE ARG A 126 -1.333 16.551 -9.216 1.00 0.00 N ATOM 1984 CZ ARG A 126 -0.263 17.288 -9.091 1.00 0.00 C ATOM 1985 NH1 ARG A 126 0.598 17.361 -10.070 1.00 0.00 N ATOM 1986 NH2 ARG A 126 -0.053 17.952 -7.987 1.00 0.00 N ATOM 0 H ARG A 126 -1.777 10.988 -11.245 1.00 0.00 H new ATOM 0 HA ARG A 126 -3.614 12.432 -9.553 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -1.263 13.102 -10.477 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -2.103 13.540 -11.951 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -3.601 15.072 -10.665 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -2.818 14.605 -9.169 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -0.649 15.313 -10.804 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -1.877 16.472 -11.271 1.00 0.00 H new ATOM 0 HE ARG A 126 -2.006 16.495 -8.452 1.00 0.00 H new ATOM 0 HH11 ARG A 126 0.434 16.842 -10.933 1.00 0.00 H new ATOM 0 HH12 ARG A 126 1.434 17.937 -9.972 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -0.725 17.895 -7.222 1.00 0.00 H new ATOM 0 HH22 ARG A 126 0.783 18.528 -7.889 1.00 0.00 H new ATOM 2000 N SER A 127 -4.284 12.374 -12.801 1.00 0.00 N ATOM 2001 CA SER A 127 -5.413 12.553 -13.759 1.00 0.00 C ATOM 2002 C SER A 127 -6.495 11.516 -13.456 1.00 0.00 C ATOM 2003 O SER A 127 -7.644 11.677 -13.817 1.00 0.00 O ATOM 2004 CB SER A 127 -4.905 12.357 -15.188 1.00 0.00 C ATOM 2005 OG SER A 127 -4.426 13.599 -15.690 1.00 0.00 O ATOM 0 H SER A 127 -3.392 12.116 -13.223 1.00 0.00 H new ATOM 0 HA SER A 127 -5.826 13.556 -13.657 1.00 0.00 H new ATOM 0 HB2 SER A 127 -4.108 11.613 -15.204 1.00 0.00 H new ATOM 0 HB3 SER A 127 -5.707 11.980 -15.823 1.00 0.00 H new ATOM 0 HG SER A 127 -4.098 13.477 -16.605 1.00 0.00 H new ATOM 2011 N GLU A 128 -6.135 10.458 -12.784 1.00 0.00 N ATOM 2012 CA GLU A 128 -7.140 9.413 -12.444 1.00 0.00 C ATOM 2013 C GLU A 128 -7.855 9.807 -11.154 1.00 0.00 C ATOM 2014 O GLU A 128 -9.050 9.633 -11.016 1.00 0.00 O ATOM 2015 CB GLU A 128 -6.438 8.067 -12.258 1.00 0.00 C ATOM 2016 CG GLU A 128 -6.863 7.109 -13.374 1.00 0.00 C ATOM 2017 CD GLU A 128 -6.331 7.620 -14.714 1.00 0.00 C ATOM 2018 OE1 GLU A 128 -5.149 7.916 -14.786 1.00 0.00 O ATOM 2019 OE2 GLU A 128 -7.113 7.706 -15.646 1.00 0.00 O ATOM 0 H GLU A 128 -5.187 10.272 -12.455 1.00 0.00 H new ATOM 0 HA GLU A 128 -7.867 9.326 -13.251 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -5.357 8.204 -12.274 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -6.691 7.644 -11.286 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -6.478 6.109 -13.175 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -7.950 7.032 -13.407 1.00 0.00 H new ATOM 2026 N LEU A 129 -7.133 10.339 -10.209 1.00 0.00 N ATOM 2027 CA LEU A 129 -7.775 10.747 -8.930 1.00 0.00 C ATOM 2028 C LEU A 129 -8.535 12.044 -9.161 1.00 0.00 C ATOM 2029 O LEU A 129 -9.620 12.238 -8.650 1.00 0.00 O ATOM 2030 CB LEU A 129 -6.702 10.954 -7.858 1.00 0.00 C ATOM 2031 CG LEU A 129 -6.743 9.795 -6.857 1.00 0.00 C ATOM 2032 CD1 LEU A 129 -5.557 9.899 -5.896 1.00 0.00 C ATOM 2033 CD2 LEU A 129 -8.049 9.849 -6.055 1.00 0.00 C ATOM 0 H LEU A 129 -6.129 10.509 -10.267 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.462 9.971 -8.592 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -5.717 11.012 -8.322 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -6.868 11.899 -7.342 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.689 8.853 -7.402 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.590 9.073 -5.186 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.626 9.855 -6.461 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.609 10.844 -5.355 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.074 9.023 -5.344 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.106 10.794 -5.515 