USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1128 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 85 HIS : +bothHN:sc= 1 K(o=2.3,f=-6.9!) USER MOD Set 1.2: A 88 HIS : no HE2:sc= 1.21 K(o=2.3,f=-4!) USER MOD Set 1.3: A 93 SER OG : rot -160:sc= 0.11 USER MOD Set 2.1: A 19 TYR OH : rot 180:sc= 0.762 USER MOD Set 2.2: A 84 SER OG : rot 95:sc= 0.883 USER MOD Set 3.1: A 52 GLN : amide:sc= 0 X(o=1.1,f=0.8) USER MOD Set 3.2: A 54 THR OG1 : rot 69:sc= 1.1 USER MOD Set 4.1: A 46 THR OG1 : rot 180:sc= -0.0383 USER MOD Set 4.2: A 47 ASN : amide:sc= 0.123 K(o=0.085,f=-3.6!) USER MOD Set 5.1: A 37 ASN : amide:sc= 0.78 K(o=1.6,f=0.25) USER MOD Set 5.2: A 106 THR OG1 : rot -110:sc= 0.869 USER MOD Single : A 1 MET CE :methyl -144:sc= 0 (180deg=-1.71) USER MOD Single : A 1 MET N :NH3+ -158:sc= 1.26 (180deg=-0.148!) USER MOD Single : A 2 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0241) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0149 USER MOD Single : A 4 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 10 GLN : amide:sc= -0.0468 K(o=-0.047,f=-0.91) USER MOD Single : A 14 HIS :FLIP no HD1:sc= -1.46 F(o=-4.4!,f=-1.5) USER MOD Single : A 24 CYS SG : rot 82:sc= 0.189 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.0911 X(o=0.091,f=0) USER MOD Single : A 74 GLN :FLIP amide:sc= -0.0442 F(o=-1.3!,f=-0.044) USER MOD Single : A 82 TYR OH : rot -127:sc= 0.853 USER MOD Single : A 83 HIS : no HD1:sc= -0.476 X(o=-0.48,f=-0.014) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 TYR OH : rot 68:sc= 1.22 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -2:sc= 1.65 USER MOD Single : A 130 SER OG : rot 40:sc= 1.24 USER MOD Single : A 133 HIS : no HD1:sc= -0.24 X(o=-0.24,f=-0.0022) USER MOD Single : A 148 HIS : no HE2:sc= 0.141! C(o=0.14!,f=-6!) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 150 HIS : no HD1:sc= -0.241 X(o=-0.24,f=0) USER MOD Single : A 151 HIS : no HD1:sc= -0.092 X(o=-0.092,f=0) USER MOD Single : A 152 HIS : no HE2:sc= 0.836 K(o=0.84,f=-2.9!) USER MOD Single : A 153 HIS : no HD1:sc= -0.345 X(o=-0.35,f=-0.66) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.073 -6.454 4.485 1.00 0.00 N ATOM 2 CA MET A 1 -8.192 -6.165 3.333 1.00 0.00 C ATOM 3 C MET A 1 -8.249 -7.300 2.312 1.00 0.00 C ATOM 4 O MET A 1 -7.730 -8.388 2.562 1.00 0.00 O ATOM 5 CB MET A 1 -6.751 -5.977 3.817 1.00 0.00 C ATOM 6 CG MET A 1 -5.754 -5.740 2.693 1.00 0.00 C ATOM 7 SD MET A 1 -4.047 -5.688 3.277 1.00 0.00 S ATOM 8 CE MET A 1 -3.166 -5.459 1.732 1.00 0.00 C ATOM 0 H1 MET A 1 -9.318 -5.565 4.966 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.942 -6.917 4.150 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.580 -7.083 5.150 1.00 0.00 H new ATOM 0 HA MET A 1 -8.538 -5.249 2.854 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.716 -5.133 4.506 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.448 -6.860 4.379 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.856 -6.531 1.950 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.992 -4.801 2.194 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.225 -6.008 1.765 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.774 -5.831 0.908 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.963 -4.399 1.583 1.00 0.00 H new ATOM 20 N LYS A 2 -8.883 -7.050 1.168 1.00 0.00 N ATOM 21 CA LYS A 2 -8.903 -8.026 0.082 1.00 0.00 C ATOM 22 C LYS A 2 -7.801 -7.715 -0.917 1.00 0.00 C ATOM 23 O LYS A 2 -7.705 -6.597 -1.421 1.00 0.00 O ATOM 24 CB LYS A 2 -10.239 -8.044 -0.669 1.00 0.00 C ATOM 25 CG LYS A 2 -11.405 -8.658 0.087 1.00 0.00 C ATOM 26 CD LYS A 2 -12.140 -7.626 0.922 1.00 0.00 C ATOM 27 CE LYS A 2 -13.598 -8.011 1.155 1.00 0.00 C ATOM 28 NZ LYS A 2 -13.750 -9.342 1.802 1.00 0.00 N ATOM 0 H LYS A 2 -9.387 -6.185 0.970 1.00 0.00 H new ATOM 0 HA LYS A 2 -8.752 -9.003 0.540 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -10.500 -7.020 -0.935 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -10.104 -8.592 -1.602 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -12.098 -9.114 -0.621 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -11.040 -9.456 0.734 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -11.637 -7.512 1.882 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -12.096 -6.658 0.423 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -14.073 -7.253 1.778 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -14.124 -8.015 0.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -14.750 -9.499 2.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -13.431 -10.085 1.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -13.176 -9.374 2.669 1.00 0.00 H new ATOM 42 N THR A 3 -6.966 -8.692 -1.198 1.00 0.00 N ATOM 43 CA THR A 3 -5.943 -8.533 -2.217 1.00 0.00 C ATOM 44 C THR A 3 -5.482 -9.895 -2.723 1.00 0.00 C ATOM 45 O THR A 3 -5.614 -10.908 -2.027 1.00 0.00 O ATOM 46 CB THR A 3 -4.742 -7.700 -1.713 1.00 0.00 C ATOM 47 OG1 THR A 3 -3.853 -7.411 -2.799 1.00 0.00 O ATOM 48 CG2 THR A 3 -3.986 -8.427 -0.619 1.00 0.00 C ATOM 0 H THR A 3 -6.972 -9.603 -0.739 1.00 0.00 H new ATOM 0 HA THR A 3 -6.389 -7.981 -3.044 1.00 0.00 H new ATOM 0 HB THR A 3 -5.132 -6.770 -1.301 1.00 0.00 H new ATOM 0 HG1 THR A 3 -3.096 -6.882 -2.470 1.00 0.00 H new ATOM 0 HG21 THR A 3 -3.148 -7.814 -0.287 1.00 0.00 H new ATOM 0 HG22 THR A 3 -4.654 -8.615 0.222 1.00 0.00 H new ATOM 0 HG23 THR A 3 -3.612 -9.376 -1.004 1.00 0.00 H new ATOM 56 N THR A 4 -4.963 -9.916 -3.937 1.00 0.00 N ATOM 57 CA THR A 4 -4.585 -11.155 -4.588 1.00 0.00 C ATOM 58 C THR A 4 -3.201 -11.609 -4.140 1.00 0.00 C ATOM 59 O THR A 4 -2.377 -10.799 -3.707 1.00 0.00 O ATOM 60 CB THR A 4 -4.610 -10.992 -6.122 1.00 0.00 C ATOM 61 OG1 THR A 4 -3.856 -9.835 -6.502 1.00 0.00 O ATOM 62 CG2 THR A 4 -6.035 -10.857 -6.632 1.00 0.00 C ATOM 0 H THR A 4 -4.793 -9.080 -4.496 1.00 0.00 H new ATOM 0 HA THR A 4 -5.310 -11.916 -4.299 1.00 0.00 H new ATOM 0 HB THR A 4 -4.165 -11.883 -6.565 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.874 -9.738 -7.477 1.00 0.00 H new ATOM 0 HG21 THR A 4 -6.024 -10.743 -7.716 1.00 0.00 H new ATOM 0 HG22 THR A 4 -6.603 -11.749 -6.366 1.00 0.00 H new ATOM 0 HG23 THR A 4 -6.502 -9.982 -6.180 1.00 0.00 H new ATOM 70 N PRO A 5 -2.934 -12.919 -4.225 1.00 0.00 N ATOM 71 CA PRO A 5 -1.625 -13.480 -3.889 1.00 0.00 C ATOM 72 C PRO A 5 -0.537 -12.900 -4.782 1.00 0.00 C ATOM 73 O PRO A 5 0.616 -12.769 -4.378 1.00 0.00 O ATOM 74 CB PRO A 5 -1.794 -14.982 -4.141 1.00 0.00 C ATOM 75 CG PRO A 5 -2.991 -15.100 -5.022 1.00 0.00 C ATOM 76 CD PRO A 5 -3.883 -13.951 -4.664 1.00 0.00 C ATOM 0 HA PRO A 5 -1.322 -13.255 -2.866 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -0.910 -15.403 -4.620 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -1.938 -15.524 -3.206 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -2.707 -15.060 -6.074 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -3.499 -16.052 -4.865 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -4.475 -13.618 -5.517 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -4.585 -14.216 -3.873 1.00 0.00 H new ATOM 84 N ASP A 6 -0.931 -12.540 -5.998 1.00 0.00 N ATOM 85 CA ASP A 6 -0.035 -11.883 -6.941 1.00 0.00 C ATOM 86 C ASP A 6 0.440 -10.546 -6.390 1.00 0.00 C ATOM 87 O ASP A 6 1.636 -10.260 -6.379 1.00 0.00 O ATOM 88 CB ASP A 6 -0.748 -11.679 -8.274 1.00 0.00 C ATOM 89 CG ASP A 6 0.044 -10.837 -9.254 1.00 0.00 C ATOM 90 OD1 ASP A 6 1.078 -11.320 -9.765 1.00 0.00 O ATOM 91 OD2 ASP A 6 -0.384 -9.702 -9.542 1.00 0.00 O ATOM 0 H ASP A 6 -1.874 -12.694 -6.356 1.00 0.00 H new ATOM 0 HA ASP A 6 0.837 -12.519 -7.094 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -0.951 -12.652 -8.722 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.712 -11.204 -8.094 1.00 0.00 H new ATOM 96 N ILE A 7 -0.501 -9.736 -5.916 1.00 0.00 N ATOM 97 CA ILE A 7 -0.168 -8.444 -5.335 1.00 0.00 C ATOM 98 C ILE A 7 0.622 -8.632 -4.043 1.00 0.00 C ATOM 99 O ILE A 7 1.609 -7.937 -3.807 1.00 0.00 O ATOM 100 CB ILE A 7 -1.432 -7.597 -5.065 1.00 0.00 C ATOM 101 CG1 ILE A 7 -2.131 -7.245 -6.383 1.00 0.00 C ATOM 102 CG2 ILE A 7 -1.091 -6.330 -4.289 1.00 0.00 C ATOM 103 CD1 ILE A 7 -1.260 -6.465 -7.351 1.00 0.00 C ATOM 0 H ILE A 7 -1.498 -9.952 -5.923 1.00 0.00 H new ATOM 0 HA ILE A 7 0.446 -7.907 -6.057 1.00 0.00 H new ATOM 0 HB ILE A 7 -2.112 -8.192 -4.455 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -2.460 -8.165 -6.866 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -3.026 -6.662 -6.164 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -2.000 -5.755 -4.114 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -0.642 -6.599 -3.333 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.387 -5.729 -4.865 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -1.824 -6.254 -8.259 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -0.952 -5.527 -6.889 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -0.377 -7.053 -7.601 1.00 0.00 H new ATOM 115 N LEU A 8 0.194 -9.589 -3.225 1.00 0.00 N ATOM 116 CA LEU A 8 0.897 -9.918 -1.987 1.00 0.00 C ATOM 117 C LEU A 8 2.343 -10.294 -2.265 1.00 0.00 C ATOM 118 O LEU A 8 3.255 -9.863 -1.559 1.00 0.00 O ATOM 119 CB LEU A 8 0.202 -11.072 -1.264 1.00 0.00 C ATOM 120 CG LEU A 8 -1.125 -10.716 -0.600 1.00 0.00 C ATOM 121 CD1 LEU A 8 -1.813 -11.971 -0.087 1.00 0.00 C ATOM 122 CD2 LEU A 8 -0.896 -9.730 0.537 1.00 0.00 C ATOM 0 H LEU A 8 -0.639 -10.152 -3.397 1.00 0.00 H new ATOM 0 HA LEU A 8 0.879 -9.032 -1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.028 -11.876 -1.979 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.878 -11.463 -0.503 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.773 -10.247 -1.341 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.758 -11.701 0.384 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.003 -12.648 -0.920 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.172 -12.465 0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.850 -9.484 1.003 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.235 -10.177 1.279 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -0.439 -8.822 0.144 1.00 0.00 H new ATOM 134 N ASP A 9 2.545 -11.102 -3.298 1.00 0.00 N ATOM 135 CA ASP A 9 3.883 -11.515 -3.696 1.00 0.00 C ATOM 136 C ASP A 9 4.701 -10.305 -4.117 1.00 0.00 C ATOM 137 O ASP A 9 5.856 -10.158 -3.722 1.00 0.00 O ATOM 138 CB ASP A 9 3.822 -12.526 -4.841 1.00 0.00 C ATOM 139 CG ASP A 9 5.173 -13.142 -5.146 1.00 0.00 C ATOM 140 OD1 ASP A 9 5.580 -14.079 -4.427 1.00 0.00 O ATOM 141 OD2 ASP A 9 5.827 -12.711 -6.116 1.00 0.00 O ATOM 0 H ASP A 9 1.797 -11.485 -3.876 1.00 0.00 H new ATOM 0 HA ASP A 9 4.362 -11.991 -2.840 1.00 0.00 H new ATOM 0 HB2 ASP A 9 3.116 -13.316 -4.586 1.00 0.00 H new ATOM 0 HB3 ASP A 9 3.441 -12.034 -5.736 1.00 0.00 H new ATOM 146 N GLN A 10 4.079 -9.425 -4.898 1.00 0.00 N ATOM 147 CA GLN A 10 4.734 -8.202 -5.352 1.00 0.00 C ATOM 148 C GLN A 10 5.137 -7.322 -4.171 1.00 0.00 C ATOM 149 O GLN A 10 6.169 -6.652 -4.215 1.00 0.00 O ATOM 150 CB GLN A 10 3.826 -7.416 -6.302 1.00 0.00 C ATOM 151 CG GLN A 10 3.509 -8.154 -7.592 1.00 0.00 C ATOM 152 CD GLN A 10 2.820 -7.274 -8.616 1.00 0.00 C ATOM 153 OE1 GLN A 10 3.054 -6.064 -8.673 1.00 0.00 O ATOM 154 NE2 GLN A 10 1.954 -7.865 -9.423 1.00 0.00 N ATOM 0 H GLN A 10 3.121 -9.537 -5.230 1.00 0.00 H new ATOM 0 HA GLN A 10 5.636 -8.494 -5.890 1.00 0.00 H new ATOM 0 HB2 GLN A 10 2.893 -7.182 -5.789 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.303 -6.467 -6.545 1.00 0.00 H new ATOM 0 HG2 GLN A 10 4.433 -8.545 -8.018 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.873 -9.011 -7.369 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.787 -8.868 -9.345 1.00 0.00 H new ATOM 0 HE22 GLN A 10 1.453 -7.317 -10.123 1.00 0.00 H new ATOM 163 N ILE A 11 4.324 -7.323 -3.116 1.00 0.00 N ATOM 164 CA ILE A 11 4.646 -6.572 -1.906 1.00 0.00 C ATOM 165 C ILE A 11 5.892 -7.153 -1.240 1.00 0.00 C ATOM 166 O ILE A 11 6.765 -6.415 -0.779 1.00 0.00 O ATOM 167 CB ILE A 11 3.477 -6.569 -0.891 1.00 0.00 C ATOM 168 CG1 ILE A 11 2.205 -6.013 -1.536 1.00 0.00 C ATOM 169 CG2 ILE A 11 3.845 -5.742 0.336 1.00 0.00 C ATOM 170 CD1 ILE A 11 0.987 -6.070 -0.636 1.00 0.00 C ATOM 0 H ILE A 11 3.442 -7.833 -3.075 1.00 0.00 H new ATOM 0 HA ILE A 11 4.831 -5.541 -2.209 1.00 0.00 H new ATOM 0 HB ILE A 11 3.289 -7.597 -0.581 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.380 -4.978 -1.829 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.997 -6.572 -2.448 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.014 -5.748 1.042 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.728 -6.169 0.811 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.056 -4.716 0.033 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.126 -5.659 -1.163 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.785 -7.106 -0.363 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.173 -5.487 0.266 1.00 0.00 H new ATOM 182 N ARG A 12 5.977 -8.479 -1.210 1.00 0.00 N ATOM 183 CA ARG A 12 7.118 -9.165 -0.674 1.00 0.00 C ATOM 184 C ARG A 12 8.359 -8.887 -1.520 1.00 0.00 C ATOM 185 O ARG A 12 9.405 -8.506 -0.994 1.00 0.00 O ATOM 186 