USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 917 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 57 TYR OH : rot 180:sc= -0.154 USER MOD Set 1.2: A 83 MET CE :methyl 152:sc= -0.076 (180deg=-0.723) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HE2:sc= -9.14! C(o=-9.1!,f=-16!) USER MOD Single : A 21 CYS SG : rot 60:sc= -2.62! USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot -69:sc= -1.55! USER MOD Single : A 58 TYR OH : rot 0:sc= -1.14 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.01 USER MOD Single : A 84 THR OG1 : rot -150:sc= -2.93 USER MOD Single : A 90 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.0034) USER MOD Single : A 101 SER OG : rot -128:sc= 0.621 USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 THR OG1 : rot 53:sc= -8.38! USER MOD Single : A 121 HIS :FLIP no HD1:sc= -7.58! C(o=-10!,f=-7.6!) USER MOD Single : A 123 LYS NZ :NH3+ -149:sc= -0.286 (180deg=-1.57!) USER MOD Single : A 125 HIS : no HD1:sc= -2.95 K(o=-3,f=-4.8!) USER MOD Single : A 127 HIS : no HD1:sc= -12.5! C(o=-12!,f=-18!) USER MOD Single : A 133 ASN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 135 HIS : no HE2:sc= -1.97! C(o=-2!,f=-7.6!) USER MOD Single : A 136 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.039) USER MOD Single : A 146 THR OG1 : rot 29:sc= 0.0545 USER MOD Single : A 152 ASN : amide:sc= -3.32! C(o=-3.3!,f=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 18 N PRO A 2 -5.540 13.653 7.768 1.00 0.00 N ATOM 19 CA PRO A 2 -6.212 13.700 9.098 1.00 0.00 C ATOM 20 C PRO A 2 -5.926 12.453 9.937 1.00 0.00 C ATOM 21 O PRO A 2 -5.639 11.393 9.418 1.00 0.00 O ATOM 22 CB PRO A 2 -7.706 13.790 8.772 1.00 0.00 C ATOM 23 CG PRO A 2 -7.842 13.385 7.340 1.00 0.00 C ATOM 24 CD PRO A 2 -6.507 13.690 6.664 1.00 0.00 C ATOM 0 HA PRO A 2 -5.852 14.540 9.692 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -8.287 13.133 9.420 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -8.079 14.802 8.928 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -8.082 12.325 7.260 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -8.652 13.933 6.859 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -6.268 12.952 5.898 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -6.519 14.664 6.175 1.00 0.00 H new ATOM 32 N GLU A 3 -6.009 12.574 11.232 1.00 0.00 N ATOM 33 CA GLU A 3 -5.749 11.403 12.110 1.00 0.00 C ATOM 34 C GLU A 3 -6.754 10.295 11.785 1.00 0.00 C ATOM 35 O GLU A 3 -6.474 9.123 11.942 1.00 0.00 O ATOM 36 CB GLU A 3 -5.906 11.826 13.571 1.00 0.00 C ATOM 37 CG GLU A 3 -4.834 12.859 13.922 1.00 0.00 C ATOM 38 CD GLU A 3 -4.948 13.231 15.400 1.00 0.00 C ATOM 39 OE1 GLU A 3 -4.065 13.916 15.889 1.00 0.00 O ATOM 40 OE2 GLU A 3 -5.918 12.825 16.020 1.00 0.00 O ATOM 0 H GLU A 3 -6.247 13.437 11.721 1.00 0.00 H new ATOM 0 HA GLU A 3 -4.737 11.034 11.945 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.898 12.246 13.734 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -5.817 10.958 14.224 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -3.843 12.456 13.713 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -4.954 13.748 13.302 1.00 0.00 H new ATOM 47 N GLU A 4 -7.923 10.660 11.337 1.00 0.00 N ATOM 48 CA GLU A 4 -8.950 9.635 11.002 1.00 0.00 C ATOM 49 C GLU A 4 -8.884 9.309 9.510 1.00 0.00 C ATOM 50 O GLU A 4 -8.622 10.167 8.690 1.00 0.00 O ATOM 51 CB GLU A 4 -10.335 10.177 11.333 1.00 0.00 C ATOM 52 CG GLU A 4 -11.374 9.069 11.150 1.00 0.00 C ATOM 53 CD GLU A 4 -12.775 9.638 11.384 1.00 0.00 C ATOM 54 OE1 GLU A 4 -13.724 8.875 11.301 1.00 0.00 O ATOM 55 OE2 GLU A 4 -12.876 10.825 11.642 1.00 0.00 O ATOM 0 H GLU A 4 -8.212 11.627 11.188 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.759 8.732 11.582 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -10.357 10.545 12.359 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -10.571 11.022 10.686 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -11.303 8.652 10.146 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -11.180 8.255 11.848 1.00 0.00 H new ATOM 62 N ILE A 5 -9.113 8.073 9.154 1.00 0.00 N ATOM 63 CA ILE A 5 -9.058 7.679 7.720 1.00 0.00 C ATOM 64 C ILE A 5 -10.428 7.147 7.270 1.00 0.00 C ATOM 65 O ILE A 5 -10.702 5.967 7.364 1.00 0.00 O ATOM 66 CB ILE A 5 -8.001 6.584 7.535 1.00 0.00 C ATOM 67 CG1 ILE A 5 -7.048 6.565 8.729 1.00 0.00 C ATOM 68 CG2 ILE A 5 -7.203 6.854 6.266 1.00 0.00 C ATOM 69 CD1 ILE A 5 -6.302 7.891 8.807 1.00 0.00 C ATOM 0 H ILE A 5 -9.337 7.316 9.800 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.797 8.549 7.118 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.504 5.620 7.459 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.606 6.395 9.650 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.340 5.743 8.629 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.452 6.075 6.136 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.875 6.858 5.408 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.710 7.823 6.345 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.622 7.877 9.659 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.732 8.042 7.890 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.017 8.704 8.927 1.00 0.00 H new ATOM 81 N PRO A 6 -11.285 8.006 6.775 1.00 0.00 N ATOM 82 CA PRO A 6 -12.632 7.596 6.297 1.00 0.00 C ATOM 83 C PRO A 6 -12.561 6.973 4.901 1.00 0.00 C ATOM 84 O PRO A 6 -11.535 7.006 4.255 1.00 0.00 O ATOM 85 CB PRO A 6 -13.428 8.900 6.275 1.00 0.00 C ATOM 86 CG PRO A 6 -12.418 9.993 6.124 1.00 0.00 C ATOM 87 CD PRO A 6 -11.070 9.453 6.615 1.00 0.00 C ATOM 0 HA PRO A 6 -13.086 6.836 6.934 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -14.140 8.909 5.450 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -14.002 9.023 7.193 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -12.348 10.308 5.083 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -12.713 10.869 6.702 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -10.276 9.659 5.898 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -10.777 9.917 7.557 1.00 0.00 H new ATOM 95 N ASP A 7 -13.627 6.390 4.432 1.00 0.00 N ATOM 96 CA ASP A 7 -13.586 5.754 3.090 1.00 0.00 C ATOM 97 C ASP A 7 -13.347 6.798 1.999 1.00 0.00 C ATOM 98 O ASP A 7 -14.045 7.786 1.890 1.00 0.00 O ATOM 99 CB ASP A 7 -14.909 5.029 2.835 1.00 0.00 C ATOM 100 CG ASP A 7 -16.077 6.000 3.024 1.00 0.00 C ATOM 101 OD1 ASP A 7 -17.208 5.546 2.994 1.00 0.00 O ATOM 102 OD2 ASP A 7 -15.821 7.179 3.203 1.00 0.00 O ATOM 0 H ASP A 7 -14.521 6.327 4.919 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.762 5.041 3.064 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.922 4.622 1.824 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -15.010 4.186 3.519 1.00 0.00 H new ATOM 107 N VAL A 8 -12.355 6.564 1.184 1.00 0.00 N ATOM 108 CA VAL A 8 -12.038 7.510 0.076 1.00 0.00 C ATOM 109 C VAL A 8 -11.696 6.708 -1.184 1.00 0.00 C ATOM 110 O VAL A 8 -11.041 5.687 -1.114 1.00 0.00 O ATOM 111 CB VAL A 8 -10.842 8.377 0.472 1.00 0.00 C ATOM 112 CG1 VAL A 8 -9.594 7.502 0.595 1.00 0.00 C ATOM 113 CG2 VAL A 8 -10.613 9.447 -0.597 1.00 0.00 C ATOM 0 H VAL A 8 -11.744 5.749 1.239 1.00 0.00 H new ATOM 0 HA VAL A 8 -12.898 8.151 -0.119 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.043 8.857 1.430 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.742 8.121 0.877 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.757 6.740 1.357 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.392 7.020 -0.362 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.761 10.066 -0.316 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -10.413 8.967 -1.555 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -11.502 10.072 -0.683 1.00 0.00 H new ATOM 123 N ARG A 9 -12.129 7.158 -2.335 1.00 0.00 N ATOM 124 CA ARG A 9 -11.818 6.413 -3.593 1.00 0.00 C ATOM 125 C ARG A 9 -11.134 7.353 -4.591 1.00 0.00 C ATOM 126 O ARG A 9 -11.636 8.415 -4.902 1.00 0.00 O ATOM 127 CB ARG A 9 -13.117 5.882 -4.200 1.00 0.00 C ATOM 128 CG ARG A 9 -12.795 5.002 -5.409 1.00 0.00 C ATOM 129 CD ARG A 9 -14.092 4.427 -5.979 1.00 0.00 C ATOM 130 NE ARG A 9 -14.890 5.520 -6.600 1.00 0.00 N ATOM 131 CZ ARG A 9 -14.513 6.038 -7.737 1.00 0.00 C ATOM 132 NH1 ARG A 9 -15.212 6.997 -8.281 1.00 0.00 N ATOM 133 NH2 ARG A 9 -13.437 5.597 -8.331 1.00 0.00 N ATOM 0 H ARG A 9 -12.682 8.006 -2.458 1.00 0.00 H new ATOM 0 HA ARG A 9 -11.152 5.580 -3.368 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -13.670 5.308 -3.456 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -13.756 6.712 -4.501 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -12.278 5.586 -6.170 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -12.124 4.194 -5.116 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -13.867 3.660 -6.720 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -14.668 3.946 -5.188 1.00 0.00 H new ATOM 0 HE ARG A 9 -15.731 5.864 -6.137 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -16.053 7.341 -7.817 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -14.917 7.402 -9.170 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -12.891 4.847 -7.906 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -13.143 6.002 -9.220 1.00 0.00 H new ATOM 147 N LYS A 10 -9.992 6.968 -5.098 1.00 0.00 N ATOM 148 CA LYS A 10 -9.278 7.840 -6.077 1.00 0.00 C ATOM 149 C LYS A 10 -8.714 6.991 -7.222 1.00 0.00 C ATOM 150 O LYS A 10 -8.319 5.857 -7.032 1.00 0.00 O ATOM 151 CB LYS A 10 -8.130 8.565 -5.372 1.00 0.00 C ATOM 152 CG LYS A 10 -8.695 9.471 -4.278 1.00 0.00 C ATOM 153 CD LYS A 10 -7.561 10.286 -3.652 1.00 0.00 C ATOM 154 CE LYS A 10 -8.105 11.101 -2.477 1.00 0.00 C ATOM 155 NZ LYS A 10 -7.565 12.488 -2.542 1.00 0.00 N ATOM 0 H LYS A 10 -9.524 6.089 -4.877 1.00 0.00 H new ATOM 0 HA LYS A 10 -9.980 8.568 -6.483 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -7.440 7.841 -4.939 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -7.563 9.156 -6.091 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -9.448 10.138 -4.697 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -9.190 8.871 -3.514 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -6.767 9.622 -3.311 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -7.122 10.950 -4.397 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -9.194 11.122 -2.508 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -7.822 10.633 -1.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -7.935 13.042 -1.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -6.527 12.459 -2.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -7.856 12.932 -3.436 1.00 0.00 H new ATOM 169 N SER A 11 -8.664 7.539 -8.407 1.00 0.00 N ATOM 170 CA SER A 11 -8.113 6.775 -9.563 1.00 0.00 C ATOM 171 C SER A 11 -7.227 7.700 -10.403 1.00 0.00 C ATOM 172 O SER A 11 -7.469 8.887 -10.499 1.00 0.00 O ATOM 173 CB SER A 11 -9.263 6.252 -10.424 1.00 0.00 C ATOM 174 OG SER A 11 -9.939 7.350 -11.022 1.00 0.00 O ATOM 0 H SER A 11 -8.981 8.484 -8.624 1.00 0.00 H new ATOM 0 HA SER A 11 -7.523 5.934 -9.198 1.00 0.00 H new ATOM 0 HB2 SER A 11 -8.880 5.582 -11.194 1.00 0.00 H new ATOM 0 HB3 SER A 11 -9.955 5.673 -9.813 1.00 0.00 H new ATOM 0 HG SER A 11 -10.676 7.018 -11.576 1.00 0.00 H new ATOM 180 N VAL A 12 -6.201 7.168 -11.014 1.00 0.00 N ATOM 181 CA VAL A 12 -5.303 8.022 -11.845 1.00 0.00 C ATOM 182 C VAL A 12 -4.641 7.183 -12.936 1.00 0.00 C ATOM 183 O VAL A 12 -4.494 5.984 -12.807 1.00 0.00 O ATOM 184 CB VAL A 12 -4.224 8.653 -10.972 1.00 0.00 C ATOM 185 CG1 VAL A 12 -3.152 9.286 -11.861 1.00 0.00 C ATOM 186 CG2 VAL A 12 -4.854 9.734 -10.095 1.00 0.00 C ATOM 0 H VAL A 12 -5.947 6.181 -10.973 1.00 0.00 H new ATOM 0 HA VAL A 12 -5.902 8.808 -12.306 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.770 7.887 -10.344 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -2.381 9.737 -11.236 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -2.704 8.519 -12.493 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -3.606 10.054 -12.488 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -4.086 10.188 -9.469 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.305 10.498 -10.728 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.621 9.288 -9.462 1.00 0.00 H new ATOM 196 N VAL A 13 -4.230 7.808 -14.005 1.00 0.00 N ATOM 197 CA VAL A 13 -3.566 7.053 -15.100 1.00 0.00 C ATOM 198 C VAL A 13 -2.063 7.323 -15.042 1.00 0.00 C ATOM 199 O VAL A 13 -1.630 8.447 -14.886 1.00 0.00 O ATOM 200 CB VAL A 13 -4.115 7.513 -16.451 1.00 0.00 C ATOM 201 CG1 VAL A 13 -3.432 8.818 -16.859 1.00 0.00 C ATOM 202 CG2 VAL A 13 -3.835 6.440 -17.507 1.00 0.00 C ATOM 0 H VAL A 13 -4.326 8.811 -14.166 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.758 5.987 -14.982 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.190 7.674 -16.372 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.822 9.147 -17.822 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -3.629 9.582 -16.107 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -2.357 8.656 -16.939 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.226 6.767 -18.470 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.760 6.280 -17.587 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -4.320 5.508 -17.216 1.00 0.00 H new ATOM 212 N VAL A 14 -1.267 6.297 -15.153 1.00 0.00 N ATOM 213 CA VAL A 14 0.212 6.481 -15.092 1.00 0.00 C ATOM 214 C VAL A 14 0.876 5.730 -16.248 1.00 0.00 C ATOM 215 O VAL A 14 0.282 4.872 -16.863 1.00 0.00 O ATOM 216 CB VAL A 14 0.738 5.938 -13.764 1.00 0.00 C ATOM 217 CG1 VAL A 14 0.168 6.765 -12.610 1.00 0.00 C ATOM 218 CG2 VAL A 14 0.300 4.484 -13.607 1.00 0.00 C ATOM 0 H VAL A 14 -1.577 5.334 -15.284 1.00 0.00 H new ATOM 0 HA VAL A 14 0.446 7.543 -15.172 1.00 0.00 H new ATOM 0 HB VAL A 14 1.826 5.999 -13.751 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.544 6.377 -11.664 1.00 0.00 H new ATOM 0 HG12 VAL A 14 0.473 7.805 -12.722 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -0.920 6.703 -12.621 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.673 4.092 -12.661 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.789 4.429 -13.619 1.00 0.00 H new ATOM 0 HG23 VAL A 14 0.702 3.892 -14.429 1.00 0.00 H new ATOM 228 N ALA A 15 2.104 6.045 -16.552 1.00 0.00 N ATOM 229 CA ALA A 15 2.795 5.345 -17.673 1.00 0.00 C ATOM 230 C ALA A 15 3.362 4.015 -17.171 1.00 0.00 C ATOM 231 O ALA A 15 4.449 3.961 -16.630 1.00 0.00 O ATOM 232 CB ALA A 15 3.940 6.220 -18.188 1.00 0.00 C ATOM 0 H ALA A 15 2.659 6.755 -16.074 1.00 0.00 H new ATOM 0 HA ALA A 15 2.085 5.158 -18.478 1.00 0.00 H new ATOM 0 HB1 ALA A 15 4.447 5.711 -19.008 1.00 0.00 H new ATOM 0 HB2 ALA A 15 3.541 7.170 -18.543 1.00 0.00 H new ATOM 0 HB3 ALA A 15 4.649 6.403 -17.381 1.00 0.00 H new ATOM 238 N ALA A 16 2.638 2.938 -17.334 1.00 0.00 N ATOM 239 CA ALA A 16 3.160 1.631 -16.847 1.00 0.00 C ATOM 240 C ALA A 16 2.198 0.501 -17.214 1.00 0.00 C ATOM 241 O ALA A 16 1.057 0.726 -17.559 1.00 0.00 O ATOM 242 CB ALA A 16 3.322 1.687 -15.330 1.00 0.00 C ATOM 0 H ALA A 16 1.720 2.908 -17.778 1.00 0.00 H new ATOM 0 HA ALA A 16 4.124 1.438 -17.318 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.704 0.732 -14.969 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.022 2.480 -15.068 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.356 1.889 -14.868 1.00 0.00 H new ATOM 248 N SER A 17 2.650 -0.718 -17.126 1.00 0.00 N ATOM 249 CA SER A 17 1.763 -1.867 -17.438 1.00 0.00 C ATOM 250 C SER A 17 1.280 -2.457 -16.111 1.00 0.00 C ATOM 251 O SER A 17 1.967 -2.387 -15.111 1.00 0.00 O ATOM 252 CB SER A 17 2.540 -2.924 -18.223 1.00 0.00 C ATOM 253 OG SER A 17 3.030 -2.349 -19.427 1.00 0.00 O ATOM 0 H SER A 17 3.600 -0.967 -16.850 1.00 0.00 H new ATOM 0 HA SER A 17 0.916 -1.542 -18.042 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.368 -3.303 -17.624 1.00 0.00 H new ATOM 0 HB3 SER A 17 1.895 -3.773 -18.448 1.00 0.00 H new ATOM 0 HG SER A 17 3.530 -3.024 -19.932 1.00 0.00 H new ATOM 259 N VAL A 18 0.106 -3.020 -16.077 1.00 0.00 N ATOM 260 CA VAL A 18 -0.402 -3.585 -14.797 1.00 0.00 C ATOM 261 C VAL A 18 0.577 -4.635 -14.273 1.00 0.00 C ATOM 262 O VAL A 18 0.821 -4.729 -13.088 1.00 0.00 O ATOM 263 CB VAL A 18 -1.769 -4.213 -15.032 1.00 0.00 C ATOM 264 CG1 VAL A 18 -2.704 -3.162 -15.633 1.00 0.00 C ATOM 265 CG2 VAL A 18 -1.629 -5.392 -15.999 1.00 0.00 C ATOM 0 H VAL A 18 -0.521 -3.113 -16.876 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.495 -2.791 -14.056 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.179 -4.571 -14.088 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -3.686 -3.604 -15.805 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.799 -2.323 -14.944 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -2.294 -2.809 -16.580 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -2.607 -5.842 -16.168 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -1.224 -5.039 -16.947 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.956 -6.135 -15.571 1.00 0.00 H new ATOM 275 N GLU A 19 1.154 -5.414 -15.142 1.00 0.00 N ATOM 276 CA GLU A 19 2.128 -6.432 -14.679 1.00 0.00 C ATOM 277 C GLU A 19 3.289 -5.708 -14.006 1.00 0.00 C ATOM 278 O GLU A 19 3.798 -6.128 -12.986 1.00 0.00 O ATOM 279 CB GLU A 19 2.641 -7.219 -15.880 1.00 0.00 C ATOM 280 CG GLU A 19 1.505 -8.059 -16.468 1.00 0.00 C ATOM 281 CD GLU A 19 2.038 -8.896 -17.631 1.00 0.00 C ATOM 282 OE1 GLU A 19 3.172 -8.674 -18.024 1.00 0.00 O ATOM 283 OE2 GLU A 19 1.304 -9.745 -18.110 1.00 0.00 O ATOM 0 H GLU A 19 0.993 -5.389 -16.149 1.00 0.00 H new ATOM 0 HA GLU A 19 1.658 -7.120 -13.977 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.030 -6.536 -16.635 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.466 -7.865 -15.579 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.085 -8.709 -15.701 1.00 0.00 H new ATOM 0 HG3 GLU A 19 0.700 -7.410 -16.812 1.00 0.00 H new ATOM 290 N HIS A 20 3.696 -4.607 -14.571 1.00 0.00 N ATOM 291 CA HIS A 20 4.808 -3.822 -13.973 1.00 0.00 C ATOM 292 C HIS A 20 4.378 -3.284 -12.614 1.00 0.00 C ATOM 293 O HIS A 20 5.146 -3.246 -11.674 1.00 0.00 O ATOM 294 CB HIS A 20 5.153 -2.639 -14.871 1.00 0.00 C ATOM 295 CG HIS A 20 6.046 -1.709 -14.103 1.00 0.00 C ATOM 296 ND1 HIS A 20 7.419 -1.682 -14.295 1.00 0.00 N ATOM 297 CD2 HIS A 20 5.787 -0.792 -13.109 1.00 0.00 C ATOM 298 CE1 HIS A 20 7.929 -0.781 -13.437 1.00 0.00 C ATOM 299 NE2 HIS A 20 6.977 -0.214 -12.697 1.00 0.00 N ATOM 0 H HIS A 20 3.303 -4.215 -15.427 1.00 0.00 H new ATOM 0 HA HIS A 20 5.677 -4.471 -13.866 1.00 0.00 H new ATOM 0 HB2 HIS A 20 5.652 -2.983 -15.777 1.00 0.00 H new ATOM 0 HB3 HIS A 20 4.246 -2.122 -15.184 1.00 0.00 H new ATOM 0 HD1 HIS A 20 7.946 -2.243 -14.965 1.00 0.00 H new ATOM 0 HD2 HIS A 20 4.810 -0.560 -12.713 1.00 0.00 H new ATOM 0 HE1 HIS A 20 8.980 -0.546 -13.358 1.00 0.00 H new ATOM 308 N CYS A 21 3.155 -2.851 -12.511 1.00 0.00 N ATOM 309 CA CYS A 21 2.669 -2.296 -11.225 1.00 0.00 C ATOM 310 C CYS A 21 2.987 -3.274 -10.105 1.00 0.00 C ATOM 311 O CYS A 21 3.427 -2.891 -9.039 1.00 0.00 O ATOM 312 CB CYS A 21 1.157 -2.095 -11.306 1.00 0.00 C ATOM 313 SG CYS A 21 0.778 -0.862 -12.572 1.00 0.00 S ATOM 0 H CYS A 21 2.470 -2.859 -13.267 1.00 0.00 H new ATOM 0 HA CYS A 21 3.157 -1.342 -11.027 1.00 0.00 H new ATOM 0 HB2 CYS A 21 0.667 -3.039 -11.544 1.00 0.00 H new ATOM 0 HB3 CYS A 21 0.771 -1.770 -10.340 1.00 0.00 H new ATOM 0 HG CYS A 21 1.228 -1.268 -13.722 1.00 0.00 H new ATOM 319 N PHE A 22 2.769 -4.536 -10.330 1.00 0.00 N ATOM 320 CA PHE A 22 3.065 -5.518 -9.258 1.00 0.00 C ATOM 321 C PHE A 22 4.547 -5.866 -9.257 1.00 0.00 C ATOM 322 O PHE A 22 5.106 -6.222 -8.238 1.00 0.00 O ATOM 323 CB PHE A 22 2.212 -6.769 -9.424 1.00 0.00 C ATOM 324 CG PHE A 22 1.156 -6.721 -8.356 1.00 0.00 C ATOM 325 CD1 PHE A 22 0.037 -5.903 -8.531 1.00 0.00 C ATOM 326 CD2 PHE A 22 1.316 -7.455 -7.175 1.00 0.00 C ATOM 327 CE1 PHE A 22 -0.926 -5.816 -7.525 1.00 0.00 C ATOM 328 CE2 PHE A 22 0.347 -7.375 -6.167 1.00 0.00 C ATOM 329 CZ PHE A 22 -0.773 -6.551 -6.344 1.00 0.00 C ATOM 0 H PHE A 22 2.403 -4.926 -11.199 1.00 0.00 H new ATOM 0 HA PHE A 22 2.817 -5.069 -8.296 1.00 0.00 H new ATOM 0 HB2 PHE A 22 1.758 -6.799 -10.415 1.00 0.00 H new ATOM 0 HB3 PHE A 22 2.821 -7.668 -9.325 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -0.083 -5.339 -9.444 1.00 0.00 H new ATOM 0 HD2 PHE A 22 2.185 -8.082 -7.041 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -1.790 -5.181 -7.658 1.00 0.00 H new ATOM 0 HE2 PHE A 22 0.462 -7.946 -5.257 1.00 0.00 H new ATOM 0 HZ PHE A 22 -1.520 -6.483 -5.567 1.00 0.00 H new ATOM 339 N GLU A 23 5.204 -5.748 -10.374 1.00 0.00 N ATOM 340 CA GLU A 23 6.655 -6.052 -10.387 1.00 0.00 C ATOM 341 C GLU A 23 7.339 -5.112 -9.403 1.00 0.00 C ATOM 342 O GLU A 23 8.219 -5.496 -8.663 1.00 0.00 O ATOM 343 CB GLU A 23 7.218 -5.824 -11.788 1.00 0.00 C ATOM 344 CG GLU A 23 8.717 -6.123 -11.790 1.00 0.00 C ATOM 345 CD GLU A 23 9.295 -5.835 -13.176 1.00 0.00 C ATOM 346 OE1 GLU A 23 8.541 -5.404 -14.033 1.00 0.00 O ATOM 347 OE2 GLU A 23 10.482 -6.051 -13.358 1.00 0.00 O ATOM 0 H GLU A 23 4.804 -5.458 -11.266 1.00 0.00 H new ATOM 0 HA GLU A 23 6.827 -7.091 -10.106 1.00 0.00 H new ATOM 0 HB2 GLU A 23 6.707 -6.466 -12.506 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.041 -4.794 -12.099 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.221 -5.513 -11.041 1.00 0.00 H new ATOM 0 HG3 GLU A 23 8.891 -7.165 -11.522 1.00 0.00 H new ATOM 354 N VAL A 24 6.922 -3.881 -9.384 1.00 0.00 N ATOM 355 CA VAL A 24 7.520 -2.902 -8.449 1.00 0.00 C ATOM 356 C VAL A 24 7.140 -3.270 -7.013 1.00 0.00 C ATOM 357 O VAL A 24 7.930 -3.156 -6.101 1.00 0.00 O ATOM 358 CB VAL A 24 6.979 -1.515 -8.782 1.00 0.00 C ATOM 359 CG1 VAL A 24 7.514 -0.504 -7.773 1.00 0.00 C ATOM 360 CG2 VAL A 24 7.435 -1.125 -10.187 1.00 0.00 C ATOM 0 H VAL A 24 6.185 -3.510 -9.983 1.00 0.00 H new ATOM 0 HA VAL A 24 8.606 -2.910 -8.544 1.00 0.00 H new ATOM 0 HB VAL A 24 5.890 -1.525 -8.739 1.00 0.00 H new ATOM 0 HG11 VAL A 24 7.127 0.487 -8.011 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.194 -0.787 -6.770 1.00 0.00 H new ATOM 0 HG13 VAL A 24 8.603 -0.489 -7.816 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.052 -0.134 -10.432 1.00 0.00 H new ATOM 0 HG22 VAL A 24 8.524 -1.113 -10.226 1.00 0.00 H new ATOM 0 HG23 VAL A 24 7.055 -1.849 -10.907 1.00 0.00 H new ATOM 370 N PHE A 25 5.921 -3.689 -6.814 1.00 0.00 N ATOM 371 CA PHE A 25 5.449 -4.047 -5.447 1.00 0.00 C ATOM 372 C PHE A 25 6.310 -5.157 -4.840 1.00 0.00 C ATOM 373 O PHE A 25 6.672 -5.106 -3.684 1.00 0.00 O ATOM 374 CB PHE A 25 4.007 -4.550 -5.541 1.00 0.00 C ATOM 375 CG PHE A 25 3.028 -3.409 -5.759 1.00 0.00 C ATOM 376 CD1 PHE A 25 1.665 -3.634 -5.524 1.00 0.00 C ATOM 377 CD2 PHE A 25 3.459 -2.136 -6.185 1.00 0.00 C ATOM 378 CE1 PHE A 25 0.740 -2.605 -5.706 1.00 0.00 C ATOM 379 CE2 PHE A 25 2.529 -1.113 -6.367 1.00 0.00 C ATOM 380 CZ PHE A 25 1.174 -1.344 -6.125 1.00 0.00 C ATOM 0 H PHE A 25 5.223 -3.800 -7.550 1.00 0.00 H new ATOM 0 HA PHE A 25 5.517 -3.162 -4.814 1.00 0.00 H new ATOM 0 HB2 PHE A 25 3.923 -5.263 -6.361 1.00 0.00 H new ATOM 0 HB3 PHE A 25 3.747 -5.083 -4.627 1.00 0.00 H new ATOM 0 HD1 PHE A 25 1.329 -4.608 -5.201 1.00 0.00 H new ATOM 0 HD2 PHE A 25 4.507 -1.954 -6.370 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -0.310 -2.783 -5.523 1.00 0.00 H new ATOM 0 HE2 PHE A 25 2.858 -0.139 -6.696 1.00 0.00 H new ATOM 0 HZ PHE A 25 0.459 -0.546 -6.262 1.00 0.00 H new ATOM 390 N THR A 26 6.609 -6.177 -5.589 1.00 0.00 N ATOM 391 CA THR A 26 7.409 -7.296 -5.020 1.00 0.00 C ATOM 392 C THR A 26 8.896 -7.170 -5.373 1.00 0.00 C ATOM 393 O THR A 26 9.704 -7.958 -4.926 1.00 0.00 O ATOM 394 CB THR A 26 6.869 -8.618 -5.565 1.00 0.00 C ATOM 395 OG1 THR A 26 6.955 -8.616 -6.983 1.00 0.00 O ATOM 396 CG2 THR A 26 5.411 -8.796 -5.135 1.00 0.00 C ATOM 0 H THR A 26 6.337 -6.286 -6.566 1.00 0.00 H new ATOM 0 HA THR A 26 7.321 -7.261 -3.934 1.00 0.00 H new ATOM 0 HB THR A 26 7.461 -9.443 -5.168 1.00 0.00 H new ATOM 0 HG1 THR A 26 6.610 -9.464 -7.333 1.00 0.00 H new ATOM 0 HG21 THR A 26 5.029 -9.739 -5.525 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.351 -8.803 -4.047 1.00 0.00 H new ATOM 0 HG23 THR A 26 4.813 -7.973 -5.526 1.00 0.00 H new ATOM 404 N SER A 27 9.280 -6.211 -6.172 1.00 0.00 N ATOM 405 CA SER A 27 10.723 -6.102 -6.524 1.00 0.00 C ATOM 406 C SER A 27 11.461 -5.164 -5.562 1.00 0.00 C ATOM 407 O SER A 27 12.568 -5.449 -5.151 1.00 0.00 O ATOM 408 CB SER A 27 10.865 -5.576 -7.948 1.00 0.00 C ATOM 409 OG SER A 27 10.309 -4.274 -8.026 1.00 0.00 O ATOM 0 H SER A 27 8.668 -5.510 -6.590 1.00 0.00 H new ATOM 0 HA SER A 27 11.166 -7.095 -6.445 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.916 -5.553 -8.236 1.00 0.00 H new ATOM 0 HB3 SER A 27 10.358 -6.242 -8.646 1.00 0.00 H new ATOM 0 HG SER A 27 9.336 -4.327 -7.920 1.00 0.00 H new ATOM 415 N ARG A 28 10.886 -4.040 -5.203 1.00 0.00 N ATOM 416 CA ARG A 28 11.621 -3.119 -4.282 1.00 0.00 C ATOM 417 C ARG A 28 10.791 -1.873 -3.947 1.00 0.00 C ATOM 418 O ARG A 28 11.228 -0.761 -4.160 1.00 0.00 O ATOM 419 CB ARG A 28 12.932 -2.672 -4.948 1.00 0.00 C ATOM 420 CG ARG A 28 12.718 -2.362 -6.446 1.00 0.00 C ATOM 421 CD ARG A 28 11.986 -1.028 -6.626 1.00 0.00 C ATOM 422 NE ARG A 28 12.097 -0.595 -8.046 1.00 0.00 N ATOM 423 CZ ARG A 28 13.205 -0.058 -8.480 1.00 0.00 C ATOM 424 NH1 ARG A 28 13.302 0.324 -9.725 1.00 0.00 N ATOM 425 NH2 ARG A 28 14.216 0.096 -7.670 1.00 0.00 N ATOM 0 H ARG A 28 9.962 -3.727 -5.500 1.00 0.00 H new ATOM 0 HA ARG A 28 11.821 -3.661 -3.358 1.00 0.00 H new ATOM 0 HB2 ARG A 28 13.317 -1.787 -4.442 1.00 0.00 H new ATOM 0 HB3 ARG A 28 13.684 -3.454 -4.839 1.00 0.00 H new ATOM 0 HG2 ARG A 28 13.681 -2.325 -6.956 1.00 0.00 H new ATOM 0 HG3 ARG A 28 12.142 -3.163 -6.909 1.00 0.00 H new ATOM 0 HD2 ARG A 28 10.938 -1.134 -6.347 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.416 -0.272 -5.968 1.00 0.00 H new ATOM 0 HE ARG A 28 11.307 -0.718 -8.680 1.00 0.00 H new ATOM 0 HH11 ARG A 28 12.512 0.203 -10.359 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.168 0.744 -10.064 1.00 0.00 H new ATOM 0 HH21 ARG A 28 14.141 -0.203 -6.698 1.00 0.00 H new ATOM 0 HH22 ARG A 28 15.082 0.516 -8.009 1.00 0.00 H new ATOM 439 N PRO A 29 9.620 -2.038 -3.407 1.00 0.00 N ATOM 440 CA PRO A 29 8.750 -0.887 -3.037 1.00 0.00 C ATOM 441 C PRO A 29 9.472 0.165 -2.183 1.00 0.00 C ATOM 442 O PRO A 29 9.050 1.302 -2.102 1.00 0.00 O ATOM 443 CB PRO A 29 7.599 -1.514 -2.238 1.00 0.00 C ATOM 444 CG PRO A 29 7.975 -2.942 -2.005 1.00 0.00 C ATOM 445 CD PRO A 29 8.982 -3.318 -3.092 1.00 0.00 C ATOM 0 HA PRO A 29 8.422 -0.353 -3.929 1.00 0.00 H new ATOM 0 HB2 PRO A 29 7.453 -0.992 -1.292 1.00 0.00 H new ATOM 0 HB3 PRO A 29 6.661 -1.444 -2.789 1.00 0.00 H new ATOM 0 HG2 PRO A 29 8.410 -3.070 -1.014 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.097 -3.586 -2.053 1.00 0.00 H new ATOM 0 HD2 PRO A 29 9.705 -4.052 -2.736 1.00 0.00 H new ATOM 0 HD3 PRO A 29 8.492 -3.750 -3.964 1.00 0.00 H new ATOM 453 N ALA A 30 10.540 -0.202 -1.529 1.00 0.00 N ATOM 454 CA ALA A 30 11.262 0.782 -0.667 1.00 0.00 C ATOM 455 C ALA A 30 12.255 1.629 -1.475 1.00 0.00 C ATOM 456 O ALA A 30 12.338 2.829 -1.310 1.00 0.00 O ATOM 457 CB ALA A 30 12.036 0.030 0.416 1.00 0.00 C ATOM 0 H ALA A 30 10.945 -1.138 -1.553 1.00 0.00 H new ATOM 0 HA ALA A 30 10.518 1.447 -0.228 1.00 0.00 H new ATOM 0 HB1 ALA A 30 12.565 0.744 1.048 1.00 0.00 H new ATOM 0 HB2 ALA A 30 11.341 -0.548 1.025 1.00 0.00 H new ATOM 0 HB3 ALA A 30 12.755 -0.643 -0.051 1.00 0.00 H new ATOM 463 N ASP A 31 13.048 1.004 -2.297 1.00 0.00 N ATOM 464 CA ASP A 31 14.090 1.758 -3.064 1.00 0.00 C ATOM 465 C ASP A 31 13.492 2.861 -3.944 1.00 0.00 C ATOM 466 O ASP A 31 14.117 3.882 -4.154 1.00 0.00 O ATOM 467 CB ASP A 31 14.859 0.790 -3.962 1.00 0.00 C ATOM 468 CG ASP