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.897 9.768 -6.735 1.00 0.00 H new ATOM 2045 N LYS A 130 -7.996 12.926 -9.953 1.00 0.00 N ATOM 2046 CA LYS A 130 -8.708 14.187 -10.245 1.00 0.00 C ATOM 2047 C LYS A 130 -10.090 13.808 -10.789 1.00 0.00 C ATOM 2048 O LYS A 130 -10.958 14.635 -10.979 1.00 0.00 O ATOM 2049 CB LYS A 130 -7.872 14.959 -11.278 1.00 0.00 C ATOM 2050 CG LYS A 130 -8.722 15.951 -12.073 1.00 0.00 C ATOM 2051 CD LYS A 130 -9.179 15.302 -13.385 1.00 0.00 C ATOM 2052 CE LYS A 130 -9.889 16.346 -14.249 1.00 0.00 C ATOM 2053 NZ LYS A 130 -11.059 15.718 -14.926 1.00 0.00 N ATOM 0 H LYS A 130 -7.090 12.823 -10.410 1.00 0.00 H new ATOM 0 HA LYS A 130 -8.840 14.820 -9.368 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -7.070 15.494 -10.769 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -7.400 14.254 -11.963 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -9.588 16.256 -11.485 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -8.146 16.852 -12.283 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -8.321 14.894 -13.920 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -9.850 14.469 -13.177 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -10.218 17.182 -13.631 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -9.200 16.750 -14.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -11.818 16.421 -15.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -10.774 15.375 -15.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -11.403 14.919 -14.356 1.00 0.00 H new ATOM 2067 N LYS A 131 -10.290 12.535 -11.028 1.00 0.00 N ATOM 2068 CA LYS A 131 -11.596 12.050 -11.550 1.00 0.00 C ATOM 2069 C LYS A 131 -11.866 12.689 -12.904 1.00 0.00 C ATOM 2070 O LYS A 131 -12.209 13.850 -13.007 1.00 0.00 O ATOM 2071 CB LYS A 131 -12.719 12.392 -10.562 1.00 0.00 C ATOM 2072 CG LYS A 131 -14.036 12.623 -11.310 1.00 0.00 C ATOM 2073 CD LYS A 131 -15.208 12.445 -10.342 1.00 0.00 C ATOM 2074 CE LYS A 131 -15.119 13.497 -9.234 1.00 0.00 C ATOM 2075 NZ LYS A 131 -14.845 14.832 -9.837 1.00 0.00 N ATOM 0 H LYS A 131 -9.592 11.806 -10.880 1.00 0.00 H new ATOM 0 HA LYS A 131 -11.561 10.967 -11.667 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -12.839 11.581 -9.843 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.454 13.284 -9.995 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -14.053 13.625 -11.738 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -14.124 11.921 -12.139 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -16.153 12.543 -10.876 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -15.188 11.444 -9.910 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -16.051 13.526 -8.669 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -14.328 13.234 -8.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -15.176 15.578 -9.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -13.822 14.939 -9.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -15.345 14.912 -10.745 1.00 0.00 H new ATOM 2089 N ALA A 132 -11.708 11.931 -13.948 1.00 0.00 N ATOM 2090 CA ALA A 132 -11.955 12.482 -15.306 1.00 0.00 C ATOM 2091 C ALA A 132 -12.684 11.441 -16.157 1.00 0.00 C ATOM 2092 O ALA A 132 -13.480 11.772 -17.013 1.00 0.00 O ATOM 2093 CB ALA A 132 -10.622 12.841 -15.964 1.00 0.00 C ATOM 0 H ALA A 132 -11.418 10.953 -13.921 1.00 0.00 H new ATOM 0 HA ALA A 132 -12.571 13.378 -15.226 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -10.805 13.245 -16.960 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -10.107 13.587 -15.359 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -10.003 11.947 -16.043 1.00 0.00 H new ATOM 2099 N GLY A 133 -12.421 10.183 -15.929 1.00 0.00 N ATOM 2100 CA GLY A 133 -13.102 9.124 -16.725 1.00 0.00 C ATOM 2101 C GLY A 133 -14.603 9.413 -16.782 1.00 0.00 C ATOM 2102 O GLY A 133 -15.127 