CB ARG A 12 6.809 -10.659 -0.630 1.00 0.00 C ATOM 187 CG ARG A 12 8.018 -11.496 -0.331 1.00 0.00 C ATOM 188 CD ARG A 12 7.655 -12.942 -0.032 1.00 0.00 C ATOM 189 NE ARG A 12 6.911 -13.572 -1.128 1.00 0.00 N ATOM 190 CZ ARG A 12 6.119 -14.635 -0.975 1.00 0.00 C ATOM 191 NH1 ARG A 12 5.981 -15.191 0.225 1.00 0.00 N ATOM 192 NH2 ARG A 12 5.470 -15.145 -2.018 1.00 0.00 N ATOM 0 H ARG A 12 5.247 -9.099 -1.561 1.00 0.00 H new ATOM 0 HA ARG A 12 7.326 -8.807 0.334 1.00 0.00 H new ATOM 0 HB2 ARG A 12 6.048 -10.845 0.128 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.388 -10.966 -1.587 1.00 0.00 H new ATOM 0 HG2 ARG A 12 8.700 -11.463 -1.180 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.549 -11.073 0.521 1.00 0.00 H new ATOM 0 HD2 ARG A 12 8.566 -13.510 0.158 1.00 0.00 H new ATOM 0 HD3 ARG A 12 7.058 -12.983 0.879 1.00 0.00 H new ATOM 0 HE ARG A 12 7.005 -13.174 -2.062 1.00 0.00 H new ATOM 0 HH11 ARG A 12 6.480 -14.805 1.026 1.00 0.00 H new ATOM 0 HH12 ARG A 12 5.376 -16.004 0.344 1.00 0.00 H new ATOM 0 HH21 ARG A 12 5.576 -14.723 -2.941 1.00 0.00 H new ATOM 0 HH22 ARG A 12 4.866 -15.958 -1.895 1.00 0.00 H new ATOM 206 N VAL A 13 8.225 -9.053 -2.832 1.00 0.00 N ATOM 207 CA VAL A 13 9.317 -8.783 -3.763 1.00 0.00 C ATOM 208 C VAL A 13 9.781 -7.337 -3.633 1.00 0.00 C ATOM 209 O VAL A 13 10.969 -7.041 -3.742 1.00 0.00 O ATOM 210 CB VAL A 13 8.899 -9.050 -5.224 1.00 0.00 C ATOM 211 CG1 VAL A 13 10.046 -8.755 -6.183 1.00 0.00 C ATOM 212 CG2 VAL A 13 8.424 -10.484 -5.390 1.00 0.00 C ATOM 0 H VAL A 13 7.366 -9.375 -3.277 1.00 0.00 H new ATOM 0 HA VAL A 13 10.133 -9.458 -3.507 1.00 0.00 H new ATOM 0 HB VAL A 13 8.074 -8.380 -5.466 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.725 -8.951 -7.206 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.339 -7.709 -6.089 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.896 -9.393 -5.941 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.133 -10.653 -6.427 1.00 0.00 H new ATOM 0 HG22 VAL A 13 9.230 -11.167 -5.123 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.567 -10.661 -4.740 1.00 0.00 H new ATOM 222 N HIS A 14 8.825 -6.448 -3.376 1.00 0.00 N ATOM 223 CA HIS A 14 9.100 -5.027 -3.198 1.00 0.00 C ATOM 224 C HIS A 14 10.172 -4.792 -2.132 1.00 0.00 C ATOM 225 O HIS A 14 10.917 -3.822 -2.212 1.00 0.00 O ATOM 226 CB HIS A 14 7.809 -4.283 -2.829 1.00 0.00 C ATOM 227 CG HIS A 14 8.016 -2.846 -2.454 1.00 0.00 C ATOM 228 ND1 HIS A 14 8.386 -1.779 -3.198 1.00 0.00 N flip ATOM 229 CD2 HIS A 14 7.851 -2.376 -1.171 1.00 0.00 C flip ATOM 230 CE1 HIS A 14 8.438 -0.692 -2.359 1.00 0.00 C flip ATOM 231 NE2 HIS A 14 8.109 -1.084 -1.143 1.00 0.00 N flip ATOM 0 H HIS A 14 7.839 -6.693 -3.286 1.00 0.00 H new ATOM 0 HA HIS A 14 9.481 -4.638 -4.142 1.00 0.00 H new ATOM 0 HB2 HIS A 14 7.121 -4.332 -3.673 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.330 -4.799 -1.997 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.556 -2.973 -0.320 1.00 0.00 H new ATOM 0 HE1 HIS A 14 8.704 0.314 -2.647 1.00 0.00 H new ATOM 0 HE2 HIS A 14 8.062 -0.486 -0.318 1.00 0.00 H new ATOM 240 N GLY A 15 10.252 -5.681 -1.149 1.00 0.00 N ATOM 241 CA GLY A 15 11.248 -5.535 -0.104 1.00 0.00 C ATOM 242 C GLY A 15 12.658 -5.564 -0.657 1.00 0.00 C ATOM 243 O GLY A 15 13.470 -4.697 -0.352 1.00 0.00 O ATOM 0 H GLY A 15 9.648 -6.497 -1.057 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.085 -4.595 0.424 1.00 0.00 H new ATOM 0 HA3 GLY A 15 11.128 -6.336 0.626 1.00 0.00 H new ATOM 247 N ALA A 16 12.952 -6.561 -1.473 1.00 0.00 N ATOM 248 CA ALA A 16 14.252 -6.654 -2.124 1.00 0.00 C ATOM 249 C ALA A 16 14.358 -5.664 -3.280 1.00 0.00 C ATOM 250 O ALA A 16 15.391 -5.027 -3.481 1.00 0.00 O ATOM 251 CB ALA A 16 14.488 -8.068 -2.623 1.00 0.00 C ATOM 0 H ALA A 16 12.309 -7.319 -1.702 1.00 0.00 H new ATOM 0 HA ALA A 16 15.018 -6.403 -1.390 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.463 -8.125 -3.108 1.00 0.00 H new ATOM 0 HB2 ALA A 16 14.460 -8.760 -1.781 1.00 0.00 H new ATOM 0 HB3 ALA A 16 13.711 -8.336 -3.339 1.00 0.00 H new ATOM 257 N ASP A 17 13.269 -5.547 -4.024 1.00 0.00 N ATOM 258 CA ASP A 17 13.236 -4.777 -5.262 1.00 0.00 C ATOM 259 C ASP A 17 13.428 -3.288 -5.024 1.00 0.00 C ATOM 260 O ASP A 17 14.099 -2.607 -5.797 1.00 0.00 O ATOM 261 CB ASP A 17 11.896 -5.017 -5.952 1.00 0.00 C ATOM 262 CG ASP A 17 11.834 -4.447 -7.351 1.00 0.00 C ATOM 263 OD1 ASP A 17 12.507 -4.991 -8.255 1.00 0.00 O ATOM 264 OD2 ASP A 17 11.093 -3.465 -7.563 1.00 0.00 O ATOM 0 H ASP A 17 12.379 -5.984 -3.787 1.00 0.00 H new ATOM 0 HA ASP A 17 14.063 -5.111 -5.889 1.00 0.00 H new ATOM 0 HB2 ASP A 17 11.704 -6.089 -5.995 1.00 0.00 H new ATOM 0 HB3 ASP A 17 11.101 -4.575 -5.351 1.00 0.00 H new ATOM 269 N ALA A 18 12.844 -2.788 -3.955 1.00 0.00 N ATOM 270 CA ALA A 18 12.919 -1.370 -3.647 1.00 0.00 C ATOM 271 C ALA A 18 14.236 -1.011 -2.975 1.00 0.00 C ATOM 272 O ALA A 18 14.819 0.028 -3.269 1.00 0.00 O ATOM 273 CB ALA A 18 11.749 -0.959 -2.775 1.00 0.00 C ATOM 0 H ALA A 18 12.311 -3.340 -3.283 1.00 0.00 H new ATOM 0 HA ALA A 18 12.870 -0.822 -4.588 1.00 0.00 H new ATOM 0 HB1 ALA A 18 11.818 0.106 -2.552 1.00 0.00 H new ATOM 0 HB2 ALA A 18 10.815 -1.160 -3.300 1.00 0.00 H new ATOM 0 HB3 ALA A 18 11.771 -1.527 -1.845 1.00 0.00 H new ATOM 279 N TYR A 19 14.718 -1.887 -2.106 1.00 0.00 N ATOM 280 CA TYR A 19 15.910 -1.596 -1.317 1.00 0.00 C ATOM 281 C TYR A 19 17.149 -1.567 -2.203 1.00 0.00 C ATOM 282 O TYR A 19 17.211 -2.275 -3.214 1.00 0.00 O ATOM 283 CB TYR A 19 16.068 -2.619 -0.185 1.00 0.00 C ATOM 284 CG TYR A 19 15.257 -2.286 1.053 1.00 0.00 C ATOM 285 CD1 TYR A 19 13.893 -2.022 0.969 1.00 0.00 C ATOM 286 CD2 TYR A 19 15.858 -2.227 2.304 1.00 0.00 C ATOM 287 CE1 TYR A 19 13.154 -1.716 2.096 1.00 0.00 C ATOM 288 CE2 TYR A 19 15.126 -1.919 3.436 1.00 0.00 C ATOM 289 CZ TYR A 19 13.773 -1.663 3.326 1.00 0.00 C ATOM 290 OH TYR A 19 13.037 -1.356 4.448 1.00 0.00 O ATOM 0 H TYR A 19 14.305 -2.803 -1.928 1.00 0.00 H new ATOM 0 HA TYR A 19 15.794 -0.609 -0.869 1.00 0.00 H new ATOM 0 HB2 TYR A 19 15.770 -3.602 -0.551 1.00 0.00 H new ATOM 0 HB3 TYR A 19 17.121 -2.686 0.088 1.00 0.00 H new ATOM 0 HD1 TYR A 19 13.404 -2.057 0.007 1.00 0.00 H new ATOM 0 HD2 TYR A 19 16.916 -2.425 2.394 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.095 -1.519 2.013 1.00 0.00 H new ATOM 0 HE2 TYR A 19 15.609 -1.879 4.401 1.00 0.00 H new ATOM 0 HH TYR A 19 13.622 -1.361 5.234 1.00 0.00 H new ATOM 300 N PRO A 20 18.158 -0.749 -1.853 1.00 0.00 N ATOM 301 CA PRO A 20 18.187 0.061 -0.622 1.00 0.00 C ATOM 302 C PRO A 20 17.366 1.353 -0.711 1.00 0.00 C ATOM 303 O PRO A 20 17.303 2.124 0.250 1.00 0.00 O ATOM 304 CB PRO A 20 19.676 0.399 -0.442 1.00 0.00 C ATOM 305 CG PRO A 20 20.398 -0.284 -1.564 1.00 0.00 C ATOM 306 CD PRO A 20 19.378 -0.551 -2.631 1.00 0.00 C ATOM 0 HA PRO A 20 17.744 -0.488 0.209 1.00 0.00 H new ATOM 0 HB2 PRO A 20 19.837 1.477 -0.474 1.00 0.00 H new ATOM 0 HB3 PRO A 20 20.040 0.051 0.525 1.00 0.00 H new ATOM 0 HG2 PRO A 20 21.203 0.344 -1.946 1.00 0.00 H new ATOM 0 HG3 PRO A 20 20.854 -1.213 -1.222 1.00 0.00 H new ATOM 0 HD2 PRO A 20 19.287 0.285 -3.325 1.00 0.00 H new ATOM 0 HD3 PRO A 20 19.630 -1.431 -3.223 1.00 0.00 H new ATOM 314 N GLU A 21 16.776 1.599 -1.875 1.00 0.00 N ATOM 315 CA GLU A 21 15.981 2.803 -2.113 1.00 0.00 C ATOM 316 C GLU A 21 14.712 2.826 -1.247 1.00 0.00 C ATOM 317 O GLU A 21 14.586 2.068 -0.285 1.00 0.00 O ATOM 318 CB GLU A 21 15.606 2.883 -3.592 1.00 0.00 C ATOM 319 CG GLU A 21 16.802 2.997 -4.522 1.00 0.00 C ATOM 320 CD GLU A 21 17.336 4.409 -4.613 1.00 0.00 C ATOM 321 OE1 GLU A 21 18.196 4.785 -3.794 1.00 0.00 O ATOM 322 OE2 GLU A 21 16.886 5.155 -5.508 1.00 0.00 O ATOM 0 H GLU A 21 16.833 0.974 -2.679 1.00 0.00 H new ATOM 0 HA GLU A 21 16.584 3.668 -1.837 1.00 0.00 H new ATOM 0 HB2 GLU A 21 15.032 1.996 -3.860 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.954 3.743 -3.746 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.594 2.335 -4.172 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.517 2.655 -5.517 1.00 0.00 H new ATOM 329 N GLU A 22 13.781 3.713 -1.593 1.00 0.00 N ATOM 330 CA GLU A 22 12.564 3.911 -0.807 1.00 0.00 C ATOM 331 C GLU A 22 11.757 2.619 -0.677 1.00 0.00 C ATOM 332 O GLU A 22 11.461 1.950 -1.667 1.00 0.00 O ATOM 333 CB GLU A 22 11.700 5.008 -1.434 1.00 0.00 C ATOM 334 CG GLU A 22 10.443 5.322 -0.635 1.00 0.00 C ATOM 335 CD GLU A 22 10.744 5.729 0.792 1.00 0.00 C ATOM 336 OE1 GLU A 22 10.823 4.838 1.667 1.00 0.00 O ATOM 337 OE2 GLU A 22 10.912 6.938 1.044 1.00 0.00 O ATOM 0 H GLU A 22 13.847 4.310 -2.418 1.00 0.00 H new ATOM 0 HA GLU A 22 12.866 4.217 0.194 1.00 0.00 H new ATOM 0 HB2 GLU A 22 12.295 5.916 -1.532 1.00 0.00 H new ATOM 0 HB3 GLU A 22 11.414 4.703 -2.441 1.00 0.00 H new ATOM 0 HG2 GLU A 22 9.894 6.124 -1.129 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.793 4.447 -0.630 1.00 0.00 H new ATOM 344 N GLY A 23 11.390 2.290 0.555 1.00 0.00 N ATOM 345 CA GLY A 23 10.649 1.075 0.811 1.00 0.00 C ATOM 346 C GLY A 23 9.211 1.353 1.193 1.00 0.00 C ATOM 347 O GLY A 23 8.419 0.428 1.379 1.00 0.00 O ATOM 0 H GLY A 23 11.595 2.848 1.384 1.00 0.00 H new ATOM 0 HA2 GLY A 23 10.672 0.443 -0.077 1.00 0.00 H new ATOM 0 HA3 GLY A 23 11.135 0.517 1.612 1.00 0.00 H new ATOM 351 N CYS A 24 8.869 2.626 1.301 1.00 0.00 N ATOM 352 CA CYS A 24 7.517 3.021 1.665 1.00 0.00 C ATOM 353 C CYS A 24 6.669 3.250 0.419 1.00 0.00 C ATOM 354 O CYS A 24 7.194 3.398 -0.689 1.00 0.00 O ATOM 355 CB CYS A 24 7.554 4.289 2.518 1.00 0.00 C ATOM 356 SG CYS A 24 8.661 4.179 3.944 1.00 0.00 S ATOM 0 H CYS A 24 9.509 3.404 1.142 1.00 0.00 H new ATOM 0 HA CYS A 24 7.065 2.216 2.244 1.00 0.00 H new ATOM 0 HB2 CYS A 24 7.864 5.127 1.893 1.00 0.00 H new ATOM 0 HB3 CYS A 24 6.546 4.509 2.869 1.00 0.00 H new ATOM 0 HG CYS A 24 9.882 4.414 3.565 1.00 0.00 H new ATOM 362 N GLY A 25 5.359 3.267 0.603 1.00 0.00 N ATOM 363 CA GLY A 25 4.459 3.504 -0.503 1.00 0.00 C ATOM 364 C GLY A 25 3.010 3.487 -0.071 1.00 0.00 C ATOM 365 O GLY A 25 2.715 3.362 1.118 1.00 0.00 O ATOM 0 H GLY A 25 4.902 3.120 1.503 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.690 4.467 -0.958 1.00 0.00 H new ATOM 0 HA3 GLY A 25 4.618 2.744 -1.268 1.00 0.00 H new ATOM 369 N PHE A 26 2.105 3.579 -1.034 1.00 0.00 N ATOM 370 CA PHE A 26 0.683 3.654 -0.739 1.00 0.00 C ATOM 371 C PHE A 26 -0.073 2.539 -1.454 1.00 0.00 C ATOM 372 O PHE A 26 0.326 2.100 -2.537 1.00 0.00 O ATOM 373 CB PHE A 26 0.122 5.018 -1.159 1.00 0.00 C ATOM 374 CG PHE A 26 0.738 6.180 -0.428 1.00 0.00 C ATOM 375 CD1 PHE A 26 0.189 6.636 0.761 1.00 0.00 C ATOM 376 CD2 PHE A 26 1.862 6.819 -0.931 1.00 0.00 C ATOM 377 CE1 PHE A 26 0.750 7.706 1.433 1.00 0.00 C ATOM 378 CE2 PHE A 26 2.426 7.889 -0.263 1.00 0.00 C ATOM 379 CZ PHE A 26 1.870 8.332 0.921 1.00 0.00 C ATOM 0 H PHE A 26 2.331 3.604 -2.028 1.00 0.00 H new ATOM 0 HA PHE A 26 0.551 3.533 0.336 1.00 0.00 H new ATOM 0 HB2 PHE A 26 0.278 5.150 -2.230 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -0.955 5.025 -0.991 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -0.686 6.150 1.166 1.00 0.00 H new ATOM 0 HD2 PHE A 26 2.302 6.476 -1.856 1.00 0.00 H new ATOM 0 HE1 PHE A 26 0.313 8.052 2.358 1.00 0.00 H new ATOM 0 HE2 PHE A 26 3.300 8.378 -0.666 1.00 0.00 H new ATOM 0 HZ PHE A 26 2.310 9.167 1.446 1.00 0.00 H new ATOM 389 N LEU A 27 -1.155 2.083 -0.840 1.00 0.00 N ATOM 390 CA LEU A 27 -1.996 1.049 -1.424 1.00 0.00 C ATOM 391 C LEU A 27 -3.153 1.686 -2.174 1.00 0.00 C ATOM 392 O LEU A 27 -3.948 2.424 -1.587 1.00 0.00 O ATOM 393 CB LEU A 27 -2.548 0.124 -0.335 1.00 0.00 C ATOM 394 CG LEU A 27 -1.504 -0.649 0.468 1.00 0.00 C ATOM 395 CD1 LEU A 27 -2.163 -1.386 1.621 1.00 0.00 C ATOM 396 CD2 LEU A 27 -0.758 -1.626 -0.425 1.00 0.00 C ATOM 0 H LEU A 27 -1.473 2.416 0.070 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.389 0.462 -2.114 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.142 0.721 0.356 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.225 -0.592 -0.801 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.786 0.064 0.874 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.406 -1.932 2.184 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.656 -0.669 2.277 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.901 -2.087 1.231 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.019 -2.167 0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.464 -2.334 -0.859 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.255 -1.079 -1.223 1.00 0.00 H new ATOM 408 N LEU A 28 -3.245 1.409 -3.463 1.00 0.00 N ATOM 409 CA LEU A 28 -4.320 1.952 -4.274 1.00 0.00 C ATOM 410 C LEU A 28 -5.341 0.864 -4.571 1.00 0.00 C ATOM 411 O LEU A 28 -4.984 -0.249 -4.970 1.00 0.00 O ATOM 412 CB LEU A 28 -3.767 2.523 -5.583 1.00 0.00 C ATOM 413 CG LEU A 28 -2.676 3.586 -5.423 1.00 0.00 C ATOM 414 CD1 LEU A 28 -2.202 4.083 -6.780 1.00 0.00 C ATOM 415 CD2 LEU A 28 -3.175 4.748 -4.576 1.00 0.00 C ATOM 0 H LEU A 28 -2.590 0.813 -3.969 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.804 2.757 -3.721 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.367 1.702 -6.178 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.592 