A 31 15.617 -0.220 -3.098 1.00 0.00 C ATOM 469 OD1 ASP A 31 16.053 -1.222 -3.638 1.00 0.00 O ATOM 470 OD2 ASP A 31 15.749 0.027 -1.910 1.00 0.00 O ATOM 0 H ASP A 31 13.023 -0.000 -2.475 1.00 0.00 H new ATOM 0 HA ASP A 31 14.747 2.228 -2.332 1.00 0.00 H new ATOM 0 HB2 ASP A 31 14.170 0.270 -4.627 1.00 0.00 H new ATOM 0 HB3 ASP A 31 15.557 1.340 -4.593 1.00 0.00 H new ATOM 714 N ALA A 45 15.017 -0.763 5.225 1.00 0.00 N ATOM 715 CA ALA A 45 16.270 -1.567 5.115 1.00 0.00 C ATOM 716 C ALA A 45 16.042 -2.793 4.234 1.00 0.00 C ATOM 717 O ALA A 45 16.822 -3.086 3.349 1.00 0.00 O ATOM 718 CB ALA A 45 16.676 -2.039 6.510 1.00 0.00 C ATOM 0 HA ALA A 45 17.050 -0.948 4.673 1.00 0.00 H new ATOM 0 HB1 ALA A 45 17.591 -2.628 6.443 1.00 0.00 H new ATOM 0 HB2 ALA A 45 16.847 -1.174 7.151 1.00 0.00 H new ATOM 0 HB3 ALA A 45 15.880 -2.652 6.933 1.00 0.00 H new ATOM 724 N GLY A 46 14.989 -3.519 4.474 1.00 0.00 N ATOM 725 CA GLY A 46 14.728 -4.733 3.651 1.00 0.00 C ATOM 726 C GLY A 46 13.225 -4.967 3.554 1.00 0.00 C ATOM 727 O GLY A 46 12.448 -4.375 4.273 1.00 0.00 O ATOM 0 H GLY A 46 14.299 -3.327 5.201 1.00 0.00 H new ATOM 0 HA2 GLY A 46 15.153 -4.608 2.655 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.214 -5.600 4.098 1.00 0.00 H new ATOM 731 N LEU A 47 12.804 -5.831 2.677 1.00 0.00 N ATOM 732 CA LEU A 47 11.347 -6.098 2.555 1.00 0.00 C ATOM 733 C LEU A 47 11.115 -7.491 1.977 1.00 0.00 C ATOM 734 O LEU A 47 11.741 -7.886 1.013 1.00 0.00 O ATOM 735 CB LEU A 47 10.677 -5.069 1.633 1.00 0.00 C ATOM 736 CG LEU A 47 11.704 -4.080 1.069 1.00 0.00 C ATOM 737 CD1 LEU A 47 12.813 -4.832 0.328 1.00 0.00 C ATOM 738 CD2 LEU A 47 11.000 -3.153 0.087 1.00 0.00 C ATOM 0 H LEU A 47 13.402 -6.361 2.043 1.00 0.00 H new ATOM 0 HA LEU A 47 10.912 -6.028 3.552 1.00 0.00 H new ATOM 0 HB2 LEU A 47 10.175 -5.583 0.813 1.00 0.00 H new ATOM 0 HB3 LEU A 47 9.910 -4.526 2.186 1.00 0.00 H new ATOM 0 HG LEU A 47 12.143 -3.512 1.889 1.00 0.00 H new ATOM 0 HD11 LEU A 47 13.535 -4.118 -0.067 1.00 0.00 H new ATOM 0 HD12 LEU A 47 13.315 -5.512 1.017 1.00 0.00 H new ATOM 0 HD13 LEU A 47 12.380 -5.402 -0.494 1.00 0.00 H new ATOM 0 HD21 LEU A 47 11.719 -2.443 -0.323 1.00 0.00 H new ATOM 0 HD22 LEU A 47 10.569 -3.741 -0.723 1.00 0.00 H new ATOM 0 HD23 LEU A 47 10.208 -2.610 0.603 1.00 0.00 H new ATOM 750 N ALA A 48 10.196 -8.226 2.537 1.00 0.00 N ATOM 751 CA ALA A 48 9.897 -9.576 1.994 1.00 0.00 C ATOM 752 C ALA A 48 8.579 -9.492 1.227 1.00 0.00 C ATOM 753 O ALA A 48 7.661 -8.806 1.628 1.00 0.00 O ATOM 754 CB ALA A 48 9.790 -10.593 3.137 1.00 0.00 C ATOM 0 H ALA A 48 9.640 -7.949 3.346 1.00 0.00 H new ATOM 0 HA ALA A 48 10.696 -9.904 1.329 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.571 -11.579 2.727 1.00 0.00 H new ATOM 0 HB2 ALA A 48 10.733 -10.628 3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 48 8.990 -10.296 3.815 1.00 0.00 H new ATOM 760 N PHE A 49 8.484 -10.156 0.111 1.00 0.00 N ATOM 761 CA PHE A 49 7.231 -10.081 -0.688 1.00 0.00 C ATOM 762 C PHE A 49 6.915 -11.441 -1.295 1.00 0.00 C ATOM 763 O PHE A 49 7.706 -11.984 -2.042 1.00 0.00 O ATOM 764 CB PHE A 49 7.436 -9.090 -1.829 1.00 0.00 C ATOM 765 CG PHE A 49 6.747 -7.787 -1.524 1.00 0.00 C ATOM 766 CD1 PHE A 49 7.427 -6.787 -0.824 1.00 0.00 C ATOM 767 CD2 PHE A 49 5.439 -7.568 -1.969 1.00 0.00 C ATOM 768 CE1 PHE A 49 6.799 -5.565 -0.571 1.00 0.00 C ATOM 769 CE2 PHE A 49 4.809 -6.348 -1.712 1.00 0.00 C ATOM 770 CZ PHE A 49 5.490 -5.345 -1.015 1.00 0.00 C ATOM 0 H PHE A 49 9.217 -10.746 -0.282 1.00 0.00 H new ATOM 0 HA PHE A 49 6.413 -9.768 -0.039 1.00 0.00 H new ATOM 0 HB2 PHE A 49 8.501 -8.918 -1.982 1.00 0.00 H new ATOM 0 HB3 PHE A 49 7.044 -9.507 -2.756 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.436 -6.958 -0.479 1.00 0.00 H new ATOM 0 HD2 PHE A 49 4.916 -8.342 -2.511 1.00 0.00 H new ATOM 0 HE1 PHE A 49 7.324 -4.790 -0.033 1.00 0.00 H new ATOM 0 HE2 PHE A 49 3.798 -6.180 -2.051 1.00 0.00 H new ATOM 0 HZ PHE A 49 5.005 -4.400 -0.819 1.00 0.00 H new ATOM 780 N GLU A 50 5.765 -11.990 -1.010 1.00 0.00 N ATOM 781 CA GLU A 50 5.420 -13.312 -1.621 1.00 0.00 C ATOM 782 C GLU A 50 4.007 -13.208 -2.225 1.00 0.00 C ATOM 783 O GLU A 50 3.141 -12.633 -1.618 1.00 0.00 O ATOM 784 CB GLU A 50 5.499 -14.402 -0.538 1.00 0.00 C ATOM 785 CG GLU A 50 5.074 -15.765 -1.101 1.00 0.00 C ATOM 786 CD GLU A 50 6.245 -16.386 -1.865 1.00 0.00 C ATOM 787 OE1 GLU A 50 7.088 -15.637 -2.328 1.00 0.00 O ATOM 788 OE2 GLU A 50 6.276 -17.601 -1.975 1.00 0.00 O ATOM 0 H GLU A 50 5.058 -11.591 -0.392 1.00 0.00 H new ATOM 0 HA GLU A 50 6.119 -13.579 -2.413 1.00 0.00 H new ATOM 0 HB2 GLU A 50 6.517 -14.464 -0.153 1.00 0.00 H new ATOM 0 HB3 GLU A 50 4.857 -14.134 0.301 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.763 -16.425 -0.291 1.00 0.00 H new ATOM 0 HG3 GLU A 50 4.216 -15.646 -1.762 1.00 0.00 H new ATOM 795 N PRO A 51 3.771 -13.720 -3.423 1.00 0.00 N ATOM 796 CA PRO A 51 2.422 -13.647 -4.077 1.00 0.00 C ATOM 797 C PRO A 51 1.469 -14.773 -3.636 1.00 0.00 C ATOM 798 O PRO A 51 1.864 -15.915 -3.503 1.00 0.00 O ATOM 799 CB PRO A 51 2.754 -13.795 -5.550 1.00 0.00 C ATOM 800 CG PRO A 51 3.945 -14.695 -5.579 1.00 0.00 C ATOM 801 CD PRO A 51 4.741 -14.407 -4.300 1.00 0.00 C ATOM 0 HA PRO A 51 1.899 -12.727 -3.816 1.00 0.00 H new ATOM 0 HB2 PRO A 51 1.919 -14.225 -6.103 1.00 0.00 H new ATOM 0 HB3 PRO A 51 2.975 -12.830 -6.005 1.00 0.00 H new ATOM 0 HG2 PRO A 51 3.640 -15.741 -5.619 1.00 0.00 H new ATOM 0 HG3 PRO A 51 4.552 -14.506 -6.464 1.00 0.00 H new ATOM 0 HD2 PRO A 51 5.110 -15.326 -3.844 1.00 0.00 H new ATOM 0 HD3 PRO A 51 5.609 -13.780 -4.503 1.00 0.00 H new ATOM 809 N PHE A 52 0.222 -14.453 -3.394 1.00 0.00 N ATOM 810 CA PHE A 52 -0.758 -15.493 -2.943 1.00 0.00 C ATOM 811 C PHE A 52 -2.079 -14.828 -2.518 1.00 0.00 C ATOM 812 O PHE A 52 -2.241 -13.627 -2.602 1.00 0.00 O ATOM 813 CB PHE A 52 -0.189 -16.264 -1.742 1.00 0.00 C ATOM 814 CG PHE A 52 0.725 -15.377 -0.910 1.00 0.00 C ATOM 815 CD1 PHE A 52 1.714 -15.963 -0.108 1.00 0.00 C ATOM 816 CD2 PHE A 52 0.595 -13.979 -0.932 1.00 0.00 C ATOM 817 CE1 PHE A 52 2.565 -15.155 0.658 1.00 0.00 C ATOM 818 CE2 PHE A 52 1.446 -13.181 -0.168 1.00 0.00 C ATOM 819 CZ PHE A 52 2.430 -13.762 0.622 1.00 0.00 C ATOM 0 H PHE A 52 -0.162 -13.513 -3.489 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.940 -16.177 -3.772 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.006 -16.634 -1.122 1.00 0.00 H new ATOM 0 HB3 PHE A 52 0.364 -17.135 -2.093 1.00 0.00 H new ATOM 0 HD1 PHE A 52 1.820 -17.037 -0.080 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.168 -13.520 -1.543 1.00 0.00 H new ATOM 0 HE1 PHE A 52 3.326 -15.607 1.277 1.00 0.00 H new ATOM 0 HE2 PHE A 52 1.340 -12.106 -0.191 1.00 0.00 H new ATOM 0 HZ PHE A 52 3.090 -13.140 1.208 1.00 0.00 H new ATOM 829 N VAL A 53 -3.007 -15.609 -2.017 1.00 0.00 N ATOM 830 CA VAL A 53 -4.303 -15.044 -1.529 1.00 0.00 C ATOM 831 C VAL A 53 -4.180 -14.895 -0.009 1.00 0.00 C ATOM 832 O VAL A 53 -3.539 -15.701 0.636 1.00 0.00 O ATOM 833 CB VAL A 53 -5.457 -15.993 -1.896 1.00 0.00 C ATOM 834 CG1 VAL A 53 -4.890 -17.282 -2.493 1.00 0.00 C ATOM 835 CG2 VAL A 53 -6.290 -16.334 -0.653 1.00 0.00 C ATOM 0 H VAL A 53 -2.920 -16.621 -1.925 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.515 -14.079 -1.989 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.097 -15.497 -2.625 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.708 -17.954 -2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -4.316 -17.046 -3.389 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -4.241 -17.766 -1.763 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.102 -17.006 -0.932 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.655 -16.820 0.088 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.706 -15.419 -0.231 1.00 0.00 H new ATOM 845 N GLY A 54 -4.724 -13.860 0.582 1.00 0.00 N ATOM 846 CA GLY A 54 -4.530 -13.709 2.054 1.00 0.00 C ATOM 847 C GLY A 54 -3.032 -13.506 2.222 1.00 0.00 C ATOM 848 O GLY A 54 -2.400 -13.987 3.142 1.00 0.00 O ATOM 0 H GLY A 54 -5.277 -13.135 0.125 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.092 -12.860 2.443 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -4.874 -14.592 2.592 1.00 0.00 H new ATOM 852 N GLY A 55 -2.471 -12.860 1.244 1.00 0.00 N ATOM 853 CA GLY A 55 -1.008 -12.650 1.166 1.00 0.00 C ATOM 854 C GLY A 55 -0.454 -11.666 2.189 1.00 0.00 C ATOM 855 O GLY A 55 -1.169 -11.080 2.977 1.00 0.00 O ATOM 0 H GLY A 55 -2.991 -12.454 0.466 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -0.509 -13.610 1.297 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.758 -12.294 0.166 1.00 0.00 H new ATOM 859 N ARG A 56 0.852 -11.491 2.169 1.00 0.00 N ATOM 860 CA ARG A 56 1.493 -10.556 3.130 1.00 0.00 C ATOM 861 C ARG A 56 2.760 -9.906 2.535 1.00 0.00 C ATOM 862 O ARG A 56 3.533 -10.518 1.787 1.00 0.00 O ATOM 863 CB ARG A 56 1.882 -11.325 4.396 1.00 0.00 C ATOM 864 CG ARG A 56 0.623 -11.833 5.103 1.00 0.00 C ATOM 865 CD ARG A 56 1.014 -12.483 6.432 1.00 0.00 C ATOM 866 NE ARG A 56 -0.178 -13.151 7.028 1.00 0.00 N ATOM 867 CZ ARG A 56 -0.195 -13.442 8.299 1.00 0.00 C ATOM 868 NH1 ARG A 56 -1.238 -14.026 8.821 1.00 0.00 N ATOM 869 NH2 ARG A 56 0.832 -13.148 9.050 1.00 0.00 N ATOM 0 H ARG A 56 1.492 -11.959 1.527 1.00 0.00 H new ATOM 0 HA ARG A 56 0.777 -9.766 3.359 1.00 0.00 H new ATOM 0 HB2 ARG A 56 2.529 -12.164 4.138 1.00 0.00 H new ATOM 0 HB3 ARG A 56 2.450 -10.678 5.065 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -0.067 -11.008 5.278 1.00 0.00 H new ATOM 0 HG3 ARG A 56 0.104 -12.554 4.472 1.00 0.00 H new ATOM 0 HD2 ARG A 56 1.810 -13.210 6.273 1.00 0.00 H new ATOM 0 HD3 ARG A 56 1.403 -11.730 7.117 1.00 0.00 H new ATOM 0 HE ARG A 56 -0.980 -13.380 6.442 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -2.041 -14.255 8.235 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -1.251 -14.253 9.815 1.00 0.00 H new ATOM 0 HH21 ARG A 56 1.648 -12.691 8.642 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.819 -13.376 10.044 1.00 0.00 H new ATOM 883 N TYR A 57 2.986 -8.670 2.916 1.00 0.00 N ATOM 884 CA TYR A 57 4.199 -7.927 2.478 1.00 0.00 C ATOM 885 C TYR A 57 4.974 -7.554 3.749 1.00 0.00 C ATOM 886 O TYR A 57 4.383 -7.229 4.773 1.00 0.00 O ATOM 887 CB TYR A 57 3.811 -6.665 1.702 1.00 0.00 C ATOM 888 CG TYR A 57 2.873 -7.004 0.558 1.00 0.00 C ATOM 889 CD1 TYR A 57 1.729 -6.222 0.355 1.00 0.00 C ATOM 890 CD2 TYR A 57 3.142 -8.083 -0.303 1.00 0.00 C ATOM 891 CE1 TYR A 57 0.856 -6.514 -0.699 1.00 0.00 C ATOM 892 CE2 TYR A 57 2.266 -8.373 -1.355 1.00 0.00 C ATOM 893 CZ TYR A 57 1.123 -7.589 -1.553 1.00 0.00 C ATOM 894 OH TYR A 57 0.261 -7.877 -2.591 1.00 0.00 O ATOM 0 H TYR A 57 2.364 -8.139 3.525 1.00 0.00 H new ATOM 0 HA TYR A 57 4.807 -8.540 1.813 1.00 0.00 H new ATOM 0 HB2 TYR A 57 3.331 -5.953 2.373 1.00 0.00 H new ATOM 0 HB3 TYR A 57 4.707 -6.182 1.313 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.520 -5.392 1.013 1.00 0.00 H new ATOM 0 HD2 TYR A 57 4.024 -8.687 -0.152 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -0.025 -5.909 -0.853 1.00 0.00 H new ATOM 0 HE2 TYR A 57 2.472 -9.203 -2.015 1.00 0.00 H new ATOM 0 HH TYR A 57 0.595 -8.653 -3.087 1.00 0.00 H new ATOM 904 N TYR A 58 6.279 -7.642 3.717 1.00 0.00 N ATOM 905 CA TYR A 58 7.076 -7.356 4.945 1.00 0.00 C ATOM 906 C TYR A 58 8.088 -6.230 4.718 1.00 0.00 C ATOM 907 O TYR A 58 8.634 -6.070 3.647 1.00 0.00 O ATOM 908 CB TYR A 58 7.825 -8.631 5.318 1.00 0.00 C ATOM 909 CG TYR A 58 6.842 -9.774 5.401 1.00 0.00 C ATOM 910 CD1 TYR A 58 6.492 -10.307 6.645 1.00 0.00 C ATOM 911 CD2 TYR A 58 6.267 -10.290 4.233 1.00 0.00 C ATOM 912 CE1 TYR A 58 5.569 -11.356 6.721 1.00 0.00 C ATOM 913 CE2 TYR A 58 5.346 -11.335 4.307 1.00 0.00 C ATOM 914 CZ TYR A 58 4.993 -11.870 5.552 1.00 0.00 C ATOM 915 OH TYR A 58 4.083 -12.904 5.627 1.00 0.00 O ATOM 0 H TYR A 58 6.825 -7.899 2.895 1.00 0.00 H new ATOM 0 HA TYR A 58 6.401 -7.037 5.739 1.00 0.00 H new ATOM 0 HB2 TYR A 58 8.592 -8.848 4.575 1.00 0.00 H new ATOM 0 HB3 TYR A 58 8.334 -8.502 6.273 1.00 0.00 H new ATOM 0 HD1 TYR A 58 6.934 -9.909 7.547 1.00 0.00 H new ATOM 0 HD2 TYR A 58 6.537 -9.878 3.272 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.300 -11.770 7.682 1.00 0.00 H new ATOM 0 HE2 TYR A 58 4.905 -11.731 3.404 1.00 0.00 H new ATOM 0 HH TYR A 58 3.954 -13.159 6.564 1.00 0.00 H new ATOM 925 N GLU A 59 8.346 -5.465 5.747 1.00 0.00 N ATOM 926 CA GLU A 59 9.334 -4.349 5.655 1.00 0.00 C ATOM 927 C GLU A 59 10.331 -4.486 6.804 1.00 0.00 C ATOM 928 O GLU A 59 9.975 -4.857 7.905 1.00 0.00 O ATOM 929 CB GLU A 59 8.604 -3.007 5.765 1.00 0.00 C ATOM 930 CG GLU A 59 9.605 -1.854 5.689 1.00 0.00 C ATOM 931 CD GLU A 59 8.868 -0.537 5.934 1.00 0.00 C ATOM 932 OE1 GLU A 59 7.649 -0.568 5.998 1.00 0.00 O ATOM 933 OE2 GLU A 59 9.530 0.477 6.064 1.00 0.00 O ATOM 0 H GLU A 59 7.907 -5.568 6.662 1.00 0.00 H new ATOM 0 HA GLU A 59 9.858 -4.391 4.700 1.00 0.00 H new ATOM 0 HB2 GLU A 59 7.872 -2.916 4.963 1.00 0.00 H new ATOM 0 HB3 GLU A 59 8.054 -2.960 6.705 1.00 0.00 H new ATOM 0 HG2 GLU A 59 10.392 -1.989 6.432 1.00 0.00 H new ATOM 0 HG3 GLU A 59 10.088 -1.839 4.712 1.00 0.00 H new ATOM 940 N TRP A 60 11.575 -4.186 6.562 1.00 0.00 N ATOM 941 CA TRP A 60 12.590 -4.296 7.644 1.00 0.00 C ATOM 942 C TRP A 60 13.002 -2.904 8.084 1.00 0.00 C ATOM 943 O TRP A 60 13.389 -2.089 7.268 1.00 0.00 O ATOM 944 CB TRP A 60 13.838 -4.984 7.096 1.00 0.00 C ATOM 945 CG TRP A 60 13.947 -6.368 7.620 1.00 0.00 C ATOM 946 CD1 TRP A 60 14.118 -6.703 8.920 1.00 0.00 C ATOM 947 CD2 TRP A 60 13.906 -7.610 6.869 1.00 0.00 C ATOM 948 NE1 TRP A 60 14.190 -8.084 9.010 1.00 0.00 N ATOM 949 CE2 TRP A 60 14.053 -8.686 7.768 1.00 0.00 C ATOM 950 CE3 TRP A 60 13.750 -7.901 5.502 1.00 0.00 C ATOM 951 CZ2 TRP A 60 14.044 -10.009 7.324 1.00 0.00 C ATOM 952 CZ3 TRP A 60 13.743 -9.228 5.053 1.00 0.00 C ATOM 953 CH2 TRP A 60 13.886 -10.281 5.961 1.00 0.00 C ATOM 0 H TRP A 60 11.933 -3.869 5.661 1.00 0.00 H new ATOM 0 HA TRP A 60 12.166 -4.860 8.474 1.00 0.00 H new ATOM 0 HB2 TRP A 60 13.800 -5.004 6.007 1.00 0.00 H new ATOM 0 HB3 TRP A 60 14.725 -4.414 7.373 1.00 0.00 H new ATOM 0 HD1 TRP A 60 14.187 -6.012 9.747 1.00 0.00 H new ATOM 0 HE1 TRP A 60 14.327 -8.595 9.882 1.00 0.00 H new ATOM 0 HE3 TRP A 60 13.635 -7.095 4.793 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 14.158 -10.819 8.