10.178 -15.996 1.00 0.00 O ATOM 0 H GLY A 133 -11.764 9.843 -15.226 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -12.689 9.090 -17.733 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -12.926 8.147 -16.275 1.00 0.00 H new ATOM 2106 N GLY A 134 -15.299 8.809 -17.706 1.00 0.00 N ATOM 2107 CA GLY A 134 -16.767 9.051 -17.812 1.00 0.00 C ATOM 2108 C GLY A 134 -17.487 7.726 -18.066 1.00 0.00 C ATOM 2109 O GLY A 134 -16.873 6.725 -18.381 1.00 0.00 O ATOM 0 H GLY A 134 -14.915 8.159 -18.392 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -17.138 9.508 -16.895 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -16.973 9.750 -18.623 1.00 0.00 H new ATOM 2113 N ALA A 135 -18.785 7.709 -17.931 1.00 0.00 N ATOM 2114 CA ALA A 135 -19.543 6.449 -18.165 1.00 0.00 C ATOM 2115 C ALA A 135 -21.025 6.774 -18.365 1.00 0.00 C ATOM 2116 O ALA A 135 -21.887 5.949 -18.138 1.00 0.00 O ATOM 2117 CB ALA A 135 -19.382 5.525 -16.956 1.00 0.00 C ATOM 0 H ALA A 135 -19.353 8.514 -17.668 1.00 0.00 H new ATOM 0 HA ALA A 135 -19.157 5.953 -19.056 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -19.937 4.602 -17.127 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -18.327 5.293 -16.814 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -19.768 6.021 -16.065 1.00 0.00 H new ATOM 2123 N ASN A 136 -21.326 7.972 -18.789 1.00 0.00 N ATOM 2124 CA ASN A 136 -22.752 8.349 -19.002 1.00 0.00 C ATOM 2125 C ASN A 136 -23.484 8.364 -17.659 1.00 0.00 C ATOM 2126 O ASN A 136 -23.789 9.409 -17.120 1.00 0.00 O ATOM 2127 CB ASN A 136 -23.415 7.332 -19.933 1.00 0.00 C ATOM 2128 CG ASN A 136 -22.399 6.852 -20.972 1.00 0.00 C ATOM 2129 OD1 ASN A 136 -22.509 5.755 -21.484 1.00 0.00 O ATOM 2130 ND2 ASN A 136 -21.409 7.632 -21.306 1.00 0.00 N ATOM 0 H ASN A 136 -20.647 8.704 -18.997 1.00 0.00 H new ATOM 0 HA ASN A 136 -22.801 9.340 -19.452 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -23.789 6.486 -19.357 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -24.273 7.784 -20.430 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -20.726 7.322 -21.997 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -21.317 8.552 -20.876 1.00 0.00 H new ATOM 2137 N TYR A 137 -23.767 7.213 -17.114 1.00 0.00 N ATOM 2138 CA TYR A 137 -24.479 7.162 -15.806 1.00 0.00 C ATOM 2139 C TYR A 137 -25.757 7.999 -15.889 1.00 0.00 C ATOM 2140 O TYR A 137 -26.440 8.207 -14.905 1.00 0.00 O ATOM 2141 CB TYR A 137 -23.572 7.723 -14.710 1.00 0.00 C ATOM 2142 CG TYR A 137 -24.236 7.544 -13.365 1.00 0.00 C ATOM 2143 CD1 TYR A 137 -24.214 6.295 -12.734 1.00 0.00 C ATOM 2144 CD2 TYR A 137 -24.873 8.628 -12.751 1.00 0.00 C ATOM 2145 CE1 TYR A 137 -24.829 6.129 -11.488 1.00 0.00 C ATOM 2146 CE2 TYR A 137 -25.490 8.463 -11.503 1.00 0.00 C ATOM 2147 CZ TYR A 137 -25.467 7.213 -10.873 1.00 0.00 C ATOM 2148 OH TYR A 137 -26.075 7.049 -9.644 1.00 0.00 O ATOM 0 H TYR A 137 -23.536 6.305 -17.518 1.00 0.00 H new ATOM 0 HA TYR A 137 -24.736 6.129 -15.571 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -22.609 7.212 -14.723 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -23.374 8.779 -14.892 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -23.722 5.459 -13.209 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -24.889 9.592 -13.238 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -24.812 5.165 -11.001 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -25.982 9.299 -11.028 1.00 0.00 H new ATOM 0 HH TYR A 137 -26.469 7.899 -9.358 1.00 0.00 H new ATOM 2158 N ASP A 138 -26.086 8.483 -17.055 1.00 0.00 N ATOM 2159 CA ASP A 138 -27.319 9.307 -17.199 1.00 0.00 C ATOM 2160 C ASP A 138 -27.675 9.439 -18.681 1.00 0.00 C ATOM 2161 O ASP A 138 -28.441 8.662 -19.216 1.00 0.00 O ATOM 2162 CB ASP A 138 -27.076 10.697 -16.608 1.00 0.00 C ATOM 2163 CG ASP A 138 -28.202 11.640 -17.038 1.00 0.00 C ATOM 2164 OD1 ASP A 138 -29.226 11.144 -17.480 1.00 0.00 O ATOM 2165 OD2 ASP A 138 -28.021 12.840 -16.918 1.00 0.00 O ATOM 0 H ASP A 138 -25.554 8.343 -17.914 1.00 0.00 H new ATOM 0 HA ASP A 138 -28.141 8.825 -16.669 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -27.032 10.639 -15.520 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -26.115 11.084 -16.946 1.00 0.00 H new ATOM 2170 N ALA A 139 -27.125 10.416 -19.349 1.00 0.00 N ATOM 2171 CA ALA A 139 -27.432 10.595 -20.795 1.00 0.00 C ATOM 2172 C ALA A 139 -26.193 11.124 -21.519 1.00 0.00 C ATOM 2173 O ALA A 139 -26.048 12.313 -21.733 1.00 0.00 O ATOM 2174 CB ALA A 139 -28.581 11.593 -20.953 1.00 0.00 C ATOM 0 H ALA A 139 -26.476 11.098 -18.955 1.00 0.00 H new ATOM 0 HA ALA A 139 -27.722 9.637 -21.226 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -28.806 11.724 -22.011 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -29.464 11.215 -20.438 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -28.292 12.552 -20.522 1.00 0.00 H new ATOM 2180 N GLN A 140 -25.298 10.255 -21.897 1.00 0.00 N ATOM 2181 CA GLN A 140 -24.068 10.710 -22.606 1.00 0.00 C ATOM 2182 C GLN A 140 -23.439 11.874 -21.838 1.00 0.00 C ATOM 2183 O GLN A 140 -22.745 11.682 -20.860 1.00 0.00 O ATOM 2184 CB GLN A 140 -24.435 11.169 -24.018 1.00 0.00 C ATOM 2185 CG GLN A 140 -24.784 9.952 -24.878 1.00 0.00 C ATOM 2186 CD GLN A 140 -25.550 10.407 -26.121 1.00 0.00 C ATOM 2187 OE1 GLN A 140 -25.561 11.577 -26.448 1.00 0.00 O ATOM 2188 NE2 GLN A 140 -26.195 9.525 -26.834 1.00 0.00 N ATOM 0 H GLN A 140 -25.364 9.248 -21.746 1.00 0.00 H new ATOM 0 HA GLN A 140 -23.356 9.887 -22.665 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -25.281 11.855 -23.980 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -23.602 11.714 -24.462 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -23.874 9.427 -25.170 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -25.387 9.249 -24.304 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -26.186 8.543 -26.560 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -26.708 9.818 -27.665 1.00 0.00 H new ATOM 2197 N SER A 141 -23.675 13.081 -22.274 1.00 0.00 N ATOM 2198 CA SER A 141 -23.090 14.256 -21.569 1.00 0.00 C ATOM 2199 C SER A 141 -23.650 15.545 -22.176 1.00 0.00 C ATOM 2200 O SER A 141 -23.259 16.635 -21.809 1.00 0.00 O ATOM 2201 CB SER A 141 -21.569 14.238 -21.724 1.00 0.00 C ATOM 2202 OG SER A 141 -21.205 13.232 -22.661 1.00 0.00 O ATOM 0 H SER A 141 -24.248 13.304 -23.088 1.00 0.00 H new ATOM 0 HA SER A 141 -23.348 14.211 -20.511 1.00 0.00 H new ATOM 0 HB2 SER A 141 -21.215 15.212 -22.062 1.00 0.00 H new ATOM 0 HB3 SER A 141 -21.096 14.043 -20.762 1.00 0.00 H new ATOM 0 HG SER A 141 -20.231 13.218 -22.764 1.00 0.00 H new ATOM 2208 N GLU A 142 -24.561 15.429 -23.101 1.00 0.00 N ATOM 2209 CA GLU A 142 -25.144 16.647 -23.730 1.00 0.00 C ATOM 2210 C GLU A 142 -26.391 17.076 -22.954 1.00 0.00 C ATOM 2211 O GLU A 142 -26.581 18.270 -22.790 1.00 0.00 O ATOM 2212 CB GLU A 142 -25.528 16.341 -25.179 1.00 0.00 C ATOM 2213 CG GLU A 142 -24.370 15.618 -25.872 1.00 0.00 C ATOM 2214 CD GLU A 142 -24.490 15.796 -27.387 1.00 0.00 C ATOM 2215 OE1 GLU A 142 -25.558 15.527 -27.911 1.00 0.00 O ATOM 2216 OE2 GLU A 142 -23.512 16.197 -27.996 1.00 0.00 O ATOM 2217 OXT GLU A 142 -27.133 16.203 -22.535 1.00 0.00 O ATOM 0 H GLU A 142 -24.927 14.543 -23.449 1.00 0.00 H new ATOM 0 HA GLU A 142 -24.408 17.451 -23.711 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -26.425 15.722 -25.206 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -25.762 17.265 -25.707 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -23.417 16.017 -25.523 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -24.385 14.558 -25.617 1.00 0.00 H new TER 2224 GLU A 142