2.955 -6.149 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.830 3.126 -4.912 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.427 4.837 -6.641 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.797 3.248 -7.352 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.041 4.520 -7.321 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.384 5.491 -4.475 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.041 5.203 -5.057 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.458 4.383 -3.589 1.00 0.00 H new ATOM 427 N GLY A 29 -6.608 1.178 -4.375 1.00 0.00 N ATOM 428 CA GLY A 29 -7.647 0.203 -4.611 1.00 0.00 C ATOM 429 C GLY A 29 -9.026 0.799 -4.473 1.00 0.00 C ATOM 430 O GLY A 29 -9.211 1.999 -4.669 1.00 0.00 O ATOM 0 H GLY A 29 -6.936 2.090 -4.057 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -7.531 -0.215 -5.611 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -7.537 -0.622 -3.907 1.00 0.00 H new ATOM 434 N THR A 30 -9.994 -0.041 -4.146 1.00 0.00 N ATOM 435 CA THR A 30 -11.365 0.405 -3.978 1.00 0.00 C ATOM 436 C THR A 30 -11.962 -0.227 -2.730 1.00 0.00 C ATOM 437 O THR A 30 -11.472 -1.248 -2.247 1.00 0.00 O ATOM 438 CB THR A 30 -12.231 0.037 -5.189 1.00 0.00 C ATOM 439 OG1 THR A 30 -11.392 -0.266 -6.316 1.00 0.00 O ATOM 440 CG2 THR A 30 -13.173 1.175 -5.551 1.00 0.00 C ATOM 0 H THR A 30 -9.854 -1.039 -3.991 1.00 0.00 H new ATOM 0 HA THR A 30 -11.351 1.491 -3.882 1.00 0.00 H new ATOM 0 HB THR A 30 -12.826 -0.838 -4.927 1.00 0.00 H new ATOM 0 HG1 THR A 30 -11.951 -0.502 -7.086 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.776 0.888 -6.413 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.827 1.389 -4.706 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.592 2.065 -5.794 1.00 0.00 H new ATOM 448 N VAL A 31 -13.019 0.366 -2.216 1.00 0.00 N ATOM 449 CA VAL A 31 -13.659 -0.151 -1.021 1.00 0.00 C ATOM 450 C VAL A 31 -14.869 -0.986 -1.401 1.00 0.00 C ATOM 451 O VAL A 31 -15.829 -0.492 -1.992 1.00 0.00 O ATOM 452 CB VAL A 31 -14.072 0.973 -0.049 1.00 0.00 C ATOM 453 CG1 VAL A 31 -14.588 0.389 1.255 1.00 0.00 C ATOM 454 CG2 VAL A 31 -12.904 1.911 0.215 1.00 0.00 C ATOM 0 H VAL A 31 -13.453 1.203 -2.604 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.931 -0.776 -0.503 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.875 1.546 -0.513 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -14.874 1.197 1.928 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -15.455 -0.240 1.054 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.805 -0.210 1.720 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -13.217 2.697 0.903 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -12.079 1.350 0.655 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -12.578 2.359 -0.724 1.00 0.00 H new ATOM 464 N THR A 32 -14.806 -2.256 -1.054 1.00 0.00 N ATOM 465 CA THR A 32 -15.824 -3.211 -1.429 1.00 0.00 C ATOM 466 C THR A 32 -17.017 -3.125 -0.488 1.00 0.00 C ATOM 467 O THR A 32 -16.910 -3.447 0.700 1.00 0.00 O ATOM 468 CB THR A 32 -15.261 -4.631 -1.387 1.00 0.00 C ATOM 469 OG1 THR A 32 -13.958 -4.655 -1.987 1.00 0.00 O ATOM 470 CG2 THR A 32 -16.171 -5.598 -2.115 1.00 0.00 C ATOM 0 H THR A 32 -14.045 -2.653 -0.503 1.00 0.00 H new ATOM 0 HA THR A 32 -16.147 -2.974 -2.442 1.00 0.00 H new ATOM 0 HB THR A 32 -15.192 -4.939 -0.344 1.00 0.00 H new ATOM 0 HG1 THR A 32 -13.600 -5.567 -1.956 1.00 0.00 H new ATOM 0 HG21 THR A 32 -15.747 -6.601 -2.070 1.00 0.00 H new ATOM 0 HG22 THR A 32 -17.154 -5.598 -1.643 1.00 0.00 H new ATOM 0 HG23 THR A 32 -16.268 -5.292 -3.157 1.00 0.00 H new ATOM 478 N ASP A 33 -18.132 -2.648 -1.029 1.00 0.00 N ATOM 479 CA ASP A 33 -19.404 -2.533 -0.296 1.00 0.00 C ATOM 480 C ASP A 33 -19.288 -1.531 0.849 1.00 0.00 C ATOM 481 O ASP A 33 -20.199 -1.384 1.664 1.00 0.00 O ATOM 482 CB ASP A 33 -19.815 -3.899 0.246 1.00 0.00 C ATOM 483 CG ASP A 33 -21.315 -4.043 0.419 1.00 0.00 C ATOM 484 OD1 ASP A 33 -21.986 -4.481 -0.538 1.00 0.00 O ATOM 485 OD2 ASP A 33 -21.830 -3.732 1.513 1.00 0.00 O ATOM 0 H ASP A 33 -18.188 -2.326 -1.995 1.00 0.00 H new ATOM 0 HA ASP A 33 -20.166 -2.173 -0.987 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -19.457 -4.675 -0.431 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -19.327 -4.064 1.206 1.00 0.00 H new ATOM 490 N ASP A 34 -18.151 -0.852 0.891 1.00 0.00 N ATOM 491 CA ASP A 34 -17.810 0.088 1.965 1.00 0.00 C ATOM 492 C ASP A 34 -17.662 -0.657 3.291 1.00 0.00 C ATOM 493 O ASP A 34 -17.683 -0.070 4.371 1.00 0.00 O ATOM 494 CB ASP A 34 -18.851 1.206 2.073 1.00 0.00 C ATOM 495 CG ASP A 34 -18.377 2.365 2.936 1.00 0.00 C ATOM 496 OD1 ASP A 34 -17.391 3.031 2.552 1.00 0.00 O ATOM 497 OD2 ASP A 34 -18.990 2.623 3.997 1.00 0.00 O ATOM 0 H ASP A 34 -17.428 -0.934 0.176 1.00 0.00 H new ATOM 0 HA ASP A 34 -16.855 0.554 1.723 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -19.088 1.574 1.075 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -19.773 0.800 2.490 1.00 0.00 H new ATOM 502 N GLY A 35 -17.499 -1.967 3.194 1.00 0.00 N ATOM 503 CA GLY A 35 -17.298 -2.781 4.373 1.00 0.00 C ATOM 504 C GLY A 35 -15.836 -3.077 4.599 1.00 0.00 C ATOM 505 O GLY A 35 -15.343 -3.006 5.725 1.00 0.00 O ATOM 0 H GLY A 35 -17.502 -2.483 2.314 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.705 -2.268 5.244 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -17.848 -3.716 4.268 1.00 0.00 H new ATOM 509 N ASP A 36 -15.141 -3.400 3.519 1.00 0.00 N ATOM 510 CA ASP A 36 -13.715 -3.677 3.573 1.00 0.00 C ATOM 511 C ASP A 36 -13.069 -3.194 2.286 1.00 0.00 C ATOM 512 O ASP A 36 -13.747 -3.041 1.272 1.00 0.00 O ATOM 513 CB ASP A 36 -13.466 -5.173 3.769 1.00 0.00 C ATOM 514 CG ASP A 36 -12.007 -5.501 4.012 1.00 0.00 C ATOM 515 OD1 ASP A 36 -11.263 -4.624 4.493 1.00 0.00 O ATOM 516 OD2 ASP A 36 -11.593 -6.641 3.716 1.00 0.00 O ATOM 0 H ASP A 36 -15.547 -3.477 2.586 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.275 -3.151 4.420 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.058 -5.527 4.613 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.813 -5.712 2.887 1.00 0.00 H new ATOM 521 N ASN A 37 -11.775 -2.953 2.319 1.00 0.00 N ATOM 522 CA ASN A 37 -11.090 -2.378 1.171 1.00 0.00 C ATOM 523 C ASN A 37 -10.313 -3.442 0.411 1.00 0.00 C ATOM 524 O ASN A 37 -9.835 -4.419 0.993 1.00 0.00 O ATOM 525 CB ASN A 37 -10.148 -1.247 1.604 1.00 0.00 C ATOM 526 CG ASN A 37 -8.885 -1.741 2.293 1.00 0.00 C ATOM 527 OD1 ASN A 37 -7.875 -2.011 1.642 1.00 0.00 O ATOM 528 ND2 ASN A 37 -8.926 -1.856 3.611 1.00 0.00 N ATOM 0 H ASN A 37 -11.175 -3.144 3.122 1.00 0.00 H new ATOM 0 HA ASN A 37 -11.849 -1.963 0.508 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.869 -0.661 0.728 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.682 -0.578 2.278 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.103 -2.177 4.121 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.781 -1.623 4.117 1.00 0.00 H new ATOM 535 N ARG A 38 -10.226 -3.271 -0.899 1.00 0.00 N ATOM 536 CA ARG A 38 -9.415 -4.143 -1.723 1.00 0.00 C ATOM 537 C ARG A 38 -8.291 -3.356 -2.371 1.00 0.00 C ATOM 538 O ARG A 38 -8.431 -2.175 -2.689 1.00 0.00 O ATOM 539 CB ARG A 38 -10.213 -4.852 -2.813 1.00 0.00 C ATOM 540 CG ARG A 38 -10.408 -4.019 -4.058 1.00 0.00 C ATOM 541 CD ARG A 38 -10.503 -4.885 -5.305 1.00 0.00 C ATOM 542 NE ARG A 38 -9.187 -5.412 -5.693 1.00 0.00 N ATOM 543 CZ ARG A 38 -8.937 -6.078 -6.825 1.00 0.00 C ATOM 544 NH1 ARG A 38 -9.929 -6.397 -7.654 1.00 0.00 N ATOM 545 NH2 ARG A 38 -7.689 -6.437 -7.111 1.00 0.00 N ATOM 0 H ARG A 38 -10.709 -2.534 -1.412 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.016 -4.907 -1.056 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -9.703 -5.777 -3.081 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -11.189 -5.129 -2.415 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -11.315 -3.423 -3.959 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -9.578 -3.321 -4.162 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.189 -5.712 -5.124 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -10.919 -4.300 -6.125 1.00 0.00 H new ATOM 0 HE ARG A 38 -8.408 -5.259 -5.052 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -10.888 -6.133 -7.427 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -9.730 -6.905 -8.516 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -6.931 -6.204 -6.469 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -7.489 -6.945 -7.972 1.00 0.00 H new ATOM 559 N VAL A 39 -7.186 -4.029 -2.558 1.00 0.00 N ATOM 560 CA VAL A 39 -6.030 -3.444 -3.206 1.00 0.00 C ATOM 561 C VAL A 39 -6.021 -3.850 -4.673 1.00 0.00 C ATOM 562 O VAL A 39 -6.213 -5.024 -4.999 1.00 0.00 O ATOM 563 CB VAL A 39 -4.712 -3.882 -2.530 1.00 0.00 C ATOM 564 CG1 VAL A 39 -3.515 -3.218 -3.195 1.00 0.00 C ATOM 565 CG2 VAL A 39 -4.745 -3.562 -1.043 1.00 0.00 C ATOM 0 H VAL A 39 -7.057 -4.998 -2.267 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.100 -2.360 -3.116 1.00 0.00 H new ATOM 0 HB VAL A 39 -4.609 -4.961 -2.649 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.599 -3.542 -2.702 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.480 -3.501 -4.247 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -3.608 -2.135 -3.113 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -3.809 -3.877 -0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -4.874 -2.489 -0.905 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.576 -4.091 -0.575 1.00 0.00 H new ATOM 575 N ALA A 40 -5.840 -2.881 -5.553 1.00 0.00 N ATOM 576 CA ALA A 40 -5.866 -3.145 -6.983 1.00 0.00 C ATOM 577 C ALA A 40 -4.537 -2.788 -7.636 1.00 0.00 C ATOM 578 O ALA A 40 -4.204 -3.302 -8.700 1.00 0.00 O ATOM 579 CB ALA A 40 -7.006 -2.379 -7.640 1.00 0.00 C ATOM 0 H ALA A 40 -5.674 -1.906 -5.304 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.031 -4.213 -7.126 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.014 -2.586 -8.710 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.954 -2.692 -7.203 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.867 -1.310 -7.478 1.00 0.00 H new ATOM 585 N ALA A 41 -3.780 -1.903 -6.998 1.00 0.00 N ATOM 586 CA ALA A 41 -2.489 -1.489 -7.528 1.00 0.00 C ATOM 587 C ALA A 41 -1.558 -1.041 -6.407 1.00 0.00 C ATOM 588 O ALA A 41 -2.000 -0.469 -5.408 1.00 0.00 O ATOM 589 CB ALA A 41 -2.662 -0.370 -8.545 1.00 0.00 C ATOM 0 H ALA A 41 -4.038 -1.460 -6.116 1.00 0.00 H new ATOM 0 HA ALA A 41 -2.039 -2.348 -8.026 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -1.686 -0.074 -8.930 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -3.286 -0.719 -9.368 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -3.138 0.486 -8.067 1.00 0.00 H new ATOM 595 N LEU A 42 -0.274 -1.318 -6.573 1.00 0.00 N ATOM 596 CA LEU A 42 0.731 -0.897 -5.608 1.00 0.00 C ATOM 597 C LEU A 42 1.455 0.337 -6.123 1.00 0.00 C ATOM 598 O LEU A 42 1.884 0.371 -7.277 1.00 0.00 O ATOM 599 CB LEU A 42 1.745 -2.018 -5.373 1.00 0.00 C ATOM 600 CG LEU A 42 1.166 -3.323 -4.830 1.00 0.00 C ATOM 601 CD1 LEU A 42 2.248 -4.387 -4.745 1.00 0.00 C ATOM 602 CD2 LEU A 42 0.538 -3.093 -3.465 1.00 0.00 C ATOM 0 H LEU A 42 0.098 -1.834 -7.370 1.00 0.00 H new ATOM 0 HA LEU A 42 0.233 -0.663 -4.667 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.252 -2.229 -6.315 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.503 -1.659 -4.677 1.00 0.00 H new ATOM 0 HG LEU A 42 0.392 -3.672 -5.513 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.820 -5.311 -4.356 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.660 -4.567 -5.738 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.041 -4.047 -4.080 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.129 -4.031 -3.090 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.296 -2.725 -2.773 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.262 -2.358 -3.552 1.00 0.00 H new ATOM 614 N HIS A 43 1.593 1.349 -5.284 1.00 0.00 N ATOM 615 CA HIS A 43 2.296 2.551 -5.689 1.00 0.00 C ATOM 616 C HIS A 43 3.522 2.778 -4.814 1.00 0.00 C ATOM 617 O HIS A 43 3.421 2.873 -3.590 1.00 0.00 O ATOM 618 CB HIS A 43 1.372 3.773 -5.636 1.00 0.00 C ATOM 619 CG HIS A 43 1.987 5.007 -6.222 1.00 0.00 C ATOM 620 ND1 HIS A 43 2.009 5.266 -7.574 1.00 0.00 N ATOM 621 CD2 HIS A 43 2.615 6.051 -5.631 1.00 0.00 C ATOM 622 CE1 HIS A 43 2.624 6.415 -7.792 1.00 0.00 C ATOM 623 NE2 HIS A 43 3.002 6.912 -6.629 1.00 0.00 N ATOM 0 H HIS A 43 1.232 1.362 -4.330 1.00 0.00 H new ATOM 0 HA HIS A 43 2.624 2.415 -6.720 1.00 0.00 H new ATOM 0 HB2 HIS A 43 0.450 3.546 -6.171 1.00 0.00 H new ATOM 0 HB3 HIS A 43 1.099 3.969 -4.599 1.00 0.00 H new ATOM 0 HD2 HIS A 43 2.781 6.182 -4.572 1.00 0.00 H new ATOM 0 HE1 HIS A 43 2.789 6.870 -8.757 1.00 0.00 H new ATOM 0 HE2 HIS A 43 3.500 7.792 -6.493 1.00 0.00 H new ATOM 632 N ARG A 44 4.674 2.848 -5.452 1.00 0.00 N ATOM 633 CA ARG A 44 5.921 3.145 -4.765 1.00 0.00 C ATOM 634 C ARG A 44 6.152 4.647 -4.740 1.00 0.00 C ATOM 635 O ARG A 44 5.836 5.341 -5.709 1.00 0.00 O ATOM 636 CB ARG A 44 7.108 2.437 -5.434 1.00 0.00 C ATOM 637 CG ARG A 44 7.228 0.960 -5.083 1.00 0.00 C ATOM 638 CD ARG A 44 6.153 0.114 -5.747 1.00 0.00 C ATOM 639 NE