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 13.627 -9.438 4.000 1.00 0.00 H new ATOM 0 HH2 TRP A 60 13.875 -11.303 5.611 1.00 0.00 H new ATOM 964 N ASP A 61 12.978 -2.626 9.361 1.00 0.00 N ATOM 965 CA ASP A 61 13.436 -1.278 9.806 1.00 0.00 C ATOM 966 C ASP A 61 14.835 -1.438 10.404 1.00 0.00 C ATOM 967 O ASP A 61 15.103 -2.380 11.132 1.00 0.00 O ATOM 968 CB ASP A 61 12.484 -0.704 10.844 1.00 0.00 C ATOM 969 CG ASP A 61 12.782 0.783 11.040 1.00 0.00 C ATOM 970 OD1 ASP A 61 13.227 1.406 10.090 1.00 0.00 O ATOM 971 OD2 ASP A 61 12.561 1.273 12.135 1.00 0.00 O ATOM 0 H ASP A 61 12.669 -3.258 10.100 1.00 0.00 H new ATOM 0 HA ASP A 61 13.456 -0.590 8.961 1.00 0.00 H new ATOM 0 HB2 ASP A 61 11.452 -0.840 10.521 1.00 0.00 H new ATOM 0 HB3 ASP A 61 12.595 -1.236 11.789 1.00 0.00 H new ATOM 976 N ILE A 62 15.732 -0.545 10.079 1.00 0.00 N ATOM 977 CA ILE A 62 17.129 -0.656 10.588 1.00 0.00 C ATOM 978 C ILE A 62 17.140 -0.827 12.107 1.00 0.00 C ATOM 979 O ILE A 62 17.968 -1.531 12.649 1.00 0.00 O ATOM 980 CB ILE A 62 17.927 0.597 10.203 1.00 0.00 C ATOM 981 CG1 ILE A 62 17.389 1.841 10.930 1.00 0.00 C ATOM 982 CG2 ILE A 62 17.848 0.821 8.698 1.00 0.00 C ATOM 983 CD1 ILE A 62 15.933 2.135 10.535 1.00 0.00 C ATOM 0 H ILE A 62 15.555 0.261 9.479 1.00 0.00 H new ATOM 0 HA ILE A 62 17.591 -1.534 10.136 1.00 0.00 H new ATOM 0 HB ILE A 62 18.964 0.440 10.500 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.452 1.690 12.008 1.00 0.00 H new ATOM 0 HG13 ILE A 62 18.013 2.702 10.692 1.00 0.00 H new ATOM 0 HG21 ILE A 62 18.417 1.712 8.432 1.00 0.00 H new ATOM 0 HG22 ILE A 62 18.264 -0.043 8.179 1.00 0.00 H new ATOM 0 HG23 ILE A 62 16.807 0.954 8.404 1.00 0.00 H new ATOM 0 HD11 ILE A 62 15.583 3.020 11.066 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.876 2.311 9.461 1.00 0.00 H new ATOM 0 HD13 ILE A 62 15.306 1.283 10.797 1.00 0.00 H new ATOM 995 N ASP A 63 16.230 -0.207 12.797 1.00 0.00 N ATOM 996 CA ASP A 63 16.192 -0.355 14.275 1.00 0.00 C ATOM 997 C ASP A 63 15.040 -1.282 14.637 1.00 0.00 C ATOM 998 O ASP A 63 14.956 -1.781 15.742 1.00 0.00 O ATOM 999 CB ASP A 63 15.975 1.013 14.924 1.00 0.00 C ATOM 1000 CG ASP A 63 17.195 1.900 14.667 1.00 0.00 C ATOM 1001 OD1 ASP A 63 18.208 1.371 14.237 1.00 0.00 O ATOM 1002 OD2 ASP A 63 17.098 3.092 14.905 1.00 0.00 O ATOM 0 H ASP A 63 15.509 0.397 12.402 1.00 0.00 H new ATOM 0 HA ASP A 63 17.134 -0.770 14.634 1.00 0.00 H new ATOM 0 HB2 ASP A 63 15.079 1.482 14.517 1.00 0.00 H new ATOM 0 HB3 ASP A 63 15.816 0.897 15.996 1.00 0.00 H new ATOM 1007 N GLY A 64 14.150 -1.511 13.709 1.00 0.00 N ATOM 1008 CA GLY A 64 12.998 -2.401 13.989 1.00 0.00 C ATOM 1009 C GLY A 64 13.092 -3.686 13.175 1.00 0.00 C ATOM 1010 O GLY A 64 13.432 -3.699 12.008 1.00 0.00 O ATOM 0 H GLY A 64 14.175 -1.117 12.769 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.969 -2.641 15.052 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.068 -1.884 13.753 1.00 0.00 H new ATOM 1014 N THR A 65 12.752 -4.755 13.809 1.00 0.00 N ATOM 1015 CA THR A 65 12.745 -6.098 13.182 1.00 0.00 C ATOM 1016 C THR A 65 11.783 -6.117 11.987 1.00 0.00 C ATOM 1017 O THR A 65 11.195 -5.106 11.623 1.00 0.00 O ATOM 1018 CB THR A 65 12.280 -7.108 14.232 1.00 0.00 C ATOM 1019 OG1 THR A 65 13.003 -6.900 15.437 1.00 0.00 O ATOM 1020 CG2 THR A 65 12.513 -8.534 13.740 1.00 0.00 C ATOM 0 H THR A 65 12.463 -4.757 14.787 1.00 0.00 H new ATOM 0 HA THR A 65 13.744 -6.350 12.825 1.00 0.00 H new ATOM 0 HB THR A 65 11.214 -6.967 14.409 1.00 0.00 H new ATOM 0 HG1 THR A 65 12.706 -7.545 16.112 1.00 0.00 H new ATOM 0 HG21 THR A 65 12.177 -9.240 14.499 1.00 0.00 H new ATOM 0 HG22 THR A 65 11.953 -8.697 12.819 1.00 0.00 H new ATOM 0 HG23 THR A 65 13.576 -8.684 13.550 1.00 0.00 H new ATOM 1028 N GLU A 66 11.652 -7.257 11.357 1.00 0.00 N ATOM 1029 CA GLU A 66 10.738 -7.385 10.187 1.00 0.00 C ATOM 1030 C GLU A 66 9.296 -7.461 10.694 1.00 0.00 C ATOM 1031 O GLU A 66 9.028 -8.018 11.740 1.00 0.00 O ATOM 1032 CB GLU A 66 11.032 -8.685 9.446 1.00 0.00 C ATOM 1033 CG GLU A 66 10.327 -8.664 8.101 1.00 0.00 C ATOM 1034 CD GLU A 66 10.486 -10.021 7.414 1.00 0.00 C ATOM 1035 OE1 GLU A 66 11.103 -10.893 8.004 1.00 0.00 O ATOM 1036 OE2 GLU A 66 9.989 -10.166 6.310 1.00 0.00 O ATOM 0 H GLU A 66 12.146 -8.113 11.608 1.00 0.00 H new ATOM 0 HA GLU A 66 10.881 -6.530 9.526 1.00 0.00 H new ATOM 0 HB2 GLU A 66 12.106 -8.802 9.305 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.693 -9.538 10.034 1.00 0.00 H new ATOM 0 HG2 GLU A 66 9.270 -8.436 8.237 1.00 0.00 H new ATOM 0 HG3 GLU A 66 10.744 -7.877 7.473 1.00 0.00 H new ATOM 1043 N ILE A 67 8.362 -6.924 9.962 1.00 0.00 N ATOM 1044 CA ILE A 67 6.942 -6.991 10.415 1.00 0.00 C ATOM 1045 C ILE A 67 5.994 -6.989 9.213 1.00 0.00 C ATOM 1046 O ILE A 67 6.378 -6.680 8.102 1.00 0.00 O ATOM 1047 CB ILE A 67 6.633 -5.800 11.315 1.00 0.00 C ATOM 1048 CG1 ILE A 67 7.036 -4.515 10.602 1.00 0.00 C ATOM 1049 CG2 ILE A 67 7.409 -5.931 12.623 1.00 0.00 C ATOM 1050 CD1 ILE A 67 6.376 -3.322 11.292 1.00 0.00 C ATOM 0 H ILE A 67 8.516 -6.444 9.075 1.00 0.00 H new ATOM 0 HA ILE A 67 6.797 -7.916 10.972 1.00 0.00 H new ATOM 0 HB ILE A 67 5.566 -5.774 11.535 1.00 0.00 H new ATOM 0 HG12 ILE A 67 8.120 -4.403 10.616 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.734 -4.557 9.556 1.00 0.00 H new ATOM 0 HG21 ILE A 67 7.187 -5.079 13.265 1.00 0.00 H new ATOM 0 HG22 ILE A 67 7.117 -6.852 13.128 1.00 0.00 H new ATOM 0 HG23 ILE A 67 8.478 -5.956 12.411 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.664 -2.402 10.783 1.00 0.00 H new ATOM 0 HD12 ILE A 67 5.292 -3.434 11.255 1.00 0.00 H new ATOM 0 HD13 ILE A 67 6.700 -3.278 12.332 1.00 0.00 H new ATOM 1062 N VAL A 68 4.749 -7.321 9.436 1.00 0.00 N ATOM 1063 CA VAL A 68 3.759 -7.325 8.320 1.00 0.00 C ATOM 1064 C VAL A 68 2.895 -6.074 8.437 1.00 0.00 C ATOM 1065 O VAL A 68 2.317 -5.815 9.475 1.00 0.00 O ATOM 1066 CB VAL A 68 2.859 -8.557 8.430 1.00 0.00 C ATOM 1067 CG1 VAL A 68 1.941 -8.627 7.209 1.00 0.00 C ATOM 1068 CG2 VAL A 68 3.720 -9.819 8.493 1.00 0.00 C ATOM 0 H VAL A 68 4.375 -7.590 10.346 1.00 0.00 H new ATOM 0 HA VAL A 68 4.283 -7.344 7.364 1.00 0.00 H new ATOM 0 HB VAL A 68 2.257 -8.485 9.336 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.299 -9.505 7.286 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.324 -7.729 7.165 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.544 -8.697 6.304 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.076 -10.695 8.571 1.00 0.00 H new ATOM 0 HG22 VAL A 68 4.324 -9.893 7.589 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.374 -9.770 9.364 1.00 0.00 H new ATOM 1078 N TRP A 69 2.807 -5.286 7.396 1.00 0.00 N ATOM 1079 CA TRP A 69 1.979 -4.041 7.485 1.00 0.00 C ATOM 1080 C TRP A 69 0.731 -4.133 6.605 1.00 0.00 C ATOM 1081 O TRP A 69 -0.022 -3.185 6.501 1.00 0.00 O ATOM 1082 CB TRP A 69 2.807 -2.836 7.049 1.00 0.00 C ATOM 1083 CG TRP A 69 4.032 -3.291 6.334 1.00 0.00 C ATOM 1084 CD1 TRP A 69 5.196 -3.624 6.929 1.00 0.00 C ATOM 1085 CD2 TRP A 69 4.240 -3.454 4.903 1.00 0.00 C ATOM 1086 NE1 TRP A 69 6.109 -3.977 5.955 1.00 0.00 N ATOM 1087 CE2 TRP A 69 5.568 -3.884 4.689 1.00 0.00 C ATOM 1088 CE3 TRP A 69 3.415 -3.269 3.782 1.00 0.00 C ATOM 1089 CZ2 TRP A 69 6.061 -4.119 3.407 1.00 0.00 C ATOM 1090 CZ3 TRP A 69 3.908 -3.506 2.490 1.00 0.00 C ATOM 1091 CH2 TRP A 69 5.230 -3.928 2.304 1.00 0.00 C ATOM 0 H TRP A 69 3.265 -5.446 6.499 1.00 0.00 H new ATOM 0 HA TRP A 69 1.664 -3.927 8.522 1.00 0.00 H new ATOM 0 HB2 TRP A 69 2.214 -2.193 6.398 1.00 0.00 H new ATOM 0 HB3 TRP A 69 3.084 -2.241 7.919 1.00 0.00 H new ATOM 0 HD1 TRP A 69 5.383 -3.616 7.993 1.00 0.00 H new ATOM 0 HE1 TRP A 69 7.067 -4.271 6.148 1.00 0.00 H new ATOM 0 HE3 TRP A 69 2.394 -2.942 3.915 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 7.081 -4.447 3.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 3.265 -3.362 1.635 1.00 0.00 H new ATOM 0 HH2 TRP A 69 5.606 -4.105 1.307 1.00 0.00 H new ATOM 1102 N GLY A 70 0.500 -5.236 5.953 1.00 0.00 N ATOM 1103 CA GLY A 70 -0.703 -5.314 5.075 1.00 0.00 C ATOM 1104 C GLY A 70 -1.071 -6.768 4.793 1.00 0.00 C ATOM 1105 O GLY A 70 -0.518 -7.685 5.360 1.00 0.00 O ATOM 0 H GLY A 70 1.079 -6.075 5.987 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.542 -4.807 5.553 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.509 -4.794 4.137 1.00 0.00 H new ATOM 1109 N ARG A 71 -2.018 -6.973 3.921 1.00 0.00 N ATOM 1110 CA ARG A 71 -2.452 -8.346 3.572 1.00 0.00 C ATOM 1111 C ARG A 71 -3.019 -8.321 2.151 1.00 0.00 C ATOM 1112 O ARG A 71 -3.055 -7.293 1.505 1.00 0.00 O ATOM 1113 CB ARG A 71 -3.525 -8.842 4.551 1.00 0.00 C ATOM 1114 CG ARG A 71 -3.257 -10.307 4.905 1.00 0.00 C ATOM 1115 CD ARG A 71 -4.400 -10.846 5.767 1.00 0.00 C ATOM 1116 NE ARG A 71 -5.627 -10.985 4.933 1.00 0.00 N ATOM 1117 CZ ARG A 71 -6.804 -10.973 5.496 1.00 0.00 C ATOM 1118 NH1 ARG A 71 -7.878 -11.093 4.765 1.00 0.00 N ATOM 1119 NH2 ARG A 71 -6.907 -10.840 6.791 1.00 0.00 N ATOM 0 H ARG A 71 -2.516 -6.231 3.429 1.00 0.00 H new ATOM 0 HA ARG A 71 -1.601 -9.025 3.633 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.518 -8.232 5.454 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.514 -8.740 4.105 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -3.164 -10.900 3.995 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -2.312 -10.395 5.441 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -4.125 -11.811 6.193 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -4.589 -10.172 6.602 1.00 0.00 H new ATOM 0 HE ARG A 71 -5.547 -11.090 3.922 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -7.798 -11.196 3.753 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -8.798 -11.084 5.205 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -6.067 -10.745 7.362 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -7.827 -10.831 7.231 1.00 0.00 H new ATOM 1133 N ILE A 72 -3.474 -9.431 1.676 1.00 0.00 N ATOM 1134 CA ILE A 72 -4.064 -9.485 0.311 1.00 0.00 C ATOM 1135 C ILE A 72 -5.374 -10.278 0.396 1.00 0.00 C ATOM 1136 O ILE A 72 -5.645 -10.898 1.395 1.00 0.00 O ATOM 1137 CB ILE A 72 -3.088 -10.165 -0.662 1.00 0.00 C ATOM 1138 CG1 ILE A 72 -1.969 -9.185 -1.047 1.00 0.00 C ATOM 1139 CG2 ILE A 72 -3.827 -10.596 -1.930 1.00 0.00 C ATOM 1140 CD1 ILE A 72 -0.939 -9.090 0.082 1.00 0.00 C ATOM 0 H ILE A 72 -3.466 -10.320 2.176 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.257 -8.478 -0.059 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.661 -11.040 -0.173 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.484 -9.518 -1.965 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.391 -8.200 -1.248 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.127 -11.077 -2.613 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.619 -11.298 -1.669 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.262 -9.721 -2.413 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.151 -8.393 -0.202 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.426 -8.736 0.990 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.505 -10.074 0.263 1.00 0.00 H new ATOM 1152 N LEU A 73 -6.202 -10.242 -0.616 1.00 0.00 N ATOM 1153 CA LEU A 73 -7.486 -11.000 -0.566 1.00 0.00 C ATOM 1154 C LEU A 73 -7.456 -12.115 -1.612 1.00 0.00 C ATOM 1155 O LEU A 73 -7.699 -13.268 -1.320 1.00 0.00 O ATOM 1156 CB LEU A 73 -8.649 -10.053 -0.860 1.00 0.00 C ATOM 1157 CG LEU A 73 -9.009 -9.290 0.416 1.00 0.00 C ATOM 1158 CD1 LEU A 73 -9.611 -7.934 0.051 1.00 0.00 C ATOM 1159 CD2 LEU A 73 -10.029 -10.098 1.228 1.00 0.00 C ATOM 0 H LEU A 73 -6.043 -9.719 -1.477 1.00 0.00 H new ATOM 0 HA LEU A 73 -7.616 -11.434 0.425 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -8.375 -9.355 -1.651 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.511 -10.616 -1.217 1.00 0.00 H new ATOM 0 HG LEU A 73 -8.108 -9.139 1.011 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.867 -7.392 0.962 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -8.886 -7.357 -0.523 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -10.510 -8.084 -0.546 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -10.284 -9.553 2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -10.929 -10.252 0.632 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -9.600 -11.064 1.493 1.00 0.00 H new ATOM 1171 N GLU A 74 -7.156 -11.757 -2.831 1.00 0.00 N ATOM 1172 CA GLU A 74 -7.100 -12.756 -3.937 1.00 0.00 C ATOM 1173 C GLU A 74 -6.679 -12.038 -5.221 1.00 0.00 C ATOM 1174 O GLU A 74 -6.809 -10.835 -5.336 1.00 0.00 O ATOM 1175 CB GLU A 74 -8.483 -13.390 -4.138 1.00 0.00 C ATOM 1176 CG GLU A 74 -9.460 -12.339 -4.671 1.00 0.00 C ATOM 1177 CD GLU A 74 -10.872 -12.928 -4.706 1.00 0.00 C ATOM 1178 OE1 GLU A 74 -11.006 -14.109 -4.427 1.00 0.00 O ATOM 1179 OE2 GLU A 74 -11.793 -12.191 -5.013 1.00 0.00 O ATOM 0 H GLU A 74 -6.944 -10.800 -3.112 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.384 -13.540 -3.690 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.413 -14.223 -4.837 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.849 -13.795 -3.194 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.440 -11.453 -4.037 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.161 -12.023 -5.670 1.00 0.00 H new ATOM 1186 N TRP A 75 -6.179 -12.760 -6.187 1.00 0.00 N ATOM 1187 CA TRP A 75 -5.753 -12.110 -7.459 1.00 0.00 C ATOM 1188 C TRP A 75 -6.741 -12.468 -8.572 1.00 0.00 C ATOM 1189 O TRP A 75 -7.066 -13.621 -8.778 1.00 0.00 O ATOM 1190 CB TRP A 75 -4.355 -12.605 -7.833 1.00 0.00 C ATOM 1191 CG TRP A 75 -4.419 -14.051 -8.208 1.00 0.00 C ATOM 1192 CD1 TRP A 75 -4.608 -15.071 -7.340 1.00 0.00 C ATOM 1193 CD2 TRP A 75 -4.289 -14.656 -9.527 1.00 0.00 C ATOM 1194 NE1 TRP A 75 -4.607 -16.263 -8.043 1.00 0.00 N ATOM 1195 CE2 TRP A 75 -4.414 -16.059 -9.395 1.00 0.00 C ATOM 1196 CE3 TRP A 75 -4.079 -14.127 -10.814 1.00 0.00 C ATOM 1197 CZ2 TRP A 75 -4.333 -16.907 -10.499 1.00 0.00 C ATOM 1198 CZ3 TRP A 75 -3.997 -14.979 -11.928 1.00 0.00 C ATOM 1199 CH2 TRP A 75 -4.124 -16.365 -11.770 1.00 0.00 C ATOM 0 H TRP A 75 -6.047 -13.771 -6.150 1.00 0.00 H new ATOM 0 HA TRP A 75 -5.734 -11.028 -7.330 1.00 0.00 H new ATOM 0 HB2 TRP A 75 -3.961 -12.020 -8.664 1.00 0.00 H new ATOM 0 HB3 TRP A 75 -3.673 -12.466 -6.994 1.00 0.00 H new ATOM 0 HD1 TRP A 75 -4.738 -14.971 -6.273 1.00 0.00 H new ATOM 0 HE1 TRP A 75 -4.733 -17.180 -7.615 1.00 0.00 H new ATOM 0 HE3 TRP A 75 -3.980 -13.060 -10.946 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 -4.431 -17.975 -10.