ARG A 44 6.349 0.013 -7.192 1.00 0.00 N ATOM 640 CZ ARG A 44 5.539 -0.656 -8.011 1.00 0.00 C ATOM 641 NH1 ARG A 44 4.472 -1.283 -7.537 1.00 0.00 N ATOM 642 NH2 ARG A 44 5.798 -0.699 -9.308 1.00 0.00 N ATOM 0 H ARG A 44 4.775 2.702 -6.456 1.00 0.00 H new ATOM 0 HA ARG A 44 5.843 2.775 -3.743 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.014 2.536 -6.515 1.00 0.00 H new ATOM 0 HB3 ARG A 44 8.029 2.944 -5.146 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.210 0.597 -5.386 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.163 0.841 -4.002 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.157 -0.885 -5.310 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.174 0.547 -5.544 1.00 0.00 H new ATOM 0 HE ARG A 44 7.157 0.484 -7.599 1.00 0.00 H new ATOM 0 HH11 ARG A 44 4.266 -1.255 -6.538 1.00 0.00 H new ATOM 0 HH12 ARG A 44 3.857 -1.793 -8.171 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.618 -0.220 -9.681 1.00 0.00 H new ATOM 0 HH22 ARG A 44 5.178 -1.211 -9.935 1.00 0.00 H new ATOM 656 N ALA A 45 6.641 5.154 -3.618 1.00 0.00 N ATOM 657 CA ALA A 45 6.913 6.578 -3.482 1.00 0.00 C ATOM 658 C ALA A 45 8.023 7.015 -4.436 1.00 0.00 C ATOM 659 O ALA A 45 9.199 6.727 -4.215 1.00 0.00 O ATOM 660 CB ALA A 45 7.278 6.908 -2.043 1.00 0.00 C ATOM 0 H ALA A 45 6.858 4.601 -2.789 1.00 0.00 H new ATOM 0 HA ALA A 45 6.010 7.128 -3.746 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.479 7.976 -1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.450 6.639 -1.387 1.00 0.00 H new ATOM 0 HB3 ALA A 45 8.167 6.346 -1.755 1.00 0.00 H new ATOM 666 N THR A 46 7.631 7.698 -5.501 1.00 0.00 N ATOM 667 CA THR A 46 8.565 8.176 -6.505 1.00 0.00 C ATOM 668 C THR A 46 7.926 9.328 -7.282 1.00 0.00 C ATOM 669 O THR A 46 6.768 9.679 -7.034 1.00 0.00 O ATOM 670 CB THR A 46 8.987 7.039 -7.476 1.00 0.00 C ATOM 671 OG1 THR A 46 10.033 7.484 -8.353 1.00 0.00 O ATOM 672 CG2 THR A 46 7.802 6.555 -8.305 1.00 0.00 C ATOM 0 H THR A 46 6.658 7.935 -5.692 1.00 0.00 H new ATOM 0 HA THR A 46 9.466 8.527 -6.001 1.00 0.00 H new ATOM 0 HB THR A 46 9.353 6.210 -6.870 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.287 6.754 -8.956 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.128 5.759 -8.975 1.00 0.00 H new ATOM 0 HG22 THR A 46 7.025 6.175 -7.642 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.405 7.384 -8.891 1.00 0.00 H new ATOM 680 N ASN A 47 8.666 9.901 -8.219 1.00 0.00 N ATOM 681 CA ASN A 47 8.189 11.052 -8.976 1.00 0.00 C ATOM 682 C ASN A 47 7.341 10.609 -10.163 1.00 0.00 C ATOM 683 O ASN A 47 7.349 9.439 -10.547 1.00 0.00 O ATOM 684 CB ASN A 47 9.365 11.915 -9.461 1.00 0.00 C ATOM 685 CG ASN A 47 10.264 11.209 -10.470 1.00 0.00 C ATOM 686 OD1 ASN A 47 10.433 9.990 -10.437 1.00 0.00 O ATOM 687 ND2 ASN A 47 10.846 11.982 -11.377 1.00 0.00 N ATOM 0 H ASN A 47 9.602 9.588 -8.475 1.00 0.00 H new ATOM 0 HA ASN A 47 7.569 11.652 -8.311 1.00 0.00 H new ATOM 0 HB2 ASN A 47 8.974 12.827 -9.911 1.00 0.00 H new ATOM 0 HB3 ASN A 47 9.964 12.215 -8.601 1.00 0.00 H new ATOM 0 HD21 ASN A 47 11.459 11.570 -12.081 1.00 0.00 H new ATOM 0 HD22 ASN A 47 10.681 12.988 -11.371 1.00 0.00 H new ATOM 694 N ARG A 48 6.603 11.549 -10.740 1.00 0.00 N ATOM 695 CA ARG A 48 5.759 11.249 -11.888 1.00 0.00 C ATOM 696 C ARG A 48 5.641 12.464 -12.800 1.00 0.00 C ATOM 697 O ARG A 48 6.151 12.451 -13.918 1.00 0.00 O ATOM 698 CB ARG A 48 4.370 10.791 -11.432 1.00 0.00 C ATOM 699 CG ARG A 48 3.453 10.329 -12.562 1.00 0.00 C ATOM 700 CD ARG A 48 3.990 9.091 -13.276 1.00 0.00 C ATOM 701 NE ARG A 48 5.070 9.408 -14.211 1.00 0.00 N ATOM 702 CZ ARG A 48 6.231 8.752 -14.269 1.00 0.00 C ATOM 703 NH1 ARG A 48 6.476 7.749 -13.429 1.00 0.00 N ATOM 704 NH2 ARG A 48 7.147 9.108 -15.160 1.00 0.00 N ATOM 0 H ARG A 48 6.572 12.521 -10.433 1.00 0.00 H new ATOM 0 HA ARG A 48 6.224 10.439 -12.449 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.486 9.975 -10.719 1.00 0.00 H new ATOM 0 HB3 ARG A 48 3.887 11.611 -10.901 1.00 0.00 H new ATOM 0 HG2 ARG A 48 2.464 10.112 -12.158 1.00 0.00 H new ATOM 0 HG3 ARG A 48 3.333 11.138 -13.283 1.00 0.00 H new ATOM 0 HD2 ARG A 48 4.352 8.377 -12.536 1.00 0.00 H new ATOM 0 HD3 ARG A 48 3.177 8.606 -13.816 1.00 0.00 H new ATOM 0 HE ARG A 48 4.926 10.181 -14.861 1.00 0.00 H new ATOM 0 HH11 ARG A 48 5.775 7.480 -12.738 1.00 0.00 H new ATOM 0 HH12 ARG A 48 7.364 7.250 -13.476 1.00 0.00 H new ATOM 0 HH21 ARG A 48 6.963 9.882 -15.799 1.00 0.00 H new ATOM 0 HH22 ARG A 48 8.035 8.608 -15.206 1.00 0.00 H new ATOM 718 N ARG A 49 4.985 13.513 -12.303 1.00 0.00 N ATOM 719 CA ARG A 49 4.750 14.733 -13.080 1.00 0.00 C ATOM 720 C ARG A 49 3.881 14.431 -14.301 1.00 0.00 C ATOM 721 O ARG A 49 4.384 14.121 -15.385 1.00 0.00 O ATOM 722 CB ARG A 49 6.077 15.388 -13.501 1.00 0.00 C ATOM 723 CG ARG A 49 5.912 16.611 -14.395 1.00 0.00 C ATOM 724 CD ARG A 49 7.258 17.190 -14.806 1.00 0.00 C ATOM 725 NE ARG A 49 7.953 17.823 -13.684 1.00 0.00 N ATOM 726 CZ ARG A 49 9.268 17.745 -13.478 1.00 0.00 C ATOM 727 NH1 ARG A 49 10.030 17.013 -14.278 1.00 0.00 N ATOM 728 NH2 ARG A 49 9.819 18.392 -12.461 1.00 0.00 N ATOM 0 H ARG A 49 4.604 13.543 -11.357 1.00 0.00 H new ATOM 0 HA ARG A 49 4.218 15.441 -12.445 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.627 15.678 -12.605 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.685 14.649 -14.023 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.346 16.338 -15.285 1.00 0.00 H new ATOM 0 HG3 ARG A 49 5.333 17.371 -13.870 1.00 0.00 H new ATOM 0 HD2 ARG A 49 7.882 16.397 -15.217 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.110 17.923 -15.599 1.00 0.00 H new ATOM 0 HE ARG A 49 7.396 18.358 -13.017 1.00 0.00 H new ATOM 0 HH11 ARG A 49 9.611 16.505 -15.057 1.00 0.00 H new ATOM 0 HH12 ARG A 49 11.035 16.958 -14.115 1.00 0.00 H new ATOM 0 HH21 ARG A 49 9.237 18.950 -11.836 1.00 0.00 H new ATOM 0 HH22 ARG A 49 10.825 18.332 -12.303 1.00 0.00 H new ATOM 742 N SER A 50 2.575 14.484 -14.107 1.00 0.00 N ATOM 743 CA SER A 50 1.633 14.223 -15.177 1.00 0.00 C ATOM 744 C SER A 50 1.401 15.488 -15.998 1.00 0.00 C ATOM 745 O SER A 50 1.096 16.547 -15.448 1.00 0.00 O ATOM 746 CB SER A 50 0.321 13.723 -14.577 1.00 0.00 C ATOM 747 OG SER A 50 0.565 12.696 -13.626 1.00 0.00 O ATOM 0 H SER A 50 2.142 14.707 -13.211 1.00 0.00 H new ATOM 0 HA SER A 50 2.038 13.460 -15.841 1.00 0.00 H new ATOM 0 HB2 SER A 50 -0.205 14.550 -14.100 1.00 0.00 H new ATOM 0 HB3 SER A 50 -0.327 13.347 -15.369 1.00 0.00 H new ATOM 0 HG SER A 50 -0.287 12.389 -13.251 1.00 0.00 H new ATOM 753 N GLU A 51 1.566 15.378 -17.309 1.00 0.00 N ATOM 754 CA GLU A 51 1.401 16.518 -18.193 1.00 0.00 C ATOM 755 C GLU A 51 0.051 16.430 -18.887 1.00 0.00 C ATOM 756 O GLU A 51 -0.141 15.636 -19.812 1.00 0.00 O ATOM 757 CB GLU A 51 2.529 16.562 -19.232 1.00 0.00 C ATOM 758 CG GLU A 51 2.856 17.961 -19.751 1.00 0.00 C ATOM 759 CD GLU A 51 1.678 18.663 -20.403 1.00 0.00 C ATOM 760 OE1 GLU A 51 1.345 18.333 -21.563 1.00 0.00 O ATOM 761 OE2 GLU A 51 1.089 19.561 -19.766 1.00 0.00 O ATOM 0 H GLU A 51 1.814 14.509 -17.782 1.00 0.00 H new ATOM 0 HA GLU A 51 1.445 17.433 -17.603 1.00 0.00 H new ATOM 0 HB2 GLU A 51 3.429 16.132 -18.792 1.00 0.00 H new ATOM 0 HB3 GLU A 51 2.253 15.930 -20.076 1.00 0.00 H new ATOM 0 HG2 GLU A 51 3.217 18.571 -18.923 1.00 0.00 H new ATOM 0 HG3 GLU A 51 3.670 17.890 -20.473 1.00 0.00 H new ATOM 768 N GLN A 52 -0.884 17.226 -18.412 1.00 0.00 N ATOM 769 CA GLN A 52 -2.211 17.286 -18.999 1.00 0.00 C ATOM 770 C GLN A 52 -2.819 18.661 -18.759 1.00 0.00 C ATOM 771 O GLN A 52 -3.251 18.974 -17.648 1.00 0.00 O ATOM 772 CB GLN A 52 -3.111 16.189 -18.421 1.00 0.00 C ATOM 773 CG GLN A 52 -4.461 16.080 -19.115 1.00 0.00 C ATOM 774 CD GLN A 52 -5.270 14.889 -18.640 1.00 0.00 C ATOM 775 OE1 GLN A 52 -5.157 13.794 -19.187 1.00 0.00 O ATOM 776 NE2 GLN A 52 -6.098 15.095 -17.627 1.00 0.00 N ATOM 0 H GLN A 52 -0.750 17.847 -17.614 1.00 0.00 H new ATOM 0 HA GLN A 52 -2.127 17.119 -20.073 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.596 15.231 -18.495 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.272 16.384 -17.361 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.030 16.993 -18.940 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.306 16.003 -20.191 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -6.162 16.019 -17.201 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.672 14.329 -17.273 1.00 0.00 H new ATOM 785 N ARG A 53 -2.816 19.480 -19.801 1.00 0.00 N ATOM 786 CA ARG A 53 -3.328 20.843 -19.734 1.00 0.00 C ATOM 787 C ARG A 53 -4.791 20.854 -19.294 1.00 0.00 C ATOM 788 O ARG A 53 -5.690 20.591 -20.089 1.00 0.00 O ATOM 789 CB ARG A 53 -3.184 21.497 -21.105 1.00 0.00 C ATOM 790 CG ARG A 53 -3.146 23.015 -21.078 1.00 0.00 C ATOM 791 CD ARG A 53 -2.878 23.570 -22.466 1.00 0.00 C ATOM 792 NE ARG A 53 -1.738 22.908 -23.104 1.00 0.00 N ATOM 793 CZ ARG A 53 -1.471 22.974 -24.410 1.00 0.00 C ATOM 794 NH1 ARG A 53 -2.226 23.717 -25.209 1.00 0.00 N ATOM 795 NH2 ARG A 53 -0.448 22.297 -24.920 1.00 0.00 N ATOM 0 H ARG A 53 -2.458 19.218 -20.719 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.753 21.404 -18.997 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -2.270 21.132 -21.574 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -4.015 21.178 -21.735 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -4.094 23.401 -20.703 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -2.371 23.352 -20.390 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -3.766 23.444 -23.086 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -2.686 24.641 -22.399 1.00 0.00 H new ATOM 0 HE ARG A 53 -1.109 22.363 -22.514 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -3.013 24.240 -24.826 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -2.019 23.765 -26.207 1.00 0.00 H new ATOM 0 HH21 ARG A 53 0.137 21.723 -24.313 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -0.248 22.351 -25.919 1.00 0.00 H new ATOM 809 N THR A 54 -5.014 21.135 -18.018 1.00 0.00 N ATOM 810 CA THR A 54 -6.355 21.134 -17.450 1.00 0.00 C ATOM 811 C THR A 54 -6.528 22.349 -16.526 1.00 0.00 C ATOM 812 O THR A 54 -5.699 23.261 -16.545 1.00 0.00 O ATOM 813 CB THR A 54 -6.609 19.819 -16.668 1.00 0.00 C ATOM 814 OG1 THR A 54 -5.973 18.722 -17.342 1.00 0.00 O ATOM 815 CG2 THR A 54 -8.097 19.515 -16.548 1.00 0.00 C ATOM 0 H THR A 54 -4.278 21.368 -17.352 1.00 0.00 H new ATOM 0 HA THR A 54 -7.083 21.198 -18.259 1.00 0.00 H new ATOM 0 HB THR A 54 -6.195 19.948 -15.668 1.00 0.00 H new ATOM 0 HG1 THR A 54 -5.000 18.813 -17.270 1.00 0.00 H new ATOM 0 HG21 THR A 54 -8.235 18.586 -15.994 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.593 20.330 -16.020 1.00 0.00 H new ATOM 0 HG23 THR A 54 -8.529 19.411 -17.544 1.00 0.00 H new ATOM 823 N ARG A 55 -7.606 22.367 -15.744 1.00 0.00 N ATOM 824 CA ARG A 55 -7.871 23.443 -14.790 1.00 0.00 C ATOM 825 C ARG A 55 -6.723 23.602 -13.787 1.00 0.00 C ATOM 826 O ARG A 55 -6.590 22.810 -12.855 1.00 0.00 O ATOM 827 CB ARG A 55 -9.193 23.164 -14.063 1.00 0.00 C ATOM 828 CG ARG A 55 -9.465 24.067 -12.867 1.00 0.00 C ATOM 829 CD ARG A 55 -9.535 25.535 -13.251 1.00 0.00 C ATOM 830 NE ARG A 55 -9.862 26.368 -12.095 1.00 0.00 N ATOM 831 CZ ARG A 55 -9.364 27.583 -11.875 1.00 0.00 C ATOM 832 NH1 ARG A 55 -8.491 28.116 -12.719 1.00 0.00 N ATOM 833 NH2 ARG A 55 -9.742 28.267 -10.803 1.00 0.00 N ATOM 0 H ARG A 55 -8.319 21.638 -15.754 1.00 0.00 H new ATOM 0 HA ARG A 55 -7.950 24.382 -15.339 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -10.012 23.269 -14.774 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -9.195 22.127 -13.726 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -10.404 23.772 -12.399 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -8.680 23.926 -12.124 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -8.580 25.850 -13.671 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -10.287 25.675 -14.028 1.00 0.00 H new ATOM 0 HE ARG A 55 -10.517 25.992 -11.409 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -8.196 27.595 -13.544 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -8.115 29.047 -12.543 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.413 27.862 -10.150 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -9.362 29.198 -10.632 1.00 0.00 H new ATOM 847 N ARG A 56 -5.912 24.642 -14.011 1.00 0.00 N ATOM 848 CA ARG A 56 -4.723 24.954 -13.207 1.00 0.00 C ATOM 849 C ARG A 56 -3.667 23.851 -13.312 1.00 0.00 C ATOM 850 O ARG A 56 -3.976 22.676 -13.526 1.00 0.00 O ATOM 851 CB ARG A 56 -5.077 25.246 -11.732 1.00 0.00 C ATOM 852 CG ARG A 56 -4.803 24.100 -10.763 1.00 0.00 C ATOM 853 CD ARG A 56 -4.949 24.548 -9.313 1.00 0.00 C ATOM 854 NE ARG A 56 -4.687 23.461 -8.369 1.00 0.00 N ATOM 855 CZ ARG A 56 -4.101 23.621 -7.179 1.00 0.00 C ATOM 856 NH1 ARG A 56 -3.666 24.815 -6.794 1.00 0.00 N ATOM 857 NH2 ARG A 56 -3.940 22.577 -6.373 1.00 0.00 N ATOM 0 H ARG A 56 -6.066 25.304 -14.771 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.295 25.866 -13.623 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -4.514 26.120 -11.405 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.134 25.507 -11.673 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.493 23.280 -10.963 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.796 23.716 -10.927 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -4.261 25.370 -9.118 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -5.957 24.931 -9.153 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.971 22.519 -8.637 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.778 25.621 -7.409 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -3.220 24.926 -5.883 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -4.264 21.654 -6.663 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -3.493 22.698 -5.464 1.00 0.00 H new ATOM 871 N TYR A 57 -2.410 24.239 -13.194 1.00 0.00 N ATOM 872 CA TYR A 57 -1.325 23.275 -13.221 1.00 0.00 C ATOM 873 C TYR A 57 -0.972 22.821 -11.806 1.00 0.00 C ATOM 874 O TYR A 57 -0.547 23.616 -10.966 1.00 0.00 O ATOM 875 CB TYR A 57 -0.092 23.849 -13.945 1.00 0.00 C ATOM 876 CG TYR A 57 0.415 25.172 -13.403 1.00 0.00 C ATOM 877 CD1 TYR A 57 -0.101 26.380 -13.861 1.00 0.00 C ATOM 878 CD2 TYR A 57 1.416 25.212 -12.439 1.00 0.00 C ATOM 879 CE1 TYR A 57 0.363 27.586 -13.372 1.00 0.00 C ATOM 880 CE2 TYR A 57 1.883 26.412 -11.945 1.00 0.00 C ATOM 881 CZ TYR A 57 1.354 27.596 -12.415 1.00 0.00 C ATOM 882 OH TYR A 57 1.819 28.795 -11.921 1.00 0.00 O ATOM 0 H TYR A 57 -2.116 25.209 -13.079 1.00 0.00 H new ATOM 0 HA TYR A 57 -1.660 22.402 -13.782 1.00 0.00 H new ATOM 0 HB2 TYR A 57 0.715 23.118 -13.890 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.336 23.976 -15.000 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -0.878 26.375 -14.612 1.00 0.00 H new ATOM 0 HD2 TYR A 57 1.835 24.287 -12.071 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -0.049 28.515 -13.738 1.00 0.00 H new ATOM 0 HE2 TYR A 57 2.659 26.425 -11.194 1.00 0.00 H new ATOM 0 HH TYR A 57 2.516 28.625 -11.253 1.00 0.00 H new ATOM 892 N GLU A 58 -1.200 21.545 -11.538 1.00 0.00 N ATOM 893 CA GLU A 58 -0.806 20.939 -10.275 1.00 0.00 C ATOM 894 C GLU A 58 -0.100 19.612 -10.541 1.00 0.00 C ATOM 895 O GLU A 58 -0.715 18.549 -10.580 1.00 0.00 O ATOM 896 CB GLU A 58 -2.015 20.767 -9.339 1.00 0.00 C ATOM 897 CG GLU A 58 -3.230 20.117 -9.989 1.00 0.00 C ATOM 898 CD GLU A 58 -4.417 20.042 -9.048 1.00 0.00 C ATOM 899 OE1 GLU A 58 -4.516 19.067 -8.279 1.00 0.00 O ATOM 900 OE2 GLU A 58 -5.250 20.972 -9.063 1.00 0.00 O ATOM 0 H GLU A 58 -1.660 20.904 -12.184 1.00 0.00 H new ATOM 0 HA GLU A 58 -0.108 21.603 -9.765 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.712 20.166 -8.482 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.304 21.746 -8.956 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.509 20.683 -10.878 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.968 19.112 -10.320 1.00 0.00 H new ATOM 907 N LEU A 59 1.206 19.693 -10.757 1.00 0.00 N ATOM 908 CA LEU A 59 1.991 18.540 -11.180 1.00 0.00 C ATOM 909 C LEU A 59 3.037 18.175 -10.133 1.00 0.00 C ATOM 910 O LEU A 59 3.934 17.365 -10.389 1.00 0.00 O ATOM 911 CB LEU A 59 2.674 18.817 -12.531 1.00 0.00 C ATOM 912 CG LEU A 59 3.707 19.957 -12.546 1.00 0.00 C ATOM 913 CD1 LEU A 59 4.554 19.879 -13.803 1.00 0.00 C ATOM 914 CD2 LEU A 59 3.031 21.322 -12.469 1.00 0.00 C ATOM 0 H LEU A 59 1.747 20.550 -10.646 1.00 0.00 H new ATOM 0 HA LEU A 59 1.309 17.697 -11.294 1.00 0.00 H new ATOM 0 HB2 LEU A 59 3.168 17.902 -12.860 1.00 0.00 H new ATOM 0 HB3 LEU A 59 1.902 19.044 -13.266 1.00 0.00 H new ATOM 0 HG LEU A 59 4.343 19.840 -11.669 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.281 20.691 -13.803 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.077 18.923 -13.831 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.913 19.967 -14.680 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.789 22.105 -12.482 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.366 21.447 -13.323 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.454 21.391 -11.547 1.00 0.00 H new ATOM 926 N THR A 60 2.910 18.766 -8.957 1.00 0.00 N ATOM 927 CA THR A 60 3.848 18.524 -7.874 1.00 0.00 C ATOM 928 C THR A 60 3.621 17.141 -7.261 1.00 0.00 C ATOM 929 O THR A 60 2.699 16.940 -6.469 1.00 0.00 O ATOM 930 CB THR A 60 3.712 19.606 -6.787 1.00 0.00 C ATOM 931 OG1 THR A 60 3.714 20.900 -7.401 1.00 0.00 O ATOM 932 CG2 THR A 60 4.850 19.518 -5.780 1.00 0.00 C ATOM 0 H THR A 60 2.162 19.420 -8.727 1.00 0.00 H new ATOM 0 HA THR A 60 4.856 18.564 -8.287 1.00 0.00 H new ATOM 0 HB THR A 60 2.773 19.446 -6.257 1.00 0.00 H new ATOM 0 HG1 THR A 60 3.626 21.590 -6.711 1.00 0.00 H new ATOM 0 HG21 THR A 60 4.728 20.294 -5.024 1.00 0.00 H new ATOM 0 HG22 THR A 60 4.837 18.539 -5.301 1.00 0.00 H new ATOM 0 HG23 THR A 60 5.801 19.658 -6.293 1.00 0.00 H new ATOM 940 N ALA A 61 4.454 16.185 -7.654 1.00 0.00 N ATOM 941 CA ALA A 61 4.344 14.824 -7.150 1.00 0.00 C ATOM 942 C ALA A 61 4.968 14.707 -5.765 1.00 0.00 C ATOM 943 O ALA A 61 6.157 14.426 -5.627 1.00 0.00 O ATOM 944 CB ALA A 61 4.987 13.841 -8.118 1.00 0.00 C ATOM 0 H ALA A 61 5.213 16.328 -8.320 1.00 0.00 H new ATOM 0 HA ALA A 61 3.286 14.576 -7.065 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.895 12.829 -7.724 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.486 13.901 -9.084 1.00 0.00 H new ATOM 0 HB3 ALA A 61 6.042 14.088 -8.240 1.00 0.00 H new ATOM 950 N ASP A 62 4.165 14.960 -4.744 1.00 0.00 N ATOM 951 CA ASP A 62 4.634 14.890 -3.366 1.00 0.00 C ATOM 952 C ASP A 62 3.950 13.753 -2.613 1.00 0.00 C ATOM 953 O ASP A 62 2.836 13.920 -2.120 1.00 0.00 O ATOM 954 CB ASP A 62 4.387 16.226 -2.653 1.00 0.00 C ATOM 955 CG ASP A 62 4.716 16.175 -1.173 1.00 0.00 C ATOM 956 OD1 ASP A 62 5.889 15.942 -0.825 1.00 0.00 O ATOM 957 OD2 ASP A 62 3.796 16.375 -0.349 1.00 0.00 O ATOM 0 H ASP A 62 3.183 15.216 -4.842 1.00 0.00 H new ATOM 0 HA ASP A 62 5.705 14.690 -3.381 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.988 17.002 -3.127 1.00 0.00 H new ATOM 0 HB3 ASP A 62 3.342 16.511 -2.778 1.00 0.00 H new ATOM 962 N ASP A 63 4.616 12.590 -2.596 1.00 0.00 N ATOM 963 CA ASP A 63 4.187 11.393 -1.843 1.00 0.00 C ATOM 964 C ASP A 63 2.694 11.085 -1.983 1.00 0.00 C ATOM 965 O ASP A 63 2.280 10.326 -2.864 1.00 0.00 O ATOM 966 CB ASP A 63 4.541 11.536 -0.356 1.00 0.00 C ATOM 967 CG ASP A 63 6.011 11.297 -0.061 1.00 0.00 C ATOM 968 OD1 ASP A 63 6.870 11.997 -0.643 1.00 0.00 O ATOM 969 OD2 ASP A 63 6.317 10.421 0.775 1.00 0.00 O ATOM 0 H ASP A 63 5.484 12.448 -3.113 1.00 0.00 H new ATOM 0 HA ASP A 63 4.729 10.555 -2.282 1.00 0.00 H new ATOM 0 HB2 ASP A 63 4.268 12.536 -0.020 1.00 0.00 H new ATOM 0 HB3 ASP A 63 3.943 10.831 0.222 1.00 0.00 H new ATOM 974 N TYR A 64 1.897 11.699 -1.115 1.00 0.00 N ATOM 975 CA TYR A 64 0.459 11.486 -1.082 1.00 0.00 C ATOM 976 C TYR A 64 -0.168 11.935 -2.396 1.00 0.00 C ATOM 977 O TYR A 64 -1.006 11.240 -2.962 1.00 0.00 O ATOM 978 CB TYR A 64 -0.145 12.259 0.093 1.00 0.00 C ATOM 979 CG TYR A 64 -1.596 11.938 0.390 1.00 0.00 C ATOM 980 CD1 TYR A 64 -1.944 10.779 1.073 1.00 0.00 C ATOM 981 CD2 TYR A 64 -2.613 12.805 0.009 1.00 0.00 C ATOM 982 CE1 TYR A 64 -3.263 10.491 1.363 1.00 0.00 C ATOM 983 CE2 TYR A 64 -3.936 12.527 0.302 1.00 0.00 C ATOM 984 CZ TYR A 64 -4.254 11.369 0.977 1.00 0.00 C ATOM 985 OH TYR A 64 -5.569 11.092 1.282 1.00 0.00 O ATOM 0 H TYR A 64 2.233 12.359 -0.414 1.00 0.00 H new ATOM 0 HA TYR A 64 0.254 10.424 -0.950 1.00 0.00 H new ATOM 0 HB2 TYR A 64 0.447 12.056 0.985 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.059 13.326 -0.110 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -1.170 10.092 1.382 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -2.366 13.711 -0.525 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -3.517 9.583 1.889 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -4.715 13.213 0.004 1.00 0.00 H new ATOM 0 HH TYR A 64 -6.142 11.810 0.941 1.00 0.00 H new ATOM 995 N ARG A 65 0.273 13.092 -2.884 1.00 0.00 N ATOM 996 CA ARG A 65 -0.218 13.645 -4.138 1.00 0.00 C ATOM 997 C ARG A 65 0.176 12.772 -5.324 1.00 0.00 C ATOM 998 O ARG A 65 -0.578 12.634 -6.280 1.00 0.00 O ATOM 999 CB ARG A 65 0.294 15.066 -4.325 1.00 0.00 C ATOM 1000 CG ARG A 65 -0.500 16.081 -3.525 1.00 0.00 C ATOM 1001 CD ARG A 65 -1.339 16.979 -4.425 1.00 0.00 C ATOM 1002 NE ARG A 65 -2.337 16.229 -5.198 1.00 0.00 N ATOM 1003 CZ ARG A 65 -3.099 16.774 -6.150 1.00 0.00 C ATOM 1004 NH1 ARG A 65 -2.980 18.062 -6.439 1.00 0.00 N ATOM 1005 NH2 ARG A 65 -3.990 16.039 -6.806 1.00 0.00 N ATOM 0 H ARG A 65 0.977 13.668 -2.422 1.00 0.00 H new ATOM 0 HA ARG A 65 -1.307 13.667 -4.092 1.00 0.00 H new ATOM 0 HB2 ARG A 65 1.342 15.113 -4.027 1.00 0.00 H new ATOM 0 HB3 ARG A 65 0.251 15.328 -5.382 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -1.151 15.561 -2.822 1.00 0.00 H new ATOM 0 HG3 ARG A 65 0.182 16.693 -2.935 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -1.845 17.728 -3.815 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -0.683 17.516 -5.110 1.00 0.00 H new ATOM 0 HE ARG A 65 -2.455 15.236 -4.997 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -2.306 18.638 -5.934 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -3.562 18.477 -7.166 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -4.097 15.049 -6.584 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -4.567 16.464 -7.531 1.00 0.00 H new ATOM 1019 N ALA A 66 1.363 12.185 -5.258 1.00 0.00 N ATOM 1020 CA ALA A 66 1.835 11.307 -6.320 1.00 0.00 C ATOM 1021 C ALA A 66 1.010 10.028 -6.370 1.00 0.00 C ATOM 1022 O ALA A 66 0.741 9.490 -7.445 1.00 0.00 O ATOM 1023 CB ALA A 66 3.311 10.989 -6.135 1.00 0.00 C ATOM 0 H ALA A 66 2.015 12.300 -4.482 1.00 0.00 H new ATOM 0 HA ALA A 66 1.714 11.826 -7.271 1.00 0.00 H new ATOM 0 HB1 ALA A 66 3.645 10.332 -6.938 1.00 0.00 H new ATOM 0 HB2 ALA A 66 3.888 11.913 -6.159 1.00 0.00 H new ATOM 0 HB3 ALA A 66 3.459 10.493 -5.176 1.00 0.00 H new ATOM 1029 N ALA A 67 0.621 9.538 -5.201 1.00 0.00 N ATOM 1030 CA ALA A 67 -0.287 8.406 -5.120 1.00 0.00 C ATOM 1031 C ALA A 67 -1.667 8.827 -5.595 1.00 0.00 C ATOM 1032 O ALA A 67 -2.331 8.099 -6.326 1.00 0.00 O ATOM 1033 CB ALA A 67 -0.350 7.867 -3.699 1.00 0.00 C ATOM 0 H ALA A 67 0.920 9.907 -4.298 1.00 0.00 H new ATOM 0 HA ALA A 67 0.083 7.608 -5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -1.035 7.020 -3.661 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.643 7.544 -3.388 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.703 8.650 -3.028 1.00 0.00 H new ATOM 1039 N ASP A 68 -2.063 10.025 -5.182 1.00 0.00 N ATOM 1040 CA ASP A 68 -3.345 10.621 -5.553 1.00 0.00 C ATOM 1041 C ASP A 68 -3.513 10.687 -7.068 1.00 0.00 C ATOM 1042 O ASP A 68 -4.548 10.284 -7.607 1.00 0.00 O ATOM 1043 CB ASP A 68 -3.431 12.029 -4.954 1.00 0.00 C ATOM 1044 CG ASP A 68 -4.666 12.797 -5.382 1.00 0.00 C ATOM 1045 OD1 ASP A 68 -4.611 13.486 -6.421 1.00 0.00 O ATOM 1046 OD2 ASP A 68 -5.681 12.746 -4.665 1.00 0.00 O ATOM 0 H ASP A 68 -1.499 10.618 -4.574 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.147 9.996 -5.160 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.419 11.953 -3.867 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.544 12.593 -5.244 1.00 0.00 H new ATOM 1051 N ALA A 69 -2.491 11.196 -7.748 1.00 0.00 N ATOM 1052 CA ALA A 69 -2.520 11.316 -9.201 1.00 0.00 C ATOM 1053 C ALA A 69 -2.698 9.954 -9.859 1.00 0.00 C ATOM 1054 O ALA A 69 -3.620 9.753 -10.649 1.00 0.00 O ATOM 1055 CB ALA A 69 -1.250 11.986 -9.702 1.00 0.00 C ATOM 0 H ALA A 69 -1.631 11.533 -7.315 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.374 11.936 -9.473 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.286 12.068 -10.788 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.167 12.981 -9.265 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.385 11.389 -9.412 1.00 0.00 H new ATOM 1061 N ALA A 70 -1.836 9.010 -9.507 1.00 0.00 N ATOM 1062 CA ALA A 70 -1.900 7.670 -10.078 1.00 0.00 C ATOM 1063 C ALA A 70 -3.206 6.974 -9.707 1.00 0.00 C ATOM 1064 O ALA A 70 -3.735 6.172 -10.478 1.00 0.00 O ATOM 1065 CB ALA A 70 -0.713 6.845 -9.614 1.00 0.00 C ATOM 0 H ALA A 70 -1.085 9.146 -8.830 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.865 7.763 -11.163 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.772 5.847 -10.047 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.211 7.325 -9.935 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.725 6.770 -8.527 1.00 0.00 H new ATOM 1071 N ALA A 71 -3.718 7.277 -8.524 1.00 0.00 N ATOM 1072 CA ALA A 71 -4.972 6.702 -8.068 1.00 0.00 C ATOM 1073 C ALA A 71 -6.128 7.172 -8.933 1.00 0.00 C ATOM 1074 O ALA A 71 -6.890 6.355 -9.442 1.00 0.00 O ATOM 1075 CB ALA A 71 -5.228 7.056 -6.613 1.00 0.00 C ATOM 0 H ALA A 71 -3.283 7.919 -7.862 1.00 0.00 H new ATOM 0 HA ALA A 71 -4.895 5.618 -8.154 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -6.172 6.615 -6.292 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -4.418 6.667 -5.996 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.278 8.140 -6.506 1.00 0.00 H new ATOM 1081 N GLN A 72 -6.244 8.485 -9.120 1.00 0.00 N ATOM 1082 CA GLN A 72 -7.335 9.047 -9.917 1.00 0.00 C ATOM 1083 C GLN A 72 -7.211 8.627 -11.384 1.00 0.00 C ATOM 1084 O GLN A 72 -8.219 8.479 -12.077 1.00 0.00 O ATOM 1085 CB GLN A 72 -7.395 10.575 -9.788 1.00 0.00 C ATOM 1086 CG GLN A 72 -6.165 11.301 -10.301 1.00 0.00 C ATOM 1087 CD GLN A 72 -6.270 12.802 -10.134 1.00 0.00 C ATOM 1088 OE1 GLN A 72 -6.776 13.500 -11.012 1.00 0.00 O ATOM 1089 NE2 GLN A 72 -5.798 13.313 -9.008 1.00 0.00 N ATOM 0 H GLN A 72 -5.601 9.177 -8.734 1.00 0.00 H new ATOM 0 HA GLN A 72 -8.270 8.646 -9.526 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -8.268 10.938 -10.330 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -7.542 10.832 -8.739 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -5.285 10.940 -9.769 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -6.020 11.065 -11.355 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -5.386 12.701 -8.304 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -5.847 14.319 -8.845 1.00 0.00 H new ATOM 1098 N GLU A 73 -5.974 8.448 -11.850 1.00 0.00 N ATOM 1099 CA GLU A 73 -5.715 7.901 -13.175 1.00 0.00 C ATOM 1100 C GLU A 73 -6.350 6.524 -13.333 1.00 0.00 C ATOM 1101 O GLU A 73 -6.969 6.223 -14.354 1.00 0.00 O ATOM 1102 CB GLU A 73 -4.208 7.788 -13.405 1.00 0.00 C ATOM 1103 CG GLU A 73 -3.522 9.114 -13.666 1.00 0.00 C ATOM 1104 CD GLU A 73 -2.071 8.940 -14.063 1.00 0.00 C ATOM 1105 OE1 GLU A 73 -1.809 8.415 -15.169 1.00 0.00 O ATOM 1106 OE2 GLU A 73 -1.181 9.305 -13.267 1.00 0.00 O ATOM 0 H GLU A 73 -5.132 8.677 -11.322 1.00 0.00 H new ATOM 0 HA GLU A 73 -6.154 8.576 -13.910 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -3.752 7.320 -12.532 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -4.029 7.125 -14.252 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.052 9.646 -14.456 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.580 9.733 -12.771 1.00 0.00 H new ATOM 1113 N GLN A 74 -6.201 5.707 -12.308 1.00 0.00 N ATOM 1114 CA GLN A 74 -6.692 4.339 -12.327 1.00 0.00 C ATOM 1115 C GLN A 74 -8.143 4.250 -11.851 1.00 0.00 C ATOM 1116 O GLN A 74 -8.783 3.201 -11.970 1.00 0.00 O ATOM 1117 CB GLN A 74 -5.792 3.478 -11.445 1.00 0.00 C ATOM 1118 CG GLN A 74 -4.413 3.232 -12.043 1.00 0.00 C ATOM 1119 CD GLN A 74 -3.440 2.611 -11.056 1.00 0.00 C ATOM 1120 OE1 GLN A 74 -3.548 2.992 -9.793 1.00 0.00 O flip ATOM 1121 NE2 GLN A 74 -2.577 1.820 -11.433 1.00 0.00 N flip ATOM 0 H GLN A 74 -5.737 5.971 -11.439 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.668 3.976 -13.354 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -5.678 3.961 -10.475 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.279 2.519 -11.268 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -4.510 2.578 -12.909 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -4.005 4.177 -12.401 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -2.526 1.551 -12.415 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -1.912 1.433 -10.763 1.00 0.00 H new ATOM 1130 N GLY A 75 -8.658 5.352 -11.322 1.00 0.00 N ATOM 1131 CA GLY A 75 -10.010 5.364 -10.798 1.00 0.00 C ATOM 1132 C GLY A 75 -10.082 4.751 -9.414 1.00 0.00 C ATOM 1133 O GLY A 75 -11.112 4.199 -9.016 1.00 0.00 O ATOM 0 H GLY A 75 -8.162 6.240 -11.246 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.376 6.390 -10.761 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -10.667 4.815 -11.473 1.00 0.00 H new ATOM 1137 N LEU A 76 -8.980 4.844 -8.687 1.00 0.00 N ATOM 1138 CA LEU A 76 -8.867 4.262 -7.363 1.00 0.00 C ATOM 1139 C LEU A 76 -8.553 5.348 -6.342 1.00 0.00 C ATOM 1140 O LEU A 76 -8.427 6.519 -6.697 1.00 0.00 O ATOM 1141 CB LEU A 76 -7.750 3.215 -7.357 1.00 0.00 C ATOM 1142 CG LEU A 76 -7.878 2.108 -8.407 1.00 0.00 C ATOM 1143 CD1 LEU A 76 -6.653 1.210 -8.379 1.00 0.00 C ATOM 1144 CD2 LEU A 76 -9.143 1.296 -8.176 1.00 0.00 C ATOM 0 H LEU A 76 -8.138 5.327 -9.001 1.00 0.00 H new ATOM 0 HA LEU A 76 -9.813 3.788 -7.100 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.798 3.724 -7.506 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.714 2.753 -6.370 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.945 2.570 -9.392 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.758 0.428 -9.131 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -5.763 1.802 -8.593 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.558 0.755 -7.393 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -9.217 0.514 -8.932 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -9.108 0.841 -7.186 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -10.013 1.950 -8.244 1.00 0.00 H new ATOM 1156 N ASP A 77 -8.436 4.963 -5.081 1.00 0.00 N ATOM 1157 CA ASP A 77 -8.000 5.884 -4.045 1.00 0.00 C ATOM 1158 C ASP A 77 -7.084 5.172 -3.062 1.00 0.00 C ATOM 1159 O ASP A 77 -6.795 3.982 -3.216 1.00 0.00 O ATOM 1160 CB ASP A 77 -9.192 6.509 -3.310 1.00 0.00 C ATOM 1161 CG ASP A 77 -10.051 5.502 -2.566 1.00 0.00 C ATOM 1162 OD1 ASP A 77 -9.775 5.231 -1.382 1.00 0.00 O ATOM 1163 OD2 ASP A 77 -11.040 5.015 -3.152 1.00 0.00 O ATOM 0 H ASP A 77 -8.637 4.019 -4.751 1.00 0.00 H new ATOM 0 HA ASP A 77 -7.448 6.692 -4.525 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.822 7.250 -2.602 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -9.813 7.040 -4.031 1.00 0.00 H new ATOM 1168 N VAL A 78 -6.620 5.907 -2.065 1.00 0.00 N ATOM 1169 CA VAL A 78 -5.707 5.362 -1.076 1.00 0.00 C ATOM 1170 C VAL A 78 -6.480 4.593 -0.010 1.00 0.00 C ATOM 1171 O VAL A 78 -7.159 5.188 0.827 1.00 0.00 O ATOM 1172 CB VAL A 78 -4.868 6.475 -0.404 1.00 0.00 C ATOM 1173 CG1 VAL A 78 -3.845 5.879 0.555 1.00 0.00 C ATOM 1174 CG2 VAL A 78 -4.183 7.341 -1.459 1.00 0.00 C ATOM 0 H VAL A 78 -6.862 6.887 -1.920 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.027 4.686 -1.594 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.541 7.108 0.174 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.267 6.681 1.015 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -4.360 5.312 1.330 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.174 5.217 0.007 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -3.598 8.118 -0.968 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.525 6.721 -2.067 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -4.937 7.803 -2.096 1.00 0.00 H new ATOM 1184 N VAL A 79 -6.383 3.272 -0.055 1.00 0.00 N ATOM 1185 CA VAL A 79 -7.087 2.421 0.897 1.00 0.00 C ATOM 1186 C VAL A 79 -6.201 2.083 2.092 1.00 0.00 C ATOM 1187 O VAL A 79 -6.692 1.775 3.181 1.00 0.00 O ATOM 1188 CB VAL A 79 -7.589 1.118 0.236 1.00 0.00 C ATOM 1189 CG1 VAL A 79 -8.651 1.429 -0.806 1.00 0.00 C ATOM 1190 CG2 VAL A 79 -6.440 0.341 -0.390 1.00 0.00 C ATOM 0 H VAL A 79 -5.824 2.765 -0.741 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.952 2.985 1.245 1.00 0.00 H new ATOM 0 HB VAL A 79 -8.032 0.494 1.013 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.995 0.501 -1.263 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.492 1.932 -0.329 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.228 2.077 -1.574 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.824 -0.571 -0.847 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -5.959 0.954 -1.152 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.713 0.082 0.380 1.00 0.00 H new ATOM 1200 N GLY A 80 -4.894 2.164 1.891 1.00 0.00 N ATOM 1201 CA GLY A 80 -3.964 1.855 2.952 1.00 0.00 C ATOM 1202 C GLY A 80 -2.566 2.335 2.641 1.00 0.00 C ATOM 1203 O GLY A 80 -2.313 2.869 1.558 1.00 0.00 O ATOM 0 H GLY A 80 -4.462 2.439 1.009 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.307 2.315 3.879 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -3.948 0.778 3.117 1.00 0.00 H new ATOM 1207 N VAL A 81 -1.658 2.143 3.585 1.00 0.00 N ATOM 1208 CA VAL A 81 -0.267 2.558 3.424 1.00 0.00 C ATOM 1209 C VAL A 81 0.648 1.441 3.909 1.00 0.00 C ATOM 1210 O VAL A 81 0.238 0.606 4.719 1.00 0.00 O ATOM 1211 CB VAL A 81 0.055 3.847 4.224 1.00 0.00 C ATOM 1212 CG1 VAL A 81 1.371 4.461 3.776 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -1.070 4.864 4.110 1.00 0.00 C ATOM 0 H VAL A 81 -1.859 1.698 4.481 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.106 2.767 2.366 1.00 0.00 H new ATOM 0 HB VAL A 81 0.151 3.561 5.271 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.568 5.363 4.356 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.178 3.745 3.932 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.312 4.716 2.718 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.814 5.756 4.682 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.213 5.133 3.063 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.991 4.433 4.503 1.00 0.00 H new ATOM 1223 N TYR A 82 1.878 1.419 3.425 1.00 0.00 N ATOM 1224 CA TYR A 82 2.827 0.401 3.842 1.00 0.00 C ATOM 1225 C TYR A 82 4.222 0.989 4.030 1.00 0.00 C ATOM 1226 O TYR A 82 4.667 1.839 3.257 1.00 0.00 O ATOM 1227 CB TYR A 82 2.854 -0.784 2.859 1.00 0.00 C ATOM 1228 CG TYR A 82 3.259 -0.447 1.437 1.00 0.00 C ATOM 1229 CD1 TYR A 82 4.592 -0.481 1.045 1.00 0.00 C ATOM 1230 CD2 TYR A 82 2.306 -0.119 0.480 1.00 0.00 C ATOM 1231 CE1 TYR A 82 4.962 -0.193 -0.256 1.00 0.00 C ATOM 1232 CE2 TYR A 82 2.670 0.171 -0.823 1.00 0.00 C ATOM 1233 CZ TYR A 82 4.000 0.131 -1.185 1.00 0.00 C ATOM 1234 OH TYR A 82 4.368 0.419 -2.481 1.00 0.00 O ATOM 0 H TYR A 82 2.241 2.089 2.748 1.00 0.00 H new ATOM 0 HA TYR A 82 2.492 0.020 4.807 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.541 -1.537 3.245 1.00 0.00 H new ATOM 0 HB3 TYR A 82 1.863 -1.238 2.838 1.00 0.00 H new ATOM 0 HD1 TYR A 82 5.352 -0.737 1.769 1.00 0.00 H new ATOM 0 HD2 TYR A 82 1.263 -0.090 0.758 1.00 0.00 H new ATOM 0 HE1 TYR A 82 6.003 -0.222 -0.542 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.916 0.427 -1.553 1.00 0.00 H new ATOM 0 HH TYR A 82 3.984 1.281 -2.746 1.00 0.00 H new ATOM 1244 N HIS A 83 4.889 0.544 5.086 1.00 0.00 N ATOM 1245 CA HIS A 83 6.242 0.988 5.402 1.00 0.00 C ATOM 1246 C HIS A 83 7.023 -0.140 6.065 1.00 0.00 C ATOM 1247 O HIS A 83 6.534 -0.783 6.996 1.00 0.00 O ATOM 1248 CB HIS A 83 6.232 2.247 6.292 1.00 0.00 C ATOM 1249 CG HIS A 83 5.208 2.244 7.398 1.00 0.00 C ATOM 1250 ND1 HIS A 83 5.388 1.597 8.601 1.00 0.00 N ATOM 1251 CD2 HIS A 83 3.990 2.835 7.475 1.00 0.00 C ATOM 1252 CE1 HIS A 83 4.328 1.788 9.363 1.00 0.00 C ATOM 1253 NE2 HIS A 83 3.463 2.536 8.710 1.00 0.00 N ATOM 0 H HIS A 83 4.510 -0.134 5.747 1.00 0.00 H new ATOM 0 HA HIS A 83 6.737 1.256 4.468 1.00 0.00 H new ATOM 0 HB2 HIS A 83 7.221 2.367 6.735 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.058 3.118 5.660 1.00 0.00 H new ATOM 0 HD2 HIS A 83 3.520 3.431 6.707 1.00 0.00 H new ATOM 0 HE1 HIS A 83 4.192 1.395 10.360 1.00 0.00 H new ATOM 0 HE2 HIS A 83 2.555 2.842 9.061 1.00 0.00 H new ATOM 1262 N SER A 84 8.232 -0.383 5.581 1.00 0.00 N ATOM 1263 CA SER A 84 9.031 -1.510 6.033 1.00 0.00 C ATOM 1264 C SER A 84 10.179 -1.061 6.931 1.00 0.00 C ATOM 1265 O SER A 84 10.693 0.047 6.789 1.00 0.00 O ATOM 1266 CB SER A 84 9.580 -2.258 4.816 1.00 0.00 C ATOM 1267 OG SER A 84 10.222 -1.367 3.917 1.00 0.00 O ATOM 0 H SER A 84 8.683 0.191 4.869 1.00 0.00 H new ATOM 0 HA SER A 84 8.393 -2.170 6.621 1.00 0.00 H new ATOM 0 HB2 SER A 84 10.286 -3.022 5.142 1.00 0.00 H new ATOM 0 HB3 SER A 84 8.767 -2.773 4.304 1.00 0.00 H new ATOM 0 HG SER A 84 11.183 -1.347 4.107 1.00 0.00 H new ATOM 1273 N HIS A 85 10.565 -1.928 7.862 1.00 0.00 N ATOM 1274 CA HIS A 85 11.735 -1.691 8.704 1.00 0.00 C ATOM 1275 C HIS A 85 12.197 -2.996 9.348 1.00 0.00 C ATOM 1276 O HIS A 85 11.376 -3.844 9.696 1.00 0.00 O ATOM 1277 CB HIS A 85 11.472 -0.610 9.771 1.00 0.00 C ATOM 1278 CG HIS A 85 10.230 -0.798 10.593 1.00 0.00 C ATOM 1279 ND1 HIS A 85 10.238 -1.312 11.866 1.00 0.00 N ATOM 1280 CD2 HIS A 85 8.944 -0.476 10.331 1.00 0.00 C ATOM 1281 CE1 HIS A 85 9.012 -1.299 12.353 1.00 0.00 C ATOM 1282 NE2 HIS A 85 8.202 -0.790 11.442 1.00 0.00 N ATOM 0 H HIS A 85 10.082 -2.806 8.054 1.00 0.00 H new ATOM 0 HA HIS A 85 12.532 -1.315 8.063 1.00 0.00 H new ATOM 0 HB2 HIS A 85 12.329 -0.573 10.444 1.00 0.00 H new ATOM 0 HB3 HIS A 85 11.414 0.359 9.274 1.00 0.00 H new ATOM 0 HD1 HIS A 85 11.064 -1.651 12.359 1.00 0.00 H new ATOM 0 HD2 HIS A 85 8.568 -0.049 9.413 1.00 0.00 H new ATOM 0 HE1 HIS A 85 8.719 -1.646 13.333 1.00 0.00 H new ATOM 0 HE2 HIS A 85 7.197 -0.654 11.546 1.00 0.00 H new ATOM 1291 N PRO A 86 13.523 -3.173 9.498 1.00 0.00 N ATOM 1292 CA PRO A 86 14.119 -4.405 10.001 1.00 0.00 C ATOM 1293 C PRO A 86 14.333 -4.401 11.512 1.00 0.00 C ATOM 1294 O PRO A 86 15.471 -4.353 11.987 1.00 0.00 O ATOM 1295 CB PRO A 86 15.460 -4.435 9.272 1.00 0.00 C ATOM 1296 CG PRO A 86 15.828 -2.997 9.063 1.00 0.00 C ATOM 1297 CD PRO A 86 14.558 -2.182 9.169 1.00 0.00 C ATOM 0 HA PRO A 86 13.481 -5.271 9.826 1.00 0.00 H new ATOM 0 HB2 PRO A 86 16.217 -4.953 9.861 1.00 0.00 H new ATOM 0 HB3 PRO A 86 15.380 -4.963 8.322 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.554 -2.675 9.810 1.00 0.00 H new ATOM 0 HG3 PRO A 86 16.292 -2.858 8.087 1.00 0.00 H new ATOM 0 HD2 PRO A 86 14.638 -1.418 9.942 1.00 0.00 H new ATOM 0 HD3 PRO A 86 14.335 -1.668 8.234 1.00 0.00 H new ATOM 1305 N ASP A 87 13.245 -4.451 12.260 1.00 0.00 N ATOM 1306 CA ASP A 87 13.315 -4.515 13.713 1.00 0.00 