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 -3.835 -14.563 -12.911 1.00 0.00 H new ATOM 0 HH2 TRP A 75 -4.060 -17.015 -12.630 1.00 0.00 H new ATOM 1268 N ARG A 80 -6.699 -7.522 -12.175 1.00 0.00 N ATOM 1269 CA ARG A 80 -7.372 -6.918 -10.986 1.00 0.00 C ATOM 1270 C ARG A 80 -7.011 -7.688 -9.722 1.00 0.00 C ATOM 1271 O ARG A 80 -7.033 -8.903 -9.688 1.00 0.00 O ATOM 1272 CB ARG A 80 -8.891 -6.935 -11.199 1.00 0.00 C ATOM 1273 CG ARG A 80 -9.613 -6.798 -9.856 1.00 0.00 C ATOM 1274 CD ARG A 80 -11.102 -6.565 -10.111 1.00 0.00 C ATOM 1275 NE ARG A 80 -11.729 -7.835 -10.577 1.00 0.00 N ATOM 1276 CZ ARG A 80 -12.890 -7.809 -11.174 1.00 0.00 C ATOM 1277 NH1 ARG A 80 -13.438 -8.921 -11.581 1.00 0.00 N ATOM 1278 NH2 ARG A 80 -13.501 -6.672 -11.364 1.00 0.00 N ATOM 0 HA ARG A 80 -7.034 -5.889 -10.868 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -9.182 -6.120 -11.862 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -9.187 -7.864 -11.687 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -9.470 -7.698 -9.259 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -9.194 -5.968 -9.287 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -11.589 -6.219 -9.199 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -11.236 -5.784 -10.860 1.00 0.00 H new ATOM 0 HE ARG A 80 -11.251 -8.724 -10.429 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -12.960 -9.810 -11.433 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -14.345 -8.902 -12.047 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -13.072 -5.803 -11.046 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -14.408 -6.652 -11.830 1.00 0.00 H new ATOM 1292 N LEU A 81 -6.680 -6.978 -8.680 1.00 0.00 N ATOM 1293 CA LEU A 81 -6.314 -7.647 -7.407 1.00 0.00 C ATOM 1294 C LEU A 81 -7.009 -6.955 -6.234 1.00 0.00 C ATOM 1295 O LEU A 81 -6.940 -5.753 -6.078 1.00 0.00 O ATOM 1296 CB LEU A 81 -4.803 -7.561 -7.200 1.00 0.00 C ATOM 1297 CG LEU A 81 -4.083 -8.242 -8.358 1.00 0.00 C ATOM 1298 CD1 LEU A 81 -3.658 -7.188 -9.375 1.00 0.00 C ATOM 1299 CD2 LEU A 81 -2.845 -8.970 -7.826 1.00 0.00 C ATOM 0 H LEU A 81 -6.648 -5.959 -8.658 1.00 0.00 H new ATOM 0 HA LEU A 81 -6.627 -8.690 -7.456 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.495 -6.518 -7.132 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -4.528 -8.037 -6.259 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.749 -8.960 -8.835 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.142 -7.671 -10.205 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.539 -6.667 -9.749 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.988 -6.472 -8.899 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.327 -9.458 -8.652 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.176 -8.252 -7.352 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -3.149 -9.719 -7.095 1.00 0.00 H new ATOM 1311 N ALA A 82 -7.631 -7.716 -5.382 1.00 0.00 N ATOM 1312 CA ALA A 82 -8.280 -7.122 -4.183 1.00 0.00 C ATOM 1313 C ALA A 82 -7.376 -7.464 -3.010 1.00 0.00 C ATOM 1314 O ALA A 82 -6.741 -8.501 -3.020 1.00 0.00 O ATOM 1315 CB ALA A 82 -9.666 -7.739 -3.977 1.00 0.00 C ATOM 0 H ALA A 82 -7.719 -8.729 -5.464 1.00 0.00 H new ATOM 0 HA ALA A 82 -8.412 -6.045 -4.288 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.133 -7.298 -3.097 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -10.285 -7.544 -4.853 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.568 -8.815 -3.835 1.00 0.00 H new ATOM 1321 N MET A 83 -7.254 -6.620 -2.018 1.00 0.00 N ATOM 1322 CA MET A 83 -6.320 -6.981 -0.916 1.00 0.00 C ATOM 1323 C MET A 83 -6.812 -6.531 0.458 1.00 0.00 C ATOM 1324 O MET A 83 -7.425 -5.493 0.610 1.00 0.00 O ATOM 1325 CB MET A 83 -4.957 -6.338 -1.188 1.00 0.00 C ATOM 1326 CG MET A 83 -5.147 -5.033 -1.965 1.00 0.00 C ATOM 1327 SD MET A 83 -3.539 -4.238 -2.209 1.00 0.00 S ATOM 1328 CE MET A 83 -2.902 -5.390 -3.452 1.00 0.00 C ATOM 0 H MET A 83 -7.742 -5.729 -1.925 1.00 0.00 H new ATOM 0 HA MET A 83 -6.252 -8.069 -0.895 1.00 0.00 H new ATOM 0 HB2 MET A 83 -4.443 -6.141 -0.247 1.00 0.00 H new ATOM 0 HB3 MET A 83 -4.328 -7.023 -1.757 1.00 0.00 H new ATOM 0 HG2 MET A 83 -5.615 -5.236 -2.929 1.00 0.00 H new ATOM 0 HG3 MET A 83 -5.815 -4.367 -1.420 1.00 0.00 H new ATOM 0 HE1 MET A 83 -2.190 -4.873 -4.096 1.00 0.00 H new ATOM 0 HE2 MET A 83 -2.404 -6.222 -2.955 1.00 0.00 H new ATOM 0 HE3 MET A 83 -3.728 -5.769 -4.054 1.00 0.00 H new ATOM 1338 N THR A 84 -6.490 -7.300 1.474 1.00 0.00 N ATOM 1339 CA THR A 84 -6.874 -6.913 2.862 1.00 0.00 C ATOM 1340 C THR A 84 -5.617 -6.377 3.543 1.00 0.00 C ATOM 1341 O THR A 84 -4.523 -6.757 3.194 1.00 0.00 O ATOM 1342 CB THR A 84 -7.394 -8.131 3.630 1.00 0.00 C ATOM 1343 OG1 THR A 84 -8.664 -8.504 3.121 1.00 0.00 O ATOM 1344 CG2 THR A 84 -7.519 -7.785 5.115 1.00 0.00 C ATOM 0 H THR A 84 -5.977 -8.178 1.397 1.00 0.00 H new ATOM 0 HA THR A 84 -7.664 -6.162 2.844 1.00 0.00 H new ATOM 0 HB THR A 84 -6.697 -8.960 3.510 1.00 0.00 H new ATOM 0 HG1 THR A 84 -9.196 -8.913 3.836 1.00 0.00 H new ATOM 0 HG21 THR A 84 -7.889 -8.653 5.661 1.00 0.00 H new ATOM 0 HG22 THR A 84 -6.542 -7.500 5.506 1.00 0.00 H new ATOM 0 HG23 THR A 84 -8.215 -6.955 5.238 1.00 0.00 H new ATOM 1352 N TRP A 85 -5.746 -5.481 4.481 1.00 0.00 N ATOM 1353 CA TRP A 85 -4.524 -4.920 5.134 1.00 0.00 C ATOM 1354 C TRP A 85 -4.386 -5.462 6.562 1.00 0.00 C ATOM 1355 O TRP A 85 -5.293 -5.347 7.362 1.00 0.00 O ATOM 1356 CB TRP A 85 -4.649 -3.395 5.181 1.00 0.00 C ATOM 1357 CG TRP A 85 -3.297 -2.771 5.060 1.00 0.00 C ATOM 1358 CD1 TRP A 85 -2.708 -2.002 6.004 1.00 0.00 C ATOM 1359 CD2 TRP A 85 -2.360 -2.843 3.947 1.00 0.00 C ATOM 1360 NE1 TRP A 85 -1.469 -1.597 5.541 1.00 0.00 N ATOM 1361 CE2 TRP A 85 -1.209 -2.091 4.278 1.00 0.00 C ATOM 1362 CE3 TRP A 85 -2.397 -3.483 2.694 1.00 0.00 C ATOM 1363 CZ2 TRP A 85 -0.132 -1.976 3.398 1.00 0.00 C ATOM 1364 CZ3 TRP A 85 -1.315 -3.369 1.805 1.00 0.00 C ATOM 1365 CH2 TRP A 85 -0.185 -2.617 2.157 1.00 0.00 C ATOM 0 H TRP A 85 -6.634 -5.114 4.823 1.00 0.00 H new ATOM 0 HA TRP A 85 -3.643 -5.211 4.562 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -5.293 -3.049 4.372 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -5.119 -3.088 6.116 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -3.135 -1.746 6.962 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -0.826 -1.006 6.068 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -3.262 -4.065 2.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 0.736 -1.396 3.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -1.354 -3.863 0.845 1.00 0.00 H new ATOM 0 HH2 TRP A 85 0.644 -2.533 1.470 1.00 0.00 H new ATOM 1376 N ARG A 86 -3.251 -6.038 6.896 1.00 0.00 N ATOM 1377 CA ARG A 86 -3.066 -6.565 8.283 1.00 0.00 C ATOM 1378 C ARG A 86 -1.978 -5.759 8.999 1.00 0.00 C ATOM 1379 O ARG A 86 -0.801 -5.922 8.745 1.00 0.00 O ATOM 1380 CB ARG A 86 -2.644 -8.036 8.225 1.00 0.00 C ATOM 1381 CG ARG A 86 -2.525 -8.592 9.645 1.00 0.00 C ATOM 1382 CD ARG A 86 -2.014 -10.034 9.588 1.00 0.00 C ATOM 1383 NE ARG A 86 -2.982 -10.872 8.826 1.00 0.00 N ATOM 1384 CZ ARG A 86 -4.144 -11.162 9.344 1.00 0.00 C ATOM 1385 NH1 ARG A 86 -4.991 -11.898 8.678 1.00 0.00 N ATOM 1386 NH2 ARG A 86 -4.460 -10.715 10.528 1.00 0.00 N ATOM 0 H ARG A 86 -2.454 -6.163 6.272 1.00 0.00 H new ATOM 0 HA ARG A 86 -4.007 -6.476 8.826 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.375 -8.612 7.658 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.691 -8.131 7.705 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.843 -7.976 10.232 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -3.494 -8.558 10.143 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -1.034 -10.066 9.111 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -1.890 -10.428 10.597 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.736 -11.219 7.899 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.745 -12.247 7.752 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -5.899 -12.124 9.084 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -3.799 -10.139 11.049 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.368 -10.942 10.933 1.00 0.00 H new ATOM 1400 N ILE A 87 -2.365 -4.892 9.898 1.00 0.00 N ATOM 1401 CA ILE A 87 -1.357 -4.080 10.636 1.00 0.00 C ATOM 1402 C ILE A 87 -1.869 -3.778 12.047 1.00 0.00 C ATOM 1403 O ILE A 87 -3.058 -3.797 12.299 1.00 0.00 O ATOM 1404 CB ILE A 87 -1.116 -2.769 9.892 1.00 0.00 C ATOM 1405 CG1 ILE A 87 0.153 -2.106 10.430 1.00 0.00 C ATOM 1406 CG2 ILE A 87 -2.308 -1.834 10.104 1.00 0.00 C ATOM 1407 CD1 ILE A 87 0.583 -0.998 9.471 1.00 0.00 C ATOM 0 H ILE A 87 -3.336 -4.712 10.152 1.00 0.00 H new ATOM 0 HA ILE A 87 -0.424 -4.639 10.703 1.00 0.00 H new ATOM 0 HB ILE A 87 -0.999 -2.971 8.827 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.030 -1.694 11.423 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.948 -2.844 10.533 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -2.135 -0.898 9.573 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.213 -2.306 9.722 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.426 -1.630 11.168 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.487 -0.521 9.848 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.781 -1.424 8.488 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -0.212 -0.257 9.391 1.00 0.00 H new ATOM 1419 N ASP A 88 -0.985 -3.489 12.965 1.00 0.00 N ATOM 1420 CA ASP A 88 -1.423 -3.175 14.357 1.00 0.00 C ATOM 1421 C ASP A 88 -1.213 -1.690 14.644 1.00 0.00 C ATOM 1422 O ASP A 88 -0.668 -0.956 13.843 1.00 0.00 O ATOM 1423 CB ASP A 88 -0.626 -3.999 15.361 1.00 0.00 C ATOM 1424 CG ASP A 88 -1.086 -3.659 16.779 1.00 0.00 C ATOM 1425 OD1 ASP A 88 -2.071 -4.231 17.216 1.00 0.00 O ATOM 1426 OD2 ASP A 88 -0.444 -2.831 17.407 1.00 0.00 O ATOM 0 H ASP A 88 0.023 -3.457 12.811 1.00 0.00 H new ATOM 0 HA ASP A 88 -2.481 -3.421 14.452 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -0.766 -5.062 15.167 1.00 0.00 H new ATOM 0 HB3 ASP A 88 0.439 -3.792 15.253 1.00 0.00 H new ATOM 1431 N GLY A 89 -1.658 -1.245 15.783 1.00 0.00 N ATOM 1432 CA GLY A 89 -1.510 0.195 16.145 1.00 0.00 C ATOM 1433 C GLY A 89 -0.032 0.602 16.173 1.00 0.00 C ATOM 1434 O GLY A 89 0.317 1.701 15.789 1.00 0.00 O ATOM 0 H GLY A 89 -2.122 -1.820 16.486 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.048 0.812 15.426 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.960 0.377 17.121 1.00 0.00 H new ATOM 1438 N HIS A 90 0.836 -0.259 16.638 1.00 0.00 N ATOM 1439 CA HIS A 90 2.286 0.104 16.703 1.00 0.00 C ATOM 1440 C HIS A 90 3.076 -0.646 15.623 1.00 0.00 C ATOM 1441 O HIS A 90 4.173 -1.114 15.855 1.00 0.00 O ATOM 1442 CB HIS A 90 2.836 -0.246 18.089 1.00 0.00 C ATOM 1443 CG HIS A 90 3.566 0.944 18.641 1.00 0.00 C ATOM 1444 ND1 HIS A 90 3.387 1.387 19.945 1.00 0.00 N ATOM 1445 CD2 HIS A 90 4.479 1.798 18.076 1.00 0.00 C ATOM 1446 CE1 HIS A 90 4.177 2.464 20.119 1.00 0.00 C ATOM 1447 NE2 HIS A 90 4.861 2.754 19.011 1.00 0.00 N ATOM 0 H HIS A 90 0.606 -1.194 16.974 1.00 0.00 H new ATOM 0 HA HIS A 90 2.392 1.175 16.528 1.00 0.00 H new ATOM 0 HB2 HIS A 90 2.022 -0.531 18.756 1.00 0.00 H new ATOM 0 HB3 HIS A 90 3.508 -1.102 18.022 1.00 0.00 H new ATOM 0 HD2 HIS A 90 4.845 1.737 17.062 1.00 0.00 H new ATOM 0 HE1 HIS A 90 4.248 3.023 21.040 1.00 0.00 H new ATOM 0 HE2 HIS A 90 5.525 3.517 18.878 1.00 0.00 H new ATOM 1456 N TRP A 91 2.534 -0.753 14.442 1.00 0.00 N ATOM 1457 CA TRP A 91 3.259 -1.461 13.348 1.00 0.00 C ATOM 1458 C TRP A 91 3.619 -2.881 13.788 1.00 0.00 C ATOM 1459 O TRP A 91 4.658 -3.403 13.436 1.00 0.00 O ATOM 1460 CB TRP A 91 4.534 -0.694 12.992 1.00 0.00 C ATOM 1461 CG TRP A 91 4.165 0.530 12.225 1.00 0.00 C ATOM 1462 CD1 TRP A 91 3.660 0.528 10.974 1.00 0.00 C ATOM 1463 CD2 TRP A 91 4.259 1.926 12.630 1.00 0.00 C ATOM 1464 NE1 TRP A 91 3.431 1.833 10.586 1.00 0.00 N ATOM 1465 CE2 TRP A 91 3.791 2.732 11.572 1.00 0.00 C ATOM 1466 CE3 TRP A 91 4.702 2.566 13.797 1.00 0.00 C ATOM 1467 CZ2 TRP A 91 3.762 4.123 11.672 1.00 0.00 C ATOM 1468 CZ3 TRP A 91 4.675 3.965 13.902 1.00 0.00 C ATOM 1469 CH2 TRP A 91 4.206 4.743 12.839 1.00 0.00 C ATOM 0 H TRP A 91 1.620 -0.381 14.186 1.00 0.00 H new ATOM 0 HA TRP A 91 2.612 -1.514 12.472 1.00 0.00 H new ATOM 0 HB2 TRP A 91 5.075 -0.422 13.898 1.00 0.00 H new ATOM 0 HB3 TRP A 91 5.199 -1.323 12.400 1.00 0.00 H new ATOM 0 HD1 TRP A 91 3.467 -0.350 10.375 1.00 0.00 H new ATOM 0 HE1 TRP A 91 3.043 2.101 9.681 1.00 0.00 H new ATOM 0 HE3 TRP A 91 5.068 1.975 14.624 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 3.397 4.718 10.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 5.018 4.443 14.808 1.00 0.00 H new ATOM 0 HH2 TRP A 91 4.188 5.820 12.922 1.00 0.00 H new ATOM 1562 N ASP A 98 -9.090 -7.546 14.358 1.00 0.00 N ATOM 1563 CA ASP A 98 -10.538 -7.292 14.556 1.00 0.00 C ATOM 1564 C ASP A 98 -10.864 -5.951 13.903 1.00 0.00 C ATOM 1565 O ASP A 98 -12.007 -5.601 13.683 1.00 0.00 O ATOM 1566 CB ASP A 98 -10.836 -7.222 16.050 1.00 0.00 C ATOM 1567 CG ASP A 98 -10.617 -8.598 16.682 1.00 0.00 C ATOM 1568 OD1 ASP A 98 -10.486 -9.555 15.938 1.00 0.00 O ATOM 1569 OD2 ASP A 98 -10.584 -8.669 17.900 1.00 0.00 O ATOM 0 HA ASP A 98 -11.137 -8.088 14.114 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -10.189 -6.485 16.526 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -11.864 -6.896 16.211 1.00 0.00 H new ATOM 1574 N ARG A 99 -9.841 -5.204 13.604 1.00 0.00 N ATOM 1575 CA ARG A 99 -10.008 -3.873 12.972 1.00 0.00 C ATOM 1576 C ARG A 99 -9.482 -3.927 11.537 1.00 0.00 C ATOM 1577 O ARG A 99 -8.907 -2.978 11.040 1.00 0.00 O ATOM 1578 CB ARG A 99 -9.202 -2.848 13.772 1.00 0.00 C ATOM 1579 CG ARG A 99 -7.818 -3.430 14.091 1.00 0.00 C ATOM 1580 CD ARG A 99 -7.015 -2.437 14.930 1.00 0.00 C ATOM 1581 NE ARG A 99 -5.648 -2.980 15.165 1.00 0.00 N ATOM 1582 CZ ARG A 99 -5.450 -3.860 16.109 1.00 0.00 C ATOM 1583 NH1 ARG A 99 -4.254 -4.338 16.315 1.00 0.00 N ATOM 1584 NH2 ARG A 99 -6.449 -4.261 16.847 1.00 0.00 N ATOM 0 H ARG A 99 -8.872 -5.470 13.777 1.00 0.00 H new ATOM 0 HA ARG A 99 -11.061 -3.592 12.960 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -9.099 -1.925 13.202 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -9.725 -2.596 14.695 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -7.926 -4.371 14.630 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -7.285 -3.652 13.166 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -6.954 -1.477 14.418 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -7.516 -2.259 15.881 1.00 0.00 H new ATOM 0 HE ARG A 99 -4.867 -2.665 14.589 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -3.473 -4.024 15.739 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -4.100 -5.025 17.053 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -7.384 -3.887 16.686 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -6.295 -4.948 17.584 1.00 0.00 H new ATOM 1598 N ALA A 100 -9.657 -5.035 10.871 1.00 0.00 N ATOM 1599 CA ALA A 100 -9.148 -5.156 9.477 1.00 0.00 C ATOM 1600 C ALA A 100 -10.199 -4.655 8.485 1.00 0.00 C ATOM 1601 O ALA A 100 -11.385 -4.855 8.661 1.00 0.00 O ATOM 1602 CB ALA A 100 -8.827 -6.621 9.180 1.00 0.00 C ATOM 0 H ALA A 100 -10.131 -5.862 11.233 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.247 -4.551 9.374 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -8.454 -6.712 8.160 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -8.068 -6.976 9.877 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -9.730 -7.221 9.291 1.00 0.00 H new ATOM 1608 N SER A 101 -9.762 -4.006 7.440 1.00 0.00 N ATOM 1609 CA SER A 101 -10.710 -3.482 6.414 1.00 0.00 C ATOM 1610 C SER A 101 -10.386 -4.127 5.065 1.00 0.00 C ATOM 1611 O SER A 101 -9.313 -4.663 4.871 1.00 0.00 O ATOM 1612 CB SER A 101 -10.560 -1.965 6.306 1.00 0.00 C ATOM 1613 OG SER A 101 -10.836 -1.375 7.569 1.00 0.00 O ATOM 0 H SER A 101 -8.778 -3.814 7.251 1.00 0.00 H new ATOM 0 HA SER A 101 -11.734 -3.720 6.701 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.550 -1.710 5.985 1.00 0.00 H new ATOM 0 HB3 SER A 101 -11.242 -1.573 5.552 1.00 0.00 H new ATOM 0 HG SER A 101 -11.503 -0.666 7.460 1.00 0.00 H new ATOM 1619 N GLU A 102 -11.302 -4.090 4.133 1.00 0.00 N ATOM 1620 CA GLU A 102 -11.035 -4.714 2.804 1.00 0.00 C ATOM 1621 C GLU A 102 -10.840 -3.624 1.749 1.00 0.00 C ATOM 1622 O GLU A 102 -11.531 -2.624 1.736 1.00 0.00 O ATOM 1623 CB GLU A 102 -12.222 -5.594 2.410 1.00 0.00 C ATOM 1624 CG GLU A 102 -12.410 -6.697 3.454 1.00 0.00 C ATOM 1625 CD GLU A 102 -13.549 -7.622 3.020 1.00 0.00 C ATOM 1626 OE1 GLU A 102 -14.228 -7.286 2.064 1.00 0.00 O ATOM 1627 OE2 GLU A 102 -13.722 -8.652 3.652 1.00 0.00 O ATOM 0 H GLU A 102 -12.220 -3.656 4.234 1.00 0.00 H new ATOM 0 HA GLU A 102 -10.131 -5.320 2.866 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -13.127 -4.991 2.336 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -12.051 -6.034 1.427 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -11.488 -7.267 3.567 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -12.634 -6.258 4.426 1.00 0.00 H new ATOM 1634 N ILE A 103 -9.896 -3.816 0.865 1.00 0.00 N ATOM 1635 CA ILE A 103 -9.635 -2.805 -0.198 1.00 0.00 C ATOM 1636 C ILE A 103 -9.767 -3.470 -1.569 1.00 0.00 C ATOM 1637 O ILE A 103 -9.286 -4.564 -1.785 1.00 0.00 O ATOM 1638 CB ILE A 103 -8.218 -2.255 -0.036 1.00 0.00 C ATOM 1639 CG1 ILE A 103 -8.043 -1.723 1.386 1.00 0.00 C ATOM 1640 CG2 ILE A 103 -7.987 -1.116 -1.034 1.00 0.00 C ATOM 1641 CD1 ILE A 103 -6.587 -1.313 1.601 1.00 0.00 C ATOM 0 H ILE A 103 -9.291 -4.637 0.835 1.00 0.00 H new ATOM 0 HA ILE A 103 -10.354 -1.990 -0.115 1.00 0.00 H new ATOM 0 HB ILE A 103 -7.498 -3.051 -0.224 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -8.700 -0.869 1.550 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -8.327 -2.487 2.109 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -6.976 -0.727 -0.915 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -8.114 -1.491 -2.050 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -8.707 -0.318 -0.849 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -6.462 -0.933 2.615 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -5.940 -2.178 1.455 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -6.319 -0.535 0.887 1.00 0.00 H new ATOM 1653 N GLU A 104 -10.408 -2.813 -2.496 1.00 0.00 N ATOM 1654 CA GLU A 104 -10.565 -3.400 -3.858 1.00 0.00 C ATOM 1655 C GLU A 104 -9.765 -2.570 -4.865 1.00 0.00 C ATOM 1656 O GLU A 104 -9.911 -1.366 -4.941 1.00 0.00 O ATOM 1657 CB GLU A 104 -12.045 -3.388 -4.250 1.00 0.00 C ATOM 1658 CG GLU A 104 -12.228 -4.118 -5.582 1.00 0.00 C ATOM 1659 CD GLU A 104 -13.689 -4.021 -6.022 1.00 0.00 C ATOM 1660 OE1 GLU A 104 -14.460 -3.396 -5.312 1.00 0.00 O ATOM 1661 OE2 GLU A 104 -14.012 -4.574 -7.060 1.00 0.00 O ATOM 0 H GLU A 104 -10.831 -1.893 -2.369 1.00 0.00 H new ATOM 0 HA GLU A 104 -10.197 -4.426 -3.857 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.641 -3.870 -3.475 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -12.401 -2.361 -4.334 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.579 -3.680 -6.341 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -11.937 -5.163 -5.479 1.00 0.00 H new ATOM 1668 N VAL A 105 -8.923 -3.203 -5.639 1.00 0.00 N ATOM 1669 CA VAL A 105 -8.117 -2.449 -6.640 1.00 0.00 C ATOM 1670 C VAL A 105 -8.187 -3.156 -7.996 1.00 0.00 C ATOM 1671 O VAL A 105 -8.015 -4.356 -8.086 1.00 0.00 O ATOM 1672 CB VAL A 105 -6.662 -2.381 -6.176 1.00 0.00 C ATOM 1673 CG1 VAL A 105 -5.864 -1.489 -7.129 1.00 0.00 C ATOM 1674 CG2 VAL A 105 -6.606 -1.797 -4.763 1.00 0.00 C ATOM 0 H VAL A 105 -8.760 -4.210 -5.620 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.516 -1.439 -6.738 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.233 -3.383 -6.173 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -4.826 -1.440 -6.799 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.905 -1.904 -8.136 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -6.291 -0.486 -7.132 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -5.569 -1.748 -4.430 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -7.034 -0.795 -4.766 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.175 -2.432 -4.084 1.00 0.00 H new ATOM 1684 N ASP A 106 -8.432 -2.423 -9.051 1.00 0.00 N ATOM 1685 CA ASP A 106 -8.505 -3.055 -10.403 1.00 0.00 C ATOM 1686 C ASP A 106 -7.433 -2.449 -11.307 1.00 0.00 C ATOM 1687 O ASP A 106 -7.299 -1.244 -11.393 1.00 0.00 O ATOM 1688 CB ASP A 106 -9.881 -2.787 -11.018 1.00 0.00 C ATOM 1689 CG ASP A 106 -10.968 -3.394 -10.131 1.00 0.00 C ATOM 1690 OD1 ASP A 106 -12.127 -3.081 -10.349 1.00 0.00 O ATOM 1691 OD2 ASP A 106 -10.624 -4.157 -9.244 1.00 0.00 O ATOM 0 H ASP A 106 -8.585 -1.415 -9.035 1.00 0.00 H new ATOM 0 HA ASP A 106 -8.345 -4.129 -10.307 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -10.041 -1.714 -11.123 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -9.933 -3.216 -12.019 1.00 0.00 H new ATOM 1696 N PHE A 107 -6.681 -3.268 -11.996 1.00 0.00 N ATOM 1697 CA PHE A 107 -5.637 -2.731 -12.905 1.00 0.00 C ATOM 1698 C PHE A 107 -6.003 -3.070 -14.357 1.00 0.00 C ATOM 1699 O PHE A 107 -6.460 -4.164 -14.669 1.00 0.00 O ATOM 1700 CB PHE A 107 -4.275 -3.349 -12.570 1.00 0.00 C ATOM 1701 CG PHE A 107 -3.878 -3.035 -11.145 1.00 0.00 C ATOM 1702 CD1 PHE A 107 -2.899 -2.069 -10.893 1.00 0.00 C ATOM 1703 CD2 PHE A 107 -4.466 -3.729 -10.082 1.00 0.00 C ATOM 1704 CE1 PHE A 107 -2.503 -1.798 -9.576 1.00 0.00 C ATOM 1705 CE2 PHE A 107 -4.077 -3.454 -8.765 1.00 0.00 C ATOM 1706 CZ PHE A 107 -3.092 -2.490 -8.511 1.00 0.00 C ATOM 0 H PHE A 107 -6.748 -4.285 -11.965 1.00 0.00 H new ATOM 0 HA PHE A 107 -5.579 -1.650 -12.779 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.316 -4.429 -12.711 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -3.519 -2.967 -13.256 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -2.448 -1.531 -11.714 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -5.220 -4.477 -10.277 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -1.743 -1.055 -9.383 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -4.536 -3.985 -7.945 1.00 0.00 H new ATOM 0 HZ PHE A 107 -2.788 -2.281 -7.496 1.00 0.00 H new ATOM 1716 N VAL A 108 -5.796 -2.131 -15.241 1.00 0.00 N ATOM 1717 CA VAL A 108 -6.093 -2.347 -16.681 1.00 0.00 C ATOM 1718 C VAL A 108 -4.903 -1.792 -17.485 1.00 0.00 C ATOM 1719 O VAL A 108 -4.597 -0.620 -17.390 1.00 0.00 O ATOM 1720 CB VAL A 108 -7.366 -1.588 -17.057 1.00 0.00 C ATOM 1721 CG1 VAL A 108 -7.508 -0.367 -16.155 1.00 0.00 C ATOM 1722 CG2 VAL A 108 -7.275 -1.135 -18.514 1.00 0.00 C ATOM 0 H VAL A 108 -5.426 -1.207 -15.018 1.00 0.00 H new ATOM 0 HA VAL A 108 -6.241 -3.406 -16.893 1.00 0.00 H new ATOM 0 HB VAL A 108 -8.231 -2.239 -16.932 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -8.415 0.177 -16.420 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -7.568 -0.688 -15.115 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.643 0.284 -16.285 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.182 -0.594 -18.784 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.412 -0.482 -18.639 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.167 -2.006 -19.160 1.00 0.00 H new ATOM 1732 N PRO A 109 -4.212 -2.608 -18.246 1.00 0.00 N ATOM 1733 CA PRO A 109 -3.030 -2.148 -19.024 1.00 0.00 C ATOM 1734 C PRO A 109 -3.408 -1.362 -20.275 1.00 0.00 C ATOM 1735 O PRO A 109 -4.308 -1.728 -21.006 1.00 0.00 O ATOM 1736 CB PRO A 109 -2.322 -3.440 -19.412 1.00 0.00 C ATOM 1737 CG PRO A 109 -3.393 -4.475 -19.454 1.00 0.00 C ATOM 1738 CD PRO A 109 -4.475 -4.037 -18.461 1.00 0.00 C ATOM 0 HA PRO A 109 -2.416 -1.465 -18.437 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -1.829 -3.344 -20.380 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -1.551 -3.700 -18.686 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -3.805 -4.564 -20.459 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -2.995 -5.453 -19.185 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -5.475 -4.202 -18.863 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -4.410 -4.598 -17.529 1.00 0.00 H new ATOM 1746 N ASN A 110 -2.710 -0.294 -20.529 1.00 0.00 N ATOM 1747 CA ASN A 110 -2.991 0.523 -21.734 1.00 0.00 C ATOM 1748 C ASN A 110 -1.740 0.550 -22.611 1.00 0.00 C ATOM 1749 O ASN A 110 -0.629 0.547 -22.119 1.00 0.00 O ATOM 1750 CB ASN A 110 -3.363 1.941 -21.312 1.00 0.00 C ATOM 1751 CG ASN A 110 -3.685 2.778 -22.551 1.00 0.00 C ATOM 1752 OD1 ASN A 110 -2.896 3.607 -22.961 1.00 0.00 O ATOM 1753 ND2 ASN A 110 -4.819 2.596 -23.171 1.00 0.00 N ATOM 0 H ASN A 110 -1.948 0.050 -19.945 1.00 0.00 H new ATOM 0 HA ASN A 110 -3.821 0.093 -22.294 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -4.223 1.918 -20.643 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -2.540 2.394 -20.759 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -5.042 3.149 -23.998 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -5.482 1.901 -22.828 1.00 0.00 H new ATOM 1785 N GLY A 114 0.694 3.069 -20.689 1.00 0.00 N ATOM 1786 CA GLY A 114 -0.343 3.739 -19.858 1.00 0.00 C ATOM 1787 C GLY A 114 -0.919 2.736 -18.852 1.00 0.00 C ATOM 1788 O GLY A 114 -1.141 1.584 -19.163 1.00 0.00 O ATOM 0 HA2 GLY A 114 0.091 4.589 -19.332 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.138 4.129 -20.494 1.00 0.00 H new ATOM 1792 N THR A 115 -1.160 3.171 -17.646 1.00 0.00 N ATOM 1793 CA THR A 115 -1.724 2.256 -16.614 1.00 0.00 C ATOM 1794 C THR A 115 -2.850 2.962 -15.866 1.00 0.00 C ATOM 1795 O THR A 115 -2.645 3.982 -15.239 1.00 0.00 O ATOM 1796 CB THR A 115 -0.634 1.876 -15.602 1.00 0.00 C ATOM 1797 OG1 THR A 115 0.623 2.354 -16.056 1.00 0.00 O ATOM 1798 CG2 THR A 115 -0.575 0.353 -15.420 1.00 0.00 C ATOM 0 H THR A 115 -0.990 4.126 -17.330 1.00 0.00 H new ATOM 0 HA THR A 115 -2.102 1.361 -17.107 1.00 0.00 H new ATOM 0 HB THR A 115 -0.873 2.332 -14.641 1.00 0.00 H new ATOM 0 HG1 THR A 115 0.556 3.311 -16.256 1.00 0.00 H new ATOM 0 HG21 THR A 115 0.203 0.103 -14.699 1.00 0.00 H new ATOM 0 HG22 THR A 115 -1.537 -0.007 -15.055 1.00 0.00 H new ATOM 0 HG23 THR A 115 -0.349 -0.119 -16.376 1.00 0.00 H new ATOM 1806 N ARG A 116 -4.029 2.413 -15.903 1.00 0.00 N ATOM 1807 CA ARG A 116 -5.162 3.034 -15.167 1.00 0.00 C ATOM 1808 C ARG A 116 -5.455 2.178 -13.938 1.00 0.00 C ATOM 1809 O ARG A 116 -5.751 1.007 -14.046 1.00 0.00 O ATOM 1810 CB ARG A 116 -6.390 3.102 -16.071 1.00 0.00 C ATOM 1811 CG ARG A 116 -7.617 3.444 -15.227 1.00 0.00 C ATOM 1812 CD ARG A 116 -8.670 4.118 -16.103 1.00 0.00 C ATOM 1813 NE ARG A 116 -9.221 3.129 -17.075 1.00 0.00 N ATOM 1814 CZ ARG A 116 -8.725 3.034 -18.282 1.00 0.00 C ATOM 1815 NH1 ARG A 116 -9.218 2.164 -19.119 1.00 0.00 N ATOM 1816 NH2 ARG A 116 -7.739 3.806 -18.656 1.00 0.00 N ATOM 0 H ARG A 116 -4.258 1.559 -16.412 1.00 0.00 H new ATOM 0 HA ARG A 116 -4.907 4.049 -14.861 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -6.245 3.855 -16.845 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -6.537 2.148 -16.578 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -8.027 2.538 -14.780 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -7.334 4.105 -14.407 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -9.472 4.518 -15.482 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -8.229 4.960 -16.636 1.00 0.00 H new ATOM 0 HE ARG A 116 -9.991 2.521 -16.796 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -9.988 1.560 -18.832 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -8.833 2.088 -20.061 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -7.351 4.489 -18.005 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -7.358 3.726 -19.599 1.00 0.00 H new ATOM 1830 N VAL A 117 -5.349 2.741 -12.767 1.00 0.00 N ATOM 1831 CA VAL A 117 -5.598 1.943 -11.534 1.00 0.00 C ATOM 1832 C VAL A 117 -6.679 2.596 -10.684 1.00 0.00 C ATOM 1833 O VAL A 117 -6.695 3.795 -10.488 1.00 0.00 O ATOM 1834 CB VAL A 117 -4.312 1.854 -10.716 1.00 0.00 C ATOM 1835 CG1 VAL A 117 -4.568 1.010 -9.465 1.00 0.00 C ATOM 1836 CG2 VAL A 117 -3.216 1.200 -11.558 1.00 0.00 C ATOM 0 H VAL A 117 -5.101 3.718 -12.610 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.927 0.946 -11.827 1.00 0.00 H new ATOM 0 HB VAL A 117 -3.994 2.855 -10.423 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -3.652 0.943 -8.877 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -5.351 1.476 -8.866 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -4.884 0.009 -9.760 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -2.298 1.136 -10.974 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -3.531 0.198 -11.850 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.037 1.799 -12.451 1.00 0.00 H new ATOM 1846 N GLU A 118 -7.568 1.801 -10.155 1.00 0.00 N ATOM 1847 CA GLU A 118 -8.640 2.350 -9.284 1.00 0.00 C ATOM 1848 C GLU A 118 -8.476 1.749 -7.892 1.00 0.00 C ATOM 1849 O GLU A 118 -8.827 0.612 -7.654 1.00 0.00 O ATOM 1850 CB GLU A 118 -10.011 1.971 -9.852 1.00 0.00 C ATOM 1851 CG GLU A 118 -10.170 2.571 -11.251 1.00 0.00 C ATOM 1852 CD GLU A 118 -11.567 2.253 -11.786 1.00 0.00 C ATOM 1853 OE1 GLU A 118 -12.258 1.470 -11.155 1.00 0.00 O ATOM 1854 OE2 GLU A 118 -11.922 2.797 -12.818 1.00 0.00 O ATOM 0 H GLU A 118 -7.596 0.790 -10.290 1.00 0.00 H new ATOM 0 HA GLU A 118 -8.569 3.437 -9.237 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -10.110 0.886 -9.897 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -10.801 2.337 -9.196 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -10.020 3.650 -11.215 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -9.411 2.166 -11.921 1.00 0.00 H new ATOM 1861 N LEU A 119 -7.936 2.499 -6.970 1.00 0.00 N ATOM 1862 CA LEU A 119 -7.736 1.963 -5.597 1.00 0.00 C ATOM 1863 C LEU A 119 -8.787 2.555 -4.661 1.00 0.00 C ATOM 1864 O LEU A 119 -8.961 3.755 -4.591 1.00 0.00 O ATOM 1865 CB LEU A 119 -6.334 2.342 -5.109 1.00 0.00 C ATOM 1866 CG LEU A 119 -6.017 1.616 -3.796 1.00 0.00 C ATOM 1867 CD1 LEU A 119 -4.534 1.238 -3.774 1.00 0.00 C ATOM 1868 CD2 LEU A 119 -6.316 2.536 -2.607 1.00 0.00 C ATOM 0 H LEU A 119 -7.625 3.460 -7.110 1.00 0.00 H new ATOM 0 HA LEU A 119 -7.837 0.878 -5.606 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.594 2.080 -5.866 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.271 3.420 -4.961 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.632 0.719 -3.724 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.304 0.722 -2.842 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.313 0.582 -4.616 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.927 2.141 -3.848 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.089 2.014 -1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.702 3.434 -2.679 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.370 2.815 -2.619 1.00 0.00 H new ATOM 1880 N ALA A 120 -9.488 1.721 -3.941 1.00 0.00 N ATOM 1881 CA ALA A 120 -10.526 2.238 -3.009 1.00 0.00 C ATOM 1882 C ALA A 120 -10.366 1.582 -1.636 1.00 0.00 C ATOM 1883 O ALA A 120 -10.357 0.373 -1.510 1.00 0.00 O ATOM 1884 CB ALA A 120 -11.914 1.913 -3.566 1.00 0.00 C ATOM 0 H ALA A 120 -9.386 0.706 -3.959 1.00 0.00 H new ATOM 0 HA ALA A 120 -10.412 3.317 -2.907 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -12.677 2.291 -2.885 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -12.034 2.383 -4.542 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -12.021 0.833 -3.668 1.00 0.00 H new ATOM 1890 N HIS A 121 -10.262 2.376 -0.608 1.00 0.00 N ATOM 1891 CA HIS A 121 -10.129 1.820 0.769 1.00 0.00 C ATOM 1892 C HIS A 121 -11.365 2.240 1.555 1.00 0.00 C ATOM 1893 O HIS A 121 -11.881 3.322 1.354 1.00 0.00 O ATOM 1894 CB HIS A 121 -8.874 2.385 1.440 1.00 0.00 C ATOM 1895 CG HIS A 121 -9.273 3.336 2.538 1.00 0.00 C ATOM 1896 ND1 HIS A 121 -9.924 3.140 3.732 1.00 0.00 N flip ATOM 1897 CD2 HIS A 121 -9.006 4.697 2.472 1.00 0.00 C flip ATOM 1898 CE1 HIS A 121 -10.059 4.354 4.391 1.00 0.00 C flip ATOM 1899 NE2 HIS A 121 -9.492 5.259 3.595 1.00 0.00 N flip ATOM 0 H HIS A 121 -10.263 3.395 -0.662 1.00 0.00 H new ATOM 0 HA HIS A 121 -10.043 0.734 0.736 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -8.271 1.574 1.849 1.00 0.00 H new ATOM 0 HB3 HIS A 121 -8.257 2.901 0.704 1.00 0.00 H new ATOM 0 HD2 HIS A 121 -8.501 5.211 1.667 1.00 0.00 H new ATOM 0 HE1 HIS A 121 -10.526 4.528 5.349 1.00 0.00 H new ATOM 0 HE2 HIS A 121 -9.433 6.254 3.810 1.00 0.00 H new ATOM 1908 N VAL A 122 -11.866 1.409 2.431 1.00 0.00 N ATOM 1909 CA VAL A 122 -13.086 1.815 3.180 1.00 0.00 C ATOM 1910 C VAL A 122 -13.023 1.425 4.662 1.00 0.00 C ATOM 1911 O VAL A 122 -12.549 0.371 5.036 1.00 0.00 O ATOM 1912 CB VAL A 122 -14.297 1.156 2.521 1.00 0.00 C ATOM 1913 CG1 VAL A 122 -14.337 1.547 1.045 1.00 0.00 C ATOM 1914 CG2 VAL A 122 -14.186 -0.366 2.648 1.00 0.00 C ATOM 0 H VAL A 122 -11.492 0.487 2.656 1.00 0.00 H new ATOM 0 HA VAL A 122 -13.164 2.902 3.144 1.00 0.00 H new ATOM 0 HB VAL A 122 -15.210 1.490 3.013 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -15.199 1.080 0.568 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -14.417 2.631 0.958 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -13.424 1.210 0.554 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -15.050 -0.834 2.178 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -13.276 -0.707 2.155 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -14.153 -0.642 3.702 1.00 0.00 H new ATOM 1924 N LYS A 123 -13.566 2.279 5.492 1.00 0.00 N ATOM 1925 CA LYS A 123 -13.643 2.024 6.961 1.00 0.00 C ATOM 1926 C LYS A 123 -12.286 1.664 7.566 1.00 0.00 C ATOM 1927 O LYS A 123 -12.198 0.809 8.421 1.00 0.00 O ATOM 1928 CB LYS A 123 -14.641 0.896 7.224 1.00 0.00 C ATOM 1929 CG LYS A 123 -16.061 1.388 6.918 1.00 0.00 C ATOM 1930 CD LYS A 123 -16.263 1.472 5.402 1.00 0.00 C ATOM 1931 CE LYS A 123 -17.750 1.582 5.073 1.00 0.00 C ATOM 1932 NZ LYS A 123 -18.498 0.491 5.760 1.00 0.00 N ATOM 0 H LYS A 123 -13.971 3.169 5.202 1.00 0.00 H new ATOM 0 HA LYS A 123 -13.972 2.946 7.439 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -14.402 0.033 6.603 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -14.573 0.571 8.262 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -16.793 0.709 7.355 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -16.223 2.366 7.371 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -15.730 2.336 5.004 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -15.841 0.589 4.922 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -18.132 2.553 5.389 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -17.900 1.516 3.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -19.324 0.222 5.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -17.876 -0.334 5.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -18.817 0.823 6.693 1.00 0.00 H new ATOM 1946 N LEU A 124 -11.232 2.318 7.179 1.00 0.00 N ATOM 1947 CA LEU A 124 -9.922 2.005 7.806 1.00 0.00 C ATOM 1948 C LEU A 124 -9.935 2.571 9.226 1.00 0.00 C ATOM 1949 O LEU A 124 -9.338 2.027 10.129 1.00 0.00 O ATOM 1950 CB LEU A 124 -8.784 2.648 7.018 1.00 0.00 C ATOM 1951 CG LEU A 124 -7.794 1.570 6.575 1.00 0.00 C ATOM 1952 CD1 LEU A 124 -8.399 0.757 5.430 1.00 0.00 C ATOM 1953 CD2 LEU A 124 -6.507 2.237 6.098 1.00 0.00 C ATOM 0 H LEU A 124 -11.218 3.047 6.465 1.00 0.00 H new ATOM 0 HA LEU A 124 -9.766 0.926 7.816 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -9.181 3.171 6.148 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -8.277 3.391 7.633 1.00 0.00 H new ATOM 0 HG LEU A 124 -7.577 0.907 7.413 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.692 -0.011 5.116 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -9.322 0.285 5.767 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -8.615 1.417 4.590 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -5.797 1.473 5.781 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -6.729 2.897 5.259 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -6.075 2.818 6.913 1.00 0.00 H new ATOM 1965 N HIS A 125 -10.620 3.673 9.413 1.00 0.00 N ATOM 1966 CA HIS A 125 -10.682 4.328 10.754 1.00 0.00 C ATOM 1967 C HIS A 125 -10.906 3.301 11.853 1.00 0.00 C ATOM 1968 O HIS A 125 -10.759 3.597 13.023 1.00 0.00 O ATOM 1969 CB HIS A 125 -11.823 5.342 10.779 1.00 0.00 C ATOM 1970 CG HIS A 125 -12.009 5.838 12.186 1.00 0.00 C ATOM 1971 ND1 HIS A 125 -10.939 6.226 12.980 1.00 0.00 N ATOM 1972 CD2 HIS A 125 -13.131 6.005 12.959 1.00 0.00 C ATOM 1973 CE1 HIS A 125 -11.434 6.603 14.173 1.00 0.00 C ATOM 1974 NE2 HIS A 125 -12.763 6.488 14.211 1.00 0.00 N ATOM 0 H HIS A 125 -11.146 4.152 8.682 1.00 0.00 H new ATOM 0 HA HIS A 125 -9.731 4.829 10.931 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -11.600 6.175 10.113 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -12.743 4.882 10.418 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -14.142 5.794 12.644 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -10.831 6.955 14.997 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -13.379 6.708 14.993 1.00 0.00 H new ATOM 1983 N ARG A 126 -11.246 2.098 11.510 1.00 0.00 N ATOM 1984 CA ARG A 126 -11.454 1.083 12.575 1.00 0.00 C ATOM 1985 C ARG A 126 -10.235 1.079 13.494 1.00 0.00 C ATOM 1986 O ARG A 126 -10.348 0.862 14.684 1.00 0.00 O ATOM 1987 CB ARG A 126 -11.622 -0.295 11.947 1.00 0.00 C ATOM 1988 CG ARG A 126 -12.960 -0.359 11.218 1.00 0.00 C ATOM 1989 CD ARG A 126 -13.091 -1.717 10.531 1.00 0.00 C ATOM 1990 NE ARG A 126 -14.261 -1.696 9.608 1.00 0.00 N ATOM 1991 CZ ARG A 126 -15.463 -1.895 10.074 1.00 0.00 C ATOM 1992 NH1 ARG A 126 -16.487 -1.875 9.266 1.00 0.00 N ATOM 1993 NH2 ARG A 126 -15.641 -2.112 11.349 1.00 0.00 N ATOM 0 H ARG A 126 -11.388 1.773 10.554 1.00 0.00 H new ATOM 0 HA ARG A 126 -12.351 1.325 13.145 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -10.806 -0.492 11.251 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -11.577 -1.066 12.717 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -13.779 -0.213 11.922 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -13.026 0.442 10.482 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -12.181 -1.945 9.976 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -13.216 -2.503 11.276 1.00 0.00 H new ATOM 0 HE ARG A 126 -14.122 -1.526 8.612 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -16.348 -1.704 8.270 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -17.427 -2.031 9.630 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -14.840 -2.126 11.981 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -16.581 -2.268 11.714 1.00 0.00 H new ATOM 2007 N HIS A 127 -9.069 1.327 12.961 1.00 0.00 N ATOM 2008 CA HIS A 127 -7.861 1.342 13.835 1.00 0.00 C ATOM 2009 C HIS A 127 -7.772 2.675 14.584 1.00 0.00 C ATOM 2010 O HIS A 127 -7.318 2.723 15.709 1.00 0.00 O ATOM 2011 CB HIS A 127 -6.590 1.119 13.006 1.00 0.00 C ATOM 2012 CG HIS A 127 -6.563 2.021 11.802 1.00 0.00 C ATOM 2013 ND1 HIS A 127 -7.632 2.827 11.445 1.00 0.00 N ATOM 2014 CD2 HIS A 127 -5.602 2.226 10.843 1.00 0.00 C ATOM 2015 CE1 HIS A 127 -7.291 3.471 10.309 1.00 0.00 C ATOM 2016 NE2 HIS A 127 -6.067 3.139 9.906 1.00 0.00 N ATOM 0 H HIS A 127 -8.901 1.517 11.973 1.00 0.00 H new ATOM 0 HA HIS A 127 -7.948 0.531 14.558 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -5.712 1.306 13.624 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -6.539 0.078 12.686 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -4.633 1.750 10.821 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -7.932 4.169 9.791 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -5.574 3.483 9.082 1.00 0.00 H new ATOM 2051 N ALA A 131 -4.443 6.418 13.689 1.00 0.00 N ATOM 2052 CA ALA A 131 -4.499 5.557 12.478 1.00 0.00 C ATOM 2053 C ALA A 131 -3.577 6.123 11.398 1.00 0.00 C ATOM 2054 O ALA A 131 -2.736 5.428 10.866 1.00 0.00 O ATOM 2055 CB ALA A 131 -5.932 5.537 11.958 1.00 0.00 C ATOM 0 HA ALA A 131 -4.176 4.547 12.730 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.988 4.909 11.069 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.593 5.137 12.727 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -6.242 6.551 11.705 1.00 0.00 H new ATOM 2061 N TRP A 132 -3.717 7.377 11.070 1.00 0.00 N ATOM 2062 CA TRP A 132 -2.830 7.962 10.028 1.00 0.00 C ATOM 2063 C TRP A 132 -1.377 7.836 10.488 1.00 0.00 C ATOM 2064 O TRP A 132 -0.473 7.708 9.690 1.00 0.00 O ATOM 2065 CB TRP A 132 -3.184 9.430 9.789 1.00 0.00 C ATOM 2066 CG TRP A 132 -2.401 9.940 8.626 1.00 0.00 C ATOM 2067 CD1 TRP A 132 -1.119 10.367 8.682 1.00 0.00 C ATOM 2068 CD2 TRP A 132 -2.824 10.090 7.239 1.00 0.00 C ATOM 2069 NE1 TRP A 132 -0.725 10.760 7.418 1.00 0.00 N ATOM 2070 CE2 TRP A 132 -1.740 10.610 6.495 1.00 0.00 C ATOM 2071 CE3 TRP A 132 -4.030 9.825 6.558 1.00 0.00 C ATOM 2072 CZ2 TRP A 132 -1.845 10.859 5.128 1.00 0.00 C ATOM 2073 CZ3 TRP A 132 -4.138 10.077 5.181 1.00 0.00 C ATOM 2074 CH2 TRP A 132 -3.047 10.591 4.467 1.00 0.00 C ATOM 0 H TRP A 132 -4.401 8.017 11.474 1.00 0.00 H new ATOM 0 HA TRP A 132 -2.966 7.424 9.090 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -4.252 9.532 9.597 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -2.962 10.020 10.679 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -0.504 10.396 9.569 1.00 0.00 H new ATOM 0 HE1 TRP A 132 0.204 11.118 7.194 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -4.875 9.426 7.099 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -1.002 11.257 4.582 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -5.067 9.874 4.669 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.135 10.780 3.407 1.00 0.00 H new ATOM 2085 N ASN A 133 -1.139 7.853 11.772 1.00 0.00 N ATOM 2086 CA ASN A 133 0.262 7.712 12.251 1.00 0.00 C ATOM 2087 C ASN A 133 0.822 6.432 11.650 1.00 0.00 C ATOM 2088 O ASN A 133 1.930 6.391 11.155 1.00 0.00 O ATOM 2089 CB ASN A 133 0.276 7.607 13.777 1.00 0.00 C ATOM 2090 CG ASN A 133 1.690 7.874 14.295 1.00 0.00 C ATOM 2091 OD1 ASN A 133 2.225 8.948 14.108 1.00 0.00 O ATOM 2092 ND2 ASN A 133 2.322 6.934 14.944 1.00 0.00 N ATOM 0 H ASN A 133 -1.846 7.957 12.500 1.00 0.00 H new ATOM 0 HA ASN A 133 0.859 8.574 11.954 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -0.422 8.325 14.208 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -0.055 6.616 14.087 1.00 0.00 H new ATOM 0 HD21 ASN A 133 3.265 7.102 15.294 1.00 0.00 H new ATOM 0 HD22 ASN A 133 1.873 6.032 15.101 1.00 0.00 H new ATOM 2099 N ILE A 134 0.037 5.393 11.649 1.00 0.00 N ATOM 2100 CA ILE A 134 0.487 4.120 11.043 1.00 0.00 C ATOM 2101 C ILE A 134 0.807 4.399 9.575 1.00 0.00 C ATOM 2102 O ILE A 134 1.818 3.977 9.039 1.00 0.00 O ATOM 2103 CB ILE A 134 -0.640 3.100 11.144 1.00 0.00 C ATOM 2104 CG1 ILE A 134 -0.929 2.801 12.618 1.00 0.00 C ATOM 2105 CG2 ILE A 134 -0.227 1.823 10.430 1.00 0.00 C ATOM 2106 CD1 ILE A 134 -2.131 1.860 12.721 1.00 0.00 C ATOM 0 H ILE A 134 -0.903 5.375 12.046 1.00 0.00 H new ATOM 0 HA ILE A 134 1.366 3.727 11.554 1.00 0.00 H new ATOM 0 HB ILE A 134 -1.540 3.500 10.677 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -0.056 2.346 13.086 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -1.132 3.728 13.155 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -1.031 1.091 10.500 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -0.026 2.041 9.381 1.00 0.00 H new ATOM 0 HG23 ILE A 134 0.672 1.420 10.896 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -2.337 1.647 13.770 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -3.003 2.333 12.269 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -1.910 0.929 12.198 1.00 0.00 H new ATOM 2118 N HIS A 135 -0.053 5.139 8.933 1.00 0.00 N ATOM 2119 CA HIS A 135 0.170 5.497 7.509 1.00 0.00 C ATOM 2120 C HIS A 135 1.437 6.346 7.404 1.00 0.00 C ATOM 2121 O HIS A 135 2.163 6.284 6.433 1.00 0.00 O ATOM 2122 CB HIS A 135 -1.031 6.294 6.995 1.00 0.00 C ATOM 2123 CG HIS A 135 -0.765 6.759 5.596 1.00 0.00 C ATOM 2124 ND1 HIS A 135 0.392 6.420 4.916 1.00 0.00 N ATOM 2125 CD2 HIS A 135 -1.496 7.536 4.736 1.00 0.00 C ATOM 2126 CE1 HIS A 135 0.333 6.982 3.700 1.00 0.00 C ATOM 2127 NE2 HIS A 135 -0.802 7.673 3.537 1.00 0.00 N ATOM 0 H HIS A 135 -0.909 5.514 9.341 1.00 0.00 H new ATOM 0 HA HIS A 135 0.285 4.594 6.910 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -1.928 5.675 7.019 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -1.217 7.150 7.644 1.00 0.00 H new ATOM 0 HD1 HIS A 135 1.154 5.845 5.276 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -2.459 7.973 4.954 1.00 0.00 H new ATOM 0 HE1 HIS A 135 1.103 6.889 2.948 1.00 0.00 H new ATOM 2136 N LYS A 136 1.711 7.139 8.402 1.00 0.00 N ATOM 2137 CA LYS A 136 2.929 7.988 8.348 1.00 0.00 C ATOM 2138 C LYS A 136 4.134 7.099 8.057 1.00 0.00 C ATOM 2139 O LYS A 136 5.023 7.472 7.318 1.00 0.00 O ATOM 2140 CB LYS A 136 3.112 8.711 9.682 1.00 0.00 C ATOM 2141 CG LYS A 136 4.230 9.738 9.564 1.00 0.00 C ATOM 2142 CD LYS A 136 4.386 10.481 10.892 1.00 0.00 C ATOM 2143 CE LYS A 136 5.436 11.583 10.742 1.00 0.00 C ATOM 2144 NZ LYS A 136 4.833 12.751 10.041 1.00 0.00 N ATOM 0 H LYS A 136 1.147 7.235 9.247 1.00 0.00 H new ATOM 0 HA LYS A 136 2.830 8.735 7.560 1.00 0.00 H new ATOM 0 HB2 LYS A 136 2.183 9.203 9.970 1.00 0.00 H new ATOM 0 HB3 LYS A 136 3.348 7.992 10.466 1.00 0.00 H new ATOM 0 HG2 LYS A 136 5.165 9.244 9.300 1.00 0.00 H new ATOM 0 HG3 LYS A 136 4.006 10.444 8.765 1.00 0.00 H new ATOM 0 HD2 LYS A 136 3.432 10.913 11.193 1.00 0.00 H new ATOM 0 HD3 LYS A 136 4.683 9.786 11.677 1.00 0.00 H new ATOM 0 HE2 LYS A 136 5.805 11.884 11.722 1.00 0.00 H new ATOM 0 HE3 LYS A 136 6.292 11.210 10.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 5.507 13.543 10.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 4.610 12.489 9.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 3.961 13.037 10.530 1.00 0.00 H new ATOM 2158 N ALA A 137 4.164 5.910 8.597 1.00 0.00 N ATOM 2159 CA ALA A 137 5.315 5.010 8.290 1.00 0.00 C ATOM 2160 C ALA A 137 5.255 4.683 6.806 1.00 0.00 C ATOM 2161 O ALA A 137 6.244 4.726 6.102 1.00 0.00 O ATOM 2162 CB ALA A 137 5.206 3.712 9.076 1.00 0.00 C ATOM 0 H ALA A 137 3.457 5.528 9.225 1.00 0.00 H new ATOM 0 HA ALA A 137 6.249 5.503 8.559 1.00 0.00 H new ATOM 0 HB1 ALA A 137 6.054 3.070 8.838 1.00 0.00 H new ATOM 0 HB2 ALA A 137 5.206 3.932 10.144 1.00 0.00 H new ATOM 0 HB3 ALA A 137 4.280 3.202 8.810 1.00 0.00 H new ATOM 2267 N THR A 146 0.446 8.979 -3.612 1.00 0.00 N ATOM 2268 CA THR A 146 1.224 7.715 -3.718 1.00 0.00 C ATOM 2269 C THR A 146 1.369 7.343 -5.190 1.00 0.00 C ATOM 2270 O THR A 146 2.394 6.862 -5.627 1.00 0.00 O ATOM 2271 CB THR A 146 0.485 6.599 -2.985 1.00 0.00 C ATOM 2272 OG1 THR A 146 0.528 6.838 -1.585 1.00 0.00 O ATOM 2273 CG2 THR A 146 1.137 5.255 -3.310 1.00 0.00 C ATOM 0 HA THR A 146 2.209 7.851 -3.271 1.00 0.00 H new ATOM 0 HB THR A 146 -0.556 6.577 -3.308 1.00 0.00 H new ATOM 0 HG1 THR A 146 0.576 7.803 -1.419 1.00 0.00 H new ATOM 0 HG21 THR A 146 0.609 4.458 -2.786 1.00 0.00 H new ATOM 0 HG22 THR A 146 1.088 5.077 -4.384 1.00 0.00 H new ATOM 0 HG23 THR A 146 2.179 5.270 -2.991 1.00 0.00 H new ATOM 2281 N LEU A 147 0.344 7.566 -5.957 1.00 0.00 N ATOM 2282 CA LEU A 147 0.403 7.240 -7.400 1.00 0.00 C ATOM 2283 C LEU A 147 1.410 8.163 -8.096 1.00 0.00 C ATOM 2284 O LEU A 147 2.019 7.804 -9.081 1.00 0.00 O ATOM 2285 CB LEU A 147 -0.981 7.445 -8.008 1.00 0.00 C ATOM 2286 CG LEU A 147 -1.973 6.484 -7.334 1.00 0.00 C ATOM 2287 CD1 LEU A 147 -2.426 7.034 -5.974 1.00 0.00 C ATOM 2288 CD2 LEU A 147 -3.200 6.302 -8.229 1.00 0.00 C ATOM 0 H LEU A 147 -0.540 7.964 -5.641 1.00 0.00 H new ATOM 0 HA LEU A 147 0.717 6.205 -7.532 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -1.304 8.477 -7.869 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.951 7.262 -9.082 1.00 0.00 H new ATOM 0 HG LEU A 147 -1.473 5.527 -7.181 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -3.128 6.337 -5.515 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -1.559 7.157 -5.324 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -2.913 7.999 -6.116 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -3.902 5.620 -7.749 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -3.682 7.267 -8.387 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.892 5.889 -9.189 1.00 0.00 H new ATOM 2300 N ALA A 148 1.557 9.364 -7.603 1.00 0.00 N ATOM 2301 CA ALA A 148 2.489 10.344 -8.243 1.00 0.00 C ATOM 2302 C ALA A 148 3.961 9.961 -8.047 1.00 0.00 C ATOM 2303 O ALA A 148 4.736 9.969 -8.982 1.00 0.00 O ATOM 2304 CB ALA A 148 2.263 11.723 -7.621 1.00 0.00 C ATOM 0 H ALA A 148 1.069 9.713 -6.778 1.00 0.00 H new ATOM 0 HA ALA A 148 2.279 10.348 -9.313 1.00 0.00 H new ATOM 0 HB1 ALA A 148 2.938 12.445 -8.081 1.00 0.00 H new ATOM 0 HB2 ALA A 148 1.232 12.033 -7.788 1.00 0.00 H new ATOM 0 HB3 ALA A 148 2.458 11.675 -6.550 1.00 0.00 H new ATOM 2310 N ARG A 149 4.367 9.677 -6.843 1.00 0.00 N ATOM 2311 CA ARG A 149 5.806 9.357 -6.605 1.00 0.00 C ATOM 2312 C ARG A 149 6.218 8.053 -7.298 1.00 0.00 C ATOM 2313 O ARG A 149 7.206 8.008 -8.003 1.00 0.00 O ATOM 2314 CB ARG A 149 6.066 9.236 -5.103 1.00 0.00 C ATOM 2315 CG ARG A 149 4.868 8.580 -4.417 1.00 0.00 C ATOM 2316 CD ARG A 149 5.369 7.589 -3.364 1.00 0.00 C ATOM 2317 NE ARG A 149 4.293 7.332 -2.367 1.00 0.00 N ATOM 2318 CZ ARG A 149 4.283 6.217 -1.689 1.00 0.00 C ATOM 2319 NH1 ARG A 149 3.340 5.993 -0.814 1.00 0.00 N ATOM 2320 NH2 ARG A 149 5.217 5.327 -1.883 1.00 0.00 N ATOM 0 H ARG A 149 3.771 9.652 -6.016 1.00 0.00 H new ATOM 0 HA ARG A 149 6.401 10.168 -7.025 1.00 0.00 H new ATOM 0 HB2 ARG A 149 6.965 8.645 -4.928 1.00 0.00 H new ATOM 0 HB3 ARG A 149 6.245 10.223 -4.676 1.00 0.00 H new ATOM 0 HG2 ARG A 149 4.241 9.339 -3.949 1.00 0.00 H new ATOM 0 HG3 ARG A 149 4.250 8.065 -5.153 1.00 0.00 H new ATOM 0 HD2 ARG A 149 5.667 6.655 -3.841 1.00 0.00 H new ATOM 0 HD3 ARG A 149 6.252 7.988 -2.866 1.00 0.00 H new ATOM 0 HE ARG A 149 3.563 8.028 -2.214 1.00 0.00 H new ATOM 0 HH11 ARG A 149 2.611 6.690 -0.660 1.00 0.00 H new ATOM 0 HH12 ARG A 149 3.332 5.121 -0.284 1.00 0.00 H new ATOM 0 HH21 ARG A 149 5.955 5.503 -2.565 1.00 0.00 H new ATOM 0 HH22 ARG A 149 5.209 4.456 -1.353 1.00 0.00 H new ATOM 2334 N PHE A 150 5.493 6.988 -7.095 1.00 0.00 N ATOM 2335 CA PHE A 150 5.885 5.699 -7.735 1.00 0.00 C ATOM 2336 C PHE A 150 5.705 5.791 -9.253 1.00 0.00 C ATOM 2337 O PHE A 150 6.473 5.238 -10.009 1.00 0.00 O ATOM 2338 CB PHE A 150 5.032 4.562 -7.178 1.00 0.00 C ATOM 2339 CG PHE A 150 3.998 4.154 -8.185 1.00 0.00 C ATOM 2340 CD1 PHE A 150 4.101 2.912 -8.818 1.00 0.00 C ATOM 2341 CD2 PHE A 150 2.936 5.008 -8.481 1.00 0.00 C ATOM 2342 CE1 PHE A 150 3.137 2.522 -9.748 1.00 0.00 C ATOM 2343 CE2 PHE A 150 1.970 4.622 -9.415 1.00 0.00 C ATOM 2344 CZ PHE A 150 2.072 3.375 -10.048 1.00 0.00 C ATOM 0 H PHE A 150 4.652 6.953 -6.518 1.00 0.00 H new ATOM 0 HA PHE A 150 6.934 5.499 -7.515 1.00 0.00 H new ATOM 0 HB2 PHE A 150 5.665 3.710 -6.929 1.00 0.00 H new ATOM 0 HB3 PHE A 150 4.547 4.879 -6.255 1.00 0.00 H new ATOM 0 HD1 PHE A 150 4.926 2.255 -8.587 1.00 0.00 H new ATOM 0 HD2 PHE A 150 2.860 5.967 -7.989 1.00 0.00 H new ATOM 0 HE1 PHE A 150 3.214 1.561 -10.236 1.00 0.00 H new ATOM 0 HE2 PHE A 150 1.148 5.282 -9.648 1.00 0.00 H new ATOM 0 HZ PHE A 150 1.326 3.073 -10.769 1.00 0.00 H new ATOM 2354 N ALA A 151 4.699 6.479 -9.712 1.00 0.00 N ATOM 2355 CA ALA A 151 4.495 6.590 -11.183 1.00 0.00 C ATOM 2356 C ALA A 151 5.644 7.388 -11.803 1.00 0.00 C ATOM 2357 O ALA A 151 6.101 7.102 -12.891 1.00 0.00 O ATOM 2358 CB ALA A 151 3.177 7.314 -11.461 1.00 0.00 C ATOM 0 H ALA A 151 4.012 6.967 -9.137 1.00 0.00 H new ATOM 0 HA ALA A 151 4.467 5.591 -11.618 1.00 0.00 H new ATOM 0 HB1 ALA A 151 3.027 7.396 -12.538 1.00 0.00 H new ATOM 0 HB2 ALA A 151 2.353 6.752 -11.021 1.00 0.00 H new ATOM 0 HB3 ALA A 151 3.210 8.311 -11.023 1.00 0.00 H new ATOM 2364 N ASN A 152 6.099 8.397 -11.117 1.00 0.00 N ATOM 2365 CA ASN A 152 7.205 9.241 -11.657 1.00 0.00 C ATOM 2366 C ASN A 152 8.480 8.420 -11.846 1.00 0.00 C ATOM 2367 O ASN A 152 9.132 8.490 -12.869 1.00 0.00 O ATOM 2368 CB ASN A 152 7.505 10.359 -10.669 1.00 0.00 C ATOM 2369 CG ASN A 152 6.304 11.295 -10.560 1.00 0.00 C ATOM 2370 OD1 ASN A 152 5.471 11.343 -11.444 1.00 0.00 O ATOM 2371 ND2 ASN A 152 6.179 12.046 -9.502 1.00 0.00 N ATOM 0 H ASN A 152 5.752 8.677 -10.200 1.00 0.00 H new ATOM 0 HA ASN A 152 6.890 9.641 -12.621 1.00 0.00 H new ATOM 0 HB2 ASN A 152 7.739 9.938 -9.691 1.00 0.00 H new ATOM 0 HB3 ASN A 152 8.383 10.917 -10.994 1.00 0.00 H new ATOM 0 HD21 ASN A 152 5.381 12.675 -9.415 1.00 0.00 H new ATOM 0 HD22 ASN A 152 6.879 12.004 -8.761 1.00 0.00 H new ATOM 2378 N VAL A 153 8.852 7.665 -10.857 1.00 0.00 N ATOM 2379 CA VAL A 153 10.101 6.860 -10.961 1.00 0.00 C ATOM 2380 C VAL A 153 9.950 5.786 -12.038 1.00 0.00 C ATOM 2381 O VAL A 153 10.878 5.490 -12.765 1.00 0.00 O ATOM 2382 CB VAL A 153 10.398 6.212 -9.610 1.00 0.00 C ATOM 2383 CG1 VAL A 153 10.805 7.295 -8.609 1.00 0.00 C ATOM 2384 CG2 VAL A 153 9.148 5.501 -9.096 1.00 0.00 C ATOM 0 H VAL A 153 8.346 7.568 -9.977 1.00 0.00 H new ATOM 0 HA VAL A 153 10.928 7.513 -11.239 1.00 0.00 H new ATOM 0 HB VAL A 153 11.207 5.490 -9.725 1.00 0.00 H new ATOM 0 HG11 VAL A 153 11.018 6.836 -7.643 1.00 0.00 H new ATOM 0 HG12 VAL A 153 11.696 7.809 -8.971 1.00 0.00 H new ATOM 0 HG13 VAL A 153 9.992 8.013 -8.499 1.00 0.00 H new ATOM 0 HG21 VAL A 153 9.362 5.039 -8.132 1.00 0.00 H new ATOM 0 HG22 VAL A 153 8.340 6.223 -8.981 1.00 0.00 H new ATOM 0 HG23 VAL A 153 8.848 4.732 -9.808 1.00 0.00 H new ATOM 2394 N ILE A 154 8.793 5.203 -12.154 1.00 0.00 N ATOM 2395 CA ILE A 154 8.596 4.158 -13.190 1.00 0.00 C ATOM 2396 C ILE A 154 8.715 4.784 -14.581 1.00 0.00 C ATOM 2397 O ILE A 154 8.295 5.919 -14.736 1.00 0.00 O ATOM 2398 CB ILE A 154 7.213 3.538 -13.029 1.00 0.00 C ATOM 2399 CG1 ILE A 154 7.164 2.764 -11.715 1.00 0.00 C ATOM 2400 CG2 ILE A 154 6.947 2.598 -14.201 1.00 0.00 C ATOM 2401 CD1 ILE A 154 5.743 2.250 -11.473 1.00 0.00 C ATOM 0 H ILE A 154 7.977 5.405 -11.577 1.00 0.00 H new ATOM 0 HA ILE A 154 9.357 3.387 -13.075 1.00 0.00 H new ATOM 0 HB ILE A 154 6.451 4.317 -13.015 1.00 0.00 H new ATOM 0 HG12 ILE A 154 7.863 1.928 -11.748 1.00 0.00 H new ATOM 0 HG13 ILE A 154 7.474 3.407 -10.891 1.00 0.00 H new ATOM 0 HG21 ILE A 154 5.959 2.151 -14.092 1.00 0.00 H new ATOM 0 HG22 ILE A 154 6.990 3.159 -15.135 1.00 0.00 H new ATOM 0 HG23 ILE A 154 7.701 1.811 -14.215 1.00 0.00 H new ATOM 0 HD11 ILE A 154 5.711 1.698 -10.534 1.00 0.00 H new ATOM 0 HD12 ILE A 154 5.055 3.094 -11.421 1.00 0.00 H new ATOM 0 HD13 ILE A 154 5.450 1.592 -12.291 1.00 0.00 H new