C ATOM 1307 C ASP A 87 11.996 -5.030 14.261 1.00 0.00 C ATOM 1308 O ASP A 87 10.957 -4.881 13.613 1.00 0.00 O ATOM 1309 CB ASP A 87 13.647 -3.146 14.322 1.00 0.00 C ATOM 1310 CG ASP A 87 12.587 -2.100 14.045 1.00 0.00 C ATOM 1311 OD1 ASP A 87 12.592 -1.518 12.943 1.00 0.00 O ATOM 1312 OD2 ASP A 87 11.750 -1.843 14.933 1.00 0.00 O ATOM 0 H ASP A 87 12.297 -4.449 11.885 1.00 0.00 H new ATOM 0 HA ASP A 87 14.118 -5.199 13.988 1.00 0.00 H new ATOM 0 HB2 ASP A 87 13.769 -3.254 15.400 1.00 0.00 H new ATOM 0 HB3 ASP A 87 14.602 -2.801 13.926 1.00 0.00 H new ATOM 1317 N HIS A 88 12.051 -5.631 15.455 1.00 0.00 N ATOM 1318 CA HIS A 88 10.888 -6.280 16.073 1.00 0.00 C ATOM 1319 C HIS A 88 10.457 -7.510 15.270 1.00 0.00 C ATOM 1320 O HIS A 88 10.790 -7.641 14.094 1.00 0.00 O ATOM 1321 CB HIS A 88 9.713 -5.298 16.205 1.00 0.00 C ATOM 1322 CG HIS A 88 9.928 -4.221 17.223 1.00 0.00 C ATOM 1323 ND1 HIS A 88 10.446 -2.981 16.918 1.00 0.00 N ATOM 1324 CD2 HIS A 88 9.684 -4.205 18.553 1.00 0.00 C ATOM 1325 CE1 HIS A 88 10.511 -2.254 18.016 1.00 0.00 C ATOM 1326 NE2 HIS A 88 10.056 -2.972 19.024 1.00 0.00 N ATOM 0 H HIS A 88 12.900 -5.681 16.019 1.00 0.00 H new ATOM 0 HA HIS A 88 11.183 -6.602 17.072 1.00 0.00 H new ATOM 0 HB2 HIS A 88 9.530 -4.835 15.235 1.00 0.00 H new ATOM 0 HB3 HIS A 88 8.814 -5.856 16.467 1.00 0.00 H new ATOM 0 HD1 HIS A 88 10.734 -2.674 15.989 1.00 0.00 H new ATOM 0 HD2 HIS A 88 9.272 -5.015 19.137 1.00 0.00 H new ATOM 0 HE1 HIS A 88 10.876 -1.240 18.079 1.00 0.00 H new ATOM 1335 N PRO A 89 9.750 -8.459 15.902 1.00 0.00 N ATOM 1336 CA PRO A 89 9.228 -9.641 15.216 1.00 0.00 C ATOM 1337 C PRO A 89 8.040 -9.298 14.317 1.00 0.00 C ATOM 1338 O PRO A 89 6.890 -9.581 14.665 1.00 0.00 O ATOM 1339 CB PRO A 89 8.789 -10.574 16.357 1.00 0.00 C ATOM 1340 CG PRO A 89 9.312 -9.953 17.613 1.00 0.00 C ATOM 1341 CD PRO A 89 9.426 -8.484 17.333 1.00 0.00 C ATOM 0 HA PRO A 89 9.973 -10.090 14.559 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.704 -10.668 16.390 1.00 0.00 H new ATOM 0 HB3 PRO A 89 9.192 -11.577 16.219 1.00 0.00 H new ATOM 0 HG2 PRO A 89 8.639 -10.139 18.450 1.00 0.00 H new ATOM 0 HG3 PRO A 89 10.280 -10.375 17.883 1.00 0.00 H new ATOM 0 HD2 PRO A 89 8.497 -7.956 17.548 1.00 0.00 H new ATOM 0 HD3 PRO A 89 10.205 -8.015 17.934 1.00 0.00 H new ATOM 1349 N ALA A 90 8.344 -8.658 13.183 1.00 0.00 N ATOM 1350 CA ALA A 90 7.345 -8.236 12.198 1.00 0.00 C ATOM 1351 C ALA A 90 6.134 -7.580 12.860 1.00 0.00 C ATOM 1352 O ALA A 90 5.057 -8.172 12.946 1.00 0.00 O ATOM 1353 CB ALA A 90 6.920 -9.405 11.321 1.00 0.00 C ATOM 0 H ALA A 90 9.300 -8.417 12.921 1.00 0.00 H new ATOM 0 HA ALA A 90 7.813 -7.484 11.563 1.00 0.00 H new ATOM 0 HB1 ALA A 90 6.178 -9.066 10.598 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.789 -9.798 10.793 1.00 0.00 H new ATOM 0 HB3 ALA A 90 6.489 -10.189 11.944 1.00 0.00 H new ATOM 1359 N ARG A 91 6.332 -6.365 13.354 1.00 0.00 N ATOM 1360 CA ARG A 91 5.282 -5.636 14.040 1.00 0.00 C ATOM 1361 C ARG A 91 5.636 -4.154 14.120 1.00 0.00 C ATOM 1362 O ARG A 91 6.800 -3.786 13.946 1.00 0.00 O ATOM 1363 CB ARG A 91 5.075 -6.214 15.445 1.00 0.00 C ATOM 1364 CG ARG A 91 6.310 -6.146 16.325 1.00 0.00 C ATOM 1365 CD ARG A 91 6.072 -6.822 17.663 1.00 0.00 C ATOM 1366 NE ARG A 91 5.798 -8.250 17.512 1.00 0.00 N ATOM 1367 CZ ARG A 91 5.382 -9.035 18.504 1.00 0.00 C ATOM 1368 NH1 ARG A 91 5.187 -8.530 19.717 1.00 0.00 N ATOM 1369 NH2 ARG A 91 5.170 -10.327 18.282 1.00 0.00 N ATOM 0 H ARG A 91 7.218 -5.864 13.290 1.00 0.00 H new ATOM 0 HA ARG A 91 4.353 -5.740 13.479 1.00 0.00 H new ATOM 0 HB2 ARG A 91 4.263 -5.675 15.933 1.00 0.00 H new ATOM 0 HB3 ARG A 91 4.760 -7.254 15.357 1.00 0.00 H new ATOM 0 HG2 ARG A 91 7.148 -6.624 15.817 1.00 0.00 H new ATOM 0 HG3 ARG A 91 6.588 -5.104 16.486 1.00 0.00 H new ATOM 0 HD2 ARG A 91 6.947 -6.686 18.299 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.233 -6.343 18.168 1.00 0.00 H new ATOM 0 HE ARG A 91 5.933 -8.670 16.592 1.00 0.00 H new ATOM 0 HH11 ARG A 91 5.356 -7.539 19.890 1.00 0.00 H new ATOM 0 HH12 ARG A 91 4.868 -9.133 20.475 1.00 0.00 H new ATOM 0 HH21 ARG A 91 5.326 -10.717 17.352 1.00 0.00 H new ATOM 0 HH22 ARG A 91 4.851 -10.929 19.041 1.00 0.00 H new ATOM 1383 N PRO A 92 4.644 -3.283 14.375 1.00 0.00 N ATOM 1384 CA PRO A 92 4.869 -1.840 14.466 1.00 0.00 C ATOM 1385 C PRO A 92 5.674 -1.441 15.697 1.00 0.00 C ATOM 1386 O PRO A 92 5.572 -2.069 16.759 1.00 0.00 O ATOM 1387 CB PRO A 92 3.455 -1.259 14.554 1.00 0.00 C ATOM 1388 CG PRO A 92 2.622 -2.362 15.106 1.00 0.00 C ATOM 1389 CD PRO A 92 3.226 -3.634 14.586 1.00 0.00 C ATOM 0 HA PRO A 92 5.449 -1.476 13.618 1.00 0.00 H new ATOM 0 HB2 PRO A 92 3.428 -0.382 15.200 1.00 0.00 H new ATOM 0 HB3 PRO A 92 3.095 -0.944 13.574 1.00 0.00 H new ATOM 0 HG2 PRO A 92 2.625 -2.345 16.196 1.00 0.00 H new ATOM 0 HG3 PRO A 92 1.584 -2.264 14.788 1.00 0.00 H new ATOM 0 HD2 PRO A 92 3.117 -4.451 15.299 1.00 0.00 H new ATOM 0 HD3 PRO A 92 2.750 -3.955 13.659 1.00 0.00 H new ATOM 1397 N SER A 93 6.478 -0.404 15.539 1.00 0.00 N ATOM 1398 CA SER A 93 7.197 0.186 16.646 1.00 0.00 C ATOM 1399 C SER A 93 6.424 1.403 17.151 1.00 0.00 C ATOM 1400 O SER A 93 5.275 1.619 16.752 1.00 0.00 O ATOM 1401 CB SER A 93 8.602 0.579 16.190 1.00 0.00 C ATOM 1402 OG SER A 93 9.281 -0.540 15.640 1.00 0.00 O ATOM 0 H SER A 93 6.648 0.049 14.641 1.00 0.00 H new ATOM 0 HA SER A 93 7.290 -0.532 17.461 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.540 1.374 15.447 1.00 0.00 H new ATOM 0 HB3 SER A 93 9.167 0.975 17.034 1.00 0.00 H new ATOM 0 HG SER A 93 10.246 -0.371 15.644 1.00 0.00 H new ATOM 1408 N ALA A 94 7.044 2.198 18.010 1.00 0.00 N ATOM 1409 CA ALA A 94 6.380 3.372 18.555 1.00 0.00 C ATOM 1410 C ALA A 94 6.098 4.386 17.454 1.00 0.00 C ATOM 1411 O ALA A 94 4.981 4.875 17.326 1.00 0.00 O ATOM 1412 CB ALA A 94 7.215 3.997 19.660 1.00 0.00 C ATOM 0 H ALA A 94 7.997 2.054 18.342 1.00 0.00 H new ATOM 0 HA ALA A 94 5.428 3.059 18.984 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.700 4.873 20.054 1.00 0.00 H new ATOM 0 HB2 ALA A 94 7.361 3.272 20.460 1.00 0.00 H new ATOM 0 HB3 ALA A 94 8.184 4.295 19.260 1.00 0.00 H new ATOM 1418 N THR A 95 7.106 4.656 16.633 1.00 0.00 N ATOM 1419 CA THR A 95 6.984 5.634 15.558 1.00 0.00 C ATOM 1420 C THR A 95 5.894 5.235 14.560 1.00 0.00 C ATOM 1421 O THR A 95 5.146 6.088 14.081 1.00 0.00 O ATOM 1422 CB THR A 95 8.328 5.801 14.822 1.00 0.00 C ATOM 1423 OG1 THR A 95 9.373 6.042 15.777 1.00 0.00 O ATOM 1424 CG2 THR A 95 8.274 6.955 13.830 1.00 0.00 C ATOM 0 H THR A 95 8.021 4.209 16.692 1.00 0.00 H new ATOM 0 HA THR A 95 6.703 6.585 16.011 1.00 0.00 H new ATOM 0 HB THR A 95 8.530 4.883 14.270 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.227 6.146 15.308 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.236 7.048 13.327 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.495 6.764 13.092 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.052 7.881 14.361 1.00 0.00 H new ATOM 1432 N ASP A 96 5.794 3.938 14.266 1.00 0.00 N ATOM 1433 CA ASP A 96 4.754 3.433 13.367 1.00 0.00 C ATOM 1434 C ASP A 96 3.379 3.837 13.883 1.00 0.00 C ATOM 1435 O ASP A 96 2.519 4.289 13.126 1.00 0.00 O ATOM 1436 CB ASP A 96 4.808 1.903 13.253 1.00 0.00 C ATOM 1437 CG ASP A 96 6.108 1.375 12.679 1.00 0.00 C ATOM 1438 OD1 ASP A 96 7.105 1.313 13.422 1.00 0.00 O ATOM 1439 OD2 ASP A 96 6.129 0.975 11.494 1.00 0.00 O ATOM 0 H ASP A 96 6.417 3.220 14.635 1.00 0.00 H new ATOM 0 HA ASP A 96 4.930 3.866 12.382 1.00 0.00 H new ATOM 0 HB2 ASP A 96 4.656 1.469 14.241 1.00 0.00 H new ATOM 0 HB3 ASP A 96 3.982 1.566 12.627 1.00 0.00 H new ATOM 1444 N LEU A 97 3.191 3.656 15.182 1.00 0.00 N ATOM 1445 CA LEU A 97 1.942 3.994 15.848 1.00 0.00 C ATOM 1446 C LEU A 97 1.762 5.512 15.919 1.00 0.00 C ATOM 1447 O LEU A 97 0.685 6.035 15.643 1.00 0.00 O ATOM 1448 CB LEU A 97 1.944 3.370 17.254 1.00 0.00 C ATOM 1449 CG LEU A 97 0.602 3.336 17.992 1.00 0.00 C ATOM 1450 CD1 LEU A 97 0.645 2.286 19.089 1.00 0.00 C ATOM 1451 CD2 LEU A 97 0.271 4.693 18.596 1.00 0.00 C ATOM 0 H LEU A 97 3.901 3.270 15.804 1.00 0.00 H new ATOM 0 HA LEU A 97 1.103 3.594 15.279 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.314 2.348 17.172 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.657 3.919 17.869 1.00 0.00 H new ATOM 0 HG LEU A 97 -0.175 3.084 17.271 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.312 2.266 19.611 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.839 1.308 18.649 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.439 2.530 19.795 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.687 4.637 19.113 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.050 4.976 19.304 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.213 5.439 17.804 1.00 0.00 H new ATOM 1463 N GLU A 98 2.838 6.205 16.262 1.00 0.00 N ATOM 1464 CA GLU A 98 2.797 7.646 16.495 1.00 0.00 C ATOM 1465 C GLU A 98 2.439 8.425 15.226 1.00 0.00 C ATOM 1466 O GLU A 98 1.901 9.531 15.302 1.00 0.00 O ATOM 1467 CB GLU A 98 4.136 8.125 17.063 1.00 0.00 C ATOM 1468 CG GLU A 98 4.406 7.617 18.474 1.00 0.00 C ATOM 1469 CD GLU A 98 5.727 8.097 19.035 1.00 0.00 C ATOM 1470 OE1 GLU A 98 6.782 7.642 18.555 1.00 0.00 O ATOM 1471 OE2 GLU A 98 5.719 8.919 19.976 1.00 0.00 O ATOM 0 H GLU A 98 3.761 5.789 16.387 1.00 0.00 H new ATOM 0 HA GLU A 98 2.009 7.841 17.222 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.941 7.796 16.405 1.00 0.00 H new ATOM 0 HB3 GLU A 98 4.153 9.215 17.067 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.599 7.942 19.131 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.394 6.527 18.470 1.00 0.00 H new ATOM 1478 N GLU A 99 2.739 7.853 14.065 1.00 0.00 N ATOM 1479 CA GLU A 99 2.422 8.500 12.797 1.00 0.00 C ATOM 1480 C GLU A 99 1.090 8.006 12.238 1.00 0.00 C ATOM 1481 O GLU A 99 0.689 8.386 11.136 1.00 0.00 O ATOM 1482 CB GLU A 99 3.535 8.261 11.777 1.00 0.00 C ATOM 1483 CG GLU A 99 4.903 8.713 12.259 1.00 0.00 C ATOM 1484 CD GLU A 99 5.937 8.726 11.156 1.00 0.00 C ATOM 1485 OE1 GLU A 99 5.997 7.758 10.372 1.00 0.00 O ATOM 1486 OE2 GLU A 99 6.704 9.708 11.073 1.00 0.00 O ATOM 0 H GLU A 99 3.199 6.947 13.975 1.00 0.00 H new ATOM 0 HA GLU A 99 2.337 9.570 12.987 1.00 0.00 H new ATOM 0 HB2 GLU A 99 3.575 7.199 11.537 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.291 8.787 10.854 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.821 9.713 12.686 1.00 0.00 H new ATOM 0 HG3 GLU A 99 5.239 8.052 13.058 1.00 0.00 H new ATOM 1493 N ALA A 100 0.400 7.168 12.997 1.00 0.00 N ATOM 1494 CA ALA A 100 -0.891 6.650 12.574 1.00 0.00 C ATOM 1495 C ALA A 100 -2.019 7.527 13.104 1.00 0.00 C ATOM 1496 O ALA A 100 -2.783 7.128 13.980 1.00 0.00 O ATOM 1497 CB ALA A 100 -1.071 5.210 13.030 1.00 0.00 C ATOM 0 H ALA A 100 0.713 6.833 13.908 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.925 6.667 11.485 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -2.044 4.843 12.702 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.285 4.590 12.598 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -1.013 5.163 14.117 1.00 0.00 H new ATOM 1503 N THR A 101 -2.098 8.739 12.580 1.00 0.00 N ATOM 1504 CA THR A 101 -3.107 9.695 13.009 1.00 0.00 C ATOM 1505 C THR A 101 -4.346 9.629 12.110 1.00 0.00 C ATOM 1506 O THR A 101 -5.285 10.410 12.261 1.00 0.00 O ATOM 1507 CB THR A 101 -2.534 11.124 12.984 1.00 0.00 C ATOM 1508 OG1 THR A 101 -1.127 11.086 13.272 1.00 0.00 O ATOM 1509 CG2 THR A 101 -3.237 12.011 14.004 1.00 0.00 C ATOM 0 H THR A 101 -1.472 9.086 11.853 1.00 0.00 H new ATOM 0 HA THR A 101 -3.399 9.437 14.027 1.00 0.00 H new ATOM 0 HB THR A 101 -2.697 11.541 11.990 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.765 11.996 13.254 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.814 13.015 13.966 1.00 0.00 H new ATOM 0 HG22 THR A 101 -4.301 12.057 13.774 1.00 0.00 H new ATOM 0 HG23 THR A 101 -3.099 11.597 15.003 1.00 0.00 H new ATOM 1517 N PHE A 102 -4.346 8.677 11.184 1.00 0.00 N ATOM 1518 CA PHE A 102 -5.423 8.562 10.206 1.00 0.00 C ATOM 1519 C PHE A 102 -6.018 7.151 10.189 1.00 0.00 C ATOM 1520 O PHE A 102 -5.601 6.295 9.408 1.00 0.00 O ATOM 1521 CB PHE A 102 -4.935 8.981 8.807 1.00 0.00 C ATOM 1522 CG PHE A 102 -3.597 8.411 8.402 1.00 0.00 C ATOM 1523 CD1 PHE A 102 -2.418 9.011 8.817 1.00 0.00 C ATOM 1524 CD2 PHE A 102 -3.518 7.276 7.608 1.00 0.00 C ATOM 1525 CE1 PHE A 102 -1.191 8.494 8.446 1.00 0.00 C ATOM 1526 CE2 PHE A 102 -2.294 6.757 7.234 1.00 0.00 C ATOM 1527 CZ PHE A 102 -1.130 7.364 7.657 1.00 0.00 C ATOM 0 H PHE A 102 -3.613 7.974 11.089 1.00 0.00 H new ATOM 0 HA PHE A 102 -6.219 9.244 10.504 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -5.680 8.677 8.072 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -4.876 10.069 8.770 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -2.459 9.894 9.438 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.425 6.792 7.278 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -0.281 8.974 8.774 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -2.248 5.876 6.611 1.00 0.00 H new ATOM 0 HZ PHE A 102 -0.172 6.955 7.371 1.00 0.00 H new ATOM 1537 N PRO A 103 -6.987 6.885 11.078 1.00 0.00 N ATOM 1538 CA PRO A 103 -7.651 5.581 11.156 1.00 0.00 C ATOM 1539 C PRO A 103 -8.563 5.331 9.957 1.00 0.00 C ATOM 1540 O PRO A 103 -8.958 6.266 9.259 1.00 0.00 O ATOM 1541 CB PRO A 103 -8.469 5.673 12.444 1.00 0.00 C ATOM 1542 CG PRO A 103 -8.718 7.129 12.633 1.00 0.00 C ATOM 1543 CD PRO A 103 -7.513 7.835 12.076 1.00 0.00 C ATOM 0 HA PRO A 103 -6.938 4.756 11.152 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -9.404 5.119 12.359 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -7.925 5.252 13.289 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -9.625 7.439 12.115 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -8.856 7.367 13.688 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -7.781 8.788 11.620 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -6.779 8.049 12.853 1.00 0.00 H new ATOM 1551 N GLY A 104 -8.902 4.070 9.724 1.00 0.00 N ATOM 1552 CA GLY A 104 -9.719 3.724 8.577 1.00 0.00 C ATOM 1553 C GLY A 104 -8.883 3.192 7.434 1.00 0.00 C ATOM 1554 O GLY A 104 -9.391 2.530 6.528 1.00 0.00 O ATOM 0 H GLY A 104 -8.626 3.281 10.308 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -10.456 2.975 8.868 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -10.271 4.603 8.245 1.00 0.00 H new ATOM 1558 N PHE A 105 -7.594 3.493 7.475 1.00 0.00 N ATOM 1559 CA PHE A 105 -6.652 2.990 6.489 1.00 0.00 C ATOM 1560 C PHE A 105 -6.059 1.669 6.958 1.00 0.00 C ATOM 1561 O PHE A 105 -5.992 1.402 8.158 1.00 0.00 O ATOM 1562 CB PHE A 105 -5.526 4.003 6.255 1.00 0.00 C ATOM 1563 CG PHE A 105 -5.937 5.213 5.464 1.00 0.00 C ATOM 1564 CD1 PHE A 105 -6.644 6.249 6.057 1.00 0.00 C ATOM 1565 CD2 PHE A 105 -5.610 5.314 4.123 1.00 0.00 C ATOM 1566 CE1 PHE A 105 -7.009 7.363 5.325 1.00 0.00 C ATOM 1567 CE2 PHE A 105 -5.973 6.423 3.389 1.00 0.00 C ATOM 1568 CZ PHE A 105 -6.675 7.448 3.987 1.00 0.00 C ATOM 0 H PHE A 105 -7.174 4.089 8.188 1.00 0.00 H new ATOM 0 HA PHE A 105 -7.187 2.834 5.552 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -5.140 4.329 7.221 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -4.707 3.505 5.736 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -6.912 6.184 7.101 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -5.064 4.514 3.646 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -7.555 8.166 5.798 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -5.707 6.489 2.344 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.963 8.315 3.411 1.00 0.00 H new ATOM 1578 N THR A 106 -5.628 0.850 6.014 1.00 0.00 N ATOM 1579 CA THR A 106 -4.976 -0.402 6.346 1.00 0.00 C ATOM 1580 C THR A 106 -3.467 -0.197 6.425 1.00 0.00 C ATOM 1581 O THR A 106 -2.845 0.304 5.485 1.00 0.00 O ATOM 1582 CB THR A 106 -5.295 -1.499 5.307 1.00 0.00 C ATOM 1583 OG1 THR A 106 -6.711 -1.688 5.215 1.00 0.00 O ATOM 1584 CG2 THR A 106 -4.632 -2.817 5.682 1.00 0.00 C ATOM 0 H THR A 106 -5.718 1.030 5.014 1.00 0.00 H new ATOM 0 HA THR A 106 -5.356 -0.729 7.314 1.00 0.00 H new ATOM 0 HB THR A 106 -4.904 -1.175 4.343 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.950 -2.558 5.597 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.873 -3.572 4.933 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.551 -2.681 5.725 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.996 -3.143 6.656 1.00 0.00 H new ATOM 1592 N TYR A 107 -2.888 -0.558 7.560 1.00 0.00 N ATOM 1593 CA TYR A 107 -1.460 -0.397 7.769 1.00 0.00 C ATOM 1594 C TYR A 107 -0.744 -1.711 7.500 1.00 0.00 C ATOM 1595 O TYR A 107 -0.876 -2.666 8.266 1.00 0.00 O ATOM 1596 CB TYR A 107 -1.177 0.063 9.200 1.00 0.00 C ATOM 1597 CG TYR A 107 -1.987 1.265 9.627 1.00 0.00 C ATOM 1598 CD1 TYR A 107 -1.570 2.557 9.331 1.00 0.00 C ATOM 1599 CD2 TYR A 107 -3.171 1.103 10.333 1.00 0.00 C ATOM 1600 CE1 TYR A 107 -2.310 3.653 9.734 1.00 0.00 C ATOM 1601 CE2 TYR A 107 -3.916 2.191 10.736 1.00 0.00 C ATOM 1602 CZ TYR A 107 -3.484 3.462 10.435 1.00 0.00 C ATOM 1603 OH TYR A 107 -4.223 4.544 10.849 1.00 0.00 O ATOM 0 H TYR A 107 -3.387 -0.965 8.351 1.00 0.00 H new ATOM 0 HA TYR A 107 -1.092 0.361 7.078 1.00 0.00 H new ATOM 0 HB2 TYR A 107 -1.380 -0.761 9.883 1.00 0.00 H new ATOM 0 HB3 TYR A 107 -0.117 0.300 9.292 1.00 0.00 H new ATOM 0 HD1 TYR A 107 -0.655 2.707 8.778 1.00 0.00 H new ATOM 0 HD2 TYR A 107 -3.515 0.107 10.571 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -1.972 4.652 9.502 1.00 0.00 H new ATOM 0 HE2 TYR A 107 -4.834 2.046 11.285 1.00 0.00 H new ATOM 0 HH TYR A 107 -4.597 5.002 10.068 1.00 0.00 H new ATOM 1613 N VAL A 108 -0.007 -1.765 6.406 1.00 0.00 N ATOM 1614 CA VAL A 108 0.755 -2.954 6.076 1.00 0.00 C ATOM 1615 C VAL A 108 2.217 -2.750 6.435 1.00 0.00 C ATOM 1616 O VAL A 108 2.868 -1.824 5.949 1.00 0.00 O ATOM 1617 CB VAL A 108 0.633 -3.326 4.584 1.00 0.00 C ATOM 1618 CG1 VAL A 108 1.442 -4.579 4.271 1.00 0.00 C ATOM 1619 CG2 VAL A 108 -0.826 -3.525 4.203 1.00 0.00 C ATOM 0 H VAL A 108 0.080 -1.003 5.734 1.00 0.00 H new ATOM 0 HA VAL A 108 0.342 -3.778 6.658 1.00 0.00 H new ATOM 0 HB VAL A 108 1.037 -2.504 3.993 1.00 0.00 H new ATOM 0 HG11 VAL A 108 1.341 -4.822 3.213 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.492 -4.402 4.504 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.072 -5.410 4.871 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -0.894 -3.787 3.147 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.253 -4.328 4.804 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.378 -2.603 4.384 1.00 0.00 H new ATOM 1629 N ILE A 109 2.717 -3.603 7.302 1.00 0.00 N ATOM 1630 CA ILE A 109 4.100 -3.539 7.722 1.00 0.00 C ATOM 1631 C ILE A 109 4.808 -4.834 7.357 1.00 0.00 C ATOM 1632 O ILE A 109 4.347 -5.925 7.694 1.00 0.00 O ATOM 1633 CB ILE A 109 4.213 -3.280 9.241 1.00 0.00 C ATOM 1634 CG1 ILE A 109 3.499 -1.971 9.598 1.00 0.00 C ATOM 1635 CG2 ILE A 109 5.677 -3.226 9.665 1.00 0.00 C ATOM 1636 CD1 ILE A 109 3.487 -1.661 11.077 1.00 0.00 C ATOM 0 H ILE A 109 2.181 -4.356 7.733 1.00 0.00 H new ATOM 0 HA ILE A 109 4.577 -2.707 7.205 1.00 0.00 H new ATOM 0 HB ILE A 109 3.735 -4.100 9.777 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.982 -1.150 9.069 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.471 -2.020 9.239 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.739 -3.043 10.738 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.159 -4.175 9.431 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.181 -2.421 9.130 1.00 0.00 H new ATOM 0 HD11 ILE A 109 2.964 -0.720 11.247 1.00 0.00 H new ATOM 0 HD12 ILE A 109 2.977 -2.462 11.612 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.512 -1.577 11.440 1.00 0.00 H new ATOM 1648 N VAL A 110 5.906 -4.713 6.638 1.00 0.00 N ATOM 1649 CA VAL A 110 6.683 -5.871 6.253 1.00 0.00 C ATOM 1650 C VAL A 110 8.075 -5.772 6.841 1.00 0.00 C ATOM 1651 O VAL A 110 8.727 -4.727 6.765 1.00 0.00 O ATOM 1652 CB VAL A 110 6.749 -6.037 4.716 1.00 0.00 C ATOM 1653 CG1 VAL A 110 7.230 -4.764 4.040 1.00 0.00 C ATOM 1654 CG2 VAL A 110 7.636 -7.216 4.334 1.00 0.00 C ATOM 0 H VAL A 110 6.280 -3.823 6.309 1.00 0.00 H new ATOM 0 HA VAL A 110 6.187 -6.757 6.649 1.00 0.00 H new ATOM 0 HB VAL A 110 5.737 -6.240 4.364 1.00 0.00 H new ATOM 0 HG11 VAL A 110 7.265 -4.916 2.961 1.00 0.00 H new ATOM 0 HG12 VAL A 110 6.544 -3.948 4.270 1.00 0.00 H new ATOM 0 HG13 VAL A 110 8.227 -4.513 4.403 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.666 -7.312 3.249 1.00 0.00 H new ATOM 0 HG22 VAL A 110 8.645 -7.050 4.712 1.00 0.00 H new ATOM 0 HG23 VAL A 110 7.232 -8.131 4.768 1.00 0.00 H new ATOM 1664 N SER A 111 8.511 -6.844 7.464 1.00 0.00 N ATOM 1665 CA SER A 111 9.832 -6.883 8.032 1.00 0.00 C ATOM 1666 C SER A 111 10.832 -7.219 6.935 1.00 0.00 C ATOM 1667 O SER A 111 10.884 -8.349 6.458 1.00 0.00 O ATOM 1668 CB SER A 111 9.886 -7.917 9.155 1.00 0.00 C ATOM 1669 OG SER A 111 11.086 -7.810 9.898 1.00 0.00 O ATOM 0 H SER A 111 7.967 -7.698 7.588 1.00 0.00 H new ATOM 0 HA SER A 111 10.084 -5.911 8.457 1.00 0.00 H new ATOM 0 HB2 SER A 111 9.032 -7.781 9.819 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.805 -8.919 8.733 1.00 0.00 H new ATOM 0 HG SER A 111 11.091 -8.483 10.610 1.00 0.00 H new ATOM 1675 N VAL A 112 11.589 -6.228 6.505 1.00 0.00 N ATOM 1676 CA VAL A 112 12.607 -6.447 5.497 1.00 0.00 C ATOM 1677 C VAL A 112 13.976 -6.301 6.133 1.00 0.00 C ATOM 1678 O VAL A 112 14.359 -5.213 6.553 1.00 0.00 O ATOM 1679 CB VAL A 112 12.477 -5.461 4.315 1.00 0.00 C ATOM 1680 CG1 VAL A 112 13.542 -5.736 3.262 1.00 0.00 C ATOM 1681 CG2 VAL A 112 11.088 -5.537 3.699 1.00 0.00 C ATOM 0 H VAL A 112 11.518 -5.266 6.837 1.00 0.00 H new ATOM 0 HA VAL A 112 12.475 -7.453 5.100 1.00 0.00 H new ATOM 0 HB VAL A 112 12.627 -4.452 4.700 1.00 0.00 H new ATOM 0 HG11 VAL A 112 13.431 -5.030 2.439 1.00 0.00 H new ATOM 0 HG12 VAL A 112 14.531 -5.623 3.706 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.427 -6.752 2.886 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.019 -4.834 2.869 1.00 0.00 H new ATOM 0 HG22 VAL A 112 10.906 -6.548 3.335 1.00 0.00 H new ATOM 0 HG23 VAL A 112 10.342 -5.283 4.452 1.00 0.00 H new ATOM 1691 N ARG A 113 14.720 -7.389 6.172 1.00 0.00 N ATOM 1692 CA ARG A 113 15.990 -7.417 6.870 1.00 0.00 C ATOM 1693 C ARG A 113 17.121 -7.150 5.890 1.00 0.00 C ATOM 1694 O ARG A 113 18.014 -7.974 5.701 1.00 0.00 O ATOM 1695 CB ARG A 113 16.148 -8.764 7.580 1.00 0.00 C ATOM 1696 CG ARG A 113 15.052 -9.003 8.612 1.00 0.00 C ATOM 1697 CD ARG A 113 14.989 -10.452 9.066 1.00 0.00 C ATOM 1698 NE ARG A 113 16.183 -10.863 9.803 1.00 0.00 N ATOM 1699 CZ ARG A 113 16.240 -11.952 10.572 1.00 0.00 C ATOM 1700 NH1 ARG A 113 15.150 -12.683 10.768 1.00 0.00 N ATOM 1701 NH2 ARG A 113 17.382 -12.287 11.166 1.00 0.00 N ATOM 0 H ARG A 113 14.465 -8.270 5.726 1.00 0.00 H new ATOM 0 HA ARG A 113 16.023 -6.634 7.627 1.00 0.00 H new ATOM 0 HB2 ARG A 113 16.131 -9.566 6.842 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.121 -8.803 8.070 1.00 0.00 H new ATOM 0 HG2 ARG A 113 15.225 -8.362 9.476 1.00 0.00 H new ATOM 0 HG3 ARG A 113 14.089 -8.716 8.189 1.00 0.00 H new ATOM 0 HD2 ARG A 113 14.111 -10.594 9.696 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.864 -11.096 8.196 1.00 0.00 H new ATOM 0 HE ARG A 113 17.020 -10.285 9.725 1.00 0.00 H new ATOM 0 HH11 ARG A 113 14.269 -12.412 10.331 1.00 0.00 H new ATOM 0 HH12 ARG A 113 15.193 -13.516 11.356 1.00 0.00 H new ATOM 0 HH21 ARG A 113 18.214 -11.712 11.034 1.00 0.00 H new ATOM 0 HH22 ARG A 113 17.426 -13.119 11.754 1.00 0.00 H new ATOM 1715 N ASP A 114 17.038 -5.977 5.262 1.00 0.00 N ATOM 1716 CA ASP A 114 18.002 -5.530 4.257 1.00 0.00 C ATOM 1717 C ASP A 114 18.070 -6.507 3.089 1.00 0.00 C ATOM 1718 O ASP A 114 18.929 -7.385 3.038 1.00 0.00 O ATOM 1719 CB ASP A 114 19.389 -5.332 4.869 1.00 0.00 C ATOM 1720 CG ASP A 114 20.352 -4.671 3.905 1.00 0.00 C ATOM 1721 OD1 ASP A 114 20.217 -3.454 3.672 1.00 0.00 O ATOM 1722 OD2 ASP A 114 21.246 -5.362 3.374 1.00 0.00 O ATOM 0 H ASP A 114 16.292 -5.304 5.439 1.00 0.00 H new ATOM 0 HA ASP A 114 17.657 -4.568 3.879 1.00 0.00 H new ATOM 0 HB2 ASP A 114 19.303 -4.723 5.769 1.00 0.00 H new ATOM 0 HB3 ASP A 114 19.790 -6.298 5.175 1.00 0.00 H new ATOM 1727 N GLY A 115 17.127 -6.372 2.169 1.00 0.00 N ATOM 1728 CA GLY A 115 17.100 -7.230 1.001 1.00 0.00 C ATOM 1729 C GLY A 115 16.329 -8.513 1.238 1.00 0.00 C ATOM 1730 O GLY A 115 15.855 -9.140 0.292 1.00 0.00 O ATOM 0 H GLY A 115 16.377 -5.682 2.210 1.00 0.00 H new ATOM 0 HA2 GLY A 115 16.651 -6.689 0.168 1.00 0.00 H new ATOM 0 HA3 GLY A 115 18.122 -7.473 0.710 1.00 0.00 H new ATOM 1734 N ALA A 116 16.199 -8.904 2.498 1.00 0.00 N ATOM 1735 CA ALA A 116 15.484 -10.125 2.844 1.00 0.00 C ATOM 1736 C ALA A 116 14.136 -9.823 3.490 1.00 0.00 C ATOM 1737 O ALA A 116 14.067 -9.478 4.668 1.00 0.00 O ATOM 1738 CB ALA A 116 16.331 -10.990 3.765 1.00 0.00 C ATOM 0 H ALA A 116 16.578 -8.395 3.296 1.00 0.00 H new ATOM 0 HA ALA A 116 15.293 -10.671 1.920 1.00 0.00 H new ATOM 0 HB1 ALA A 116 15.784 -11.899 4.015 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.262 -11.253 3.263 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.555 -10.438 4.678 1.00 0.00 H new ATOM 1744 N PRO A 117 13.047 -9.925 2.718 1.00 0.00 N ATOM 1745 CA PRO A 117 11.692 -9.744 3.232 1.00 0.00 C ATOM 1746 C PRO A 117 11.239 -10.964 4.033 1.00 0.00 C ATOM 1747 O PRO A 117 11.108 -12.059 3.488 1.00 0.00 O ATOM 1748 CB PRO A 117 10.833 -9.577 1.965 1.00 0.00 C ATOM 1749 CG PRO A 117 11.800 -9.513 0.824 1.00 0.00 C ATOM 1750 CD PRO A 117 13.038 -10.223 1.284 1.00 0.00 C ATOM 0 HA PRO A 117 11.615 -8.895 3.911 1.00 0.00 H new ATOM 0 HB2 PRO A 117 10.143 -10.413 1.847 1.00 0.00 H new ATOM 0 HB3 PRO A 117 10.230 -8.671 2.018 1.00 0.00 H new ATOM 0 HG2 PRO A 117 11.386 -9.989 -0.065 1.00 0.00 H new ATOM 0 HG3 PRO A 117 12.020 -8.479 0.558 1.00 0.00 H new ATOM 0 HD2 PRO A 117 12.989 -11.295 1.091 1.00 0.00 H new ATOM 0 HD3 PRO A 117 13.932 -9.849 0.784 1.00 0.00 H new ATOM 1758 N GLU A 118 11.012 -10.769 5.322 1.00 0.00 N ATOM 1759 CA GLU A 118 10.679 -11.868 6.216 1.00 0.00 C ATOM 1760 C GLU A 118 9.188 -12.188 6.166 1.00 0.00 C ATOM 1761 O GLU A 118 8.779 -13.201 5.600 1.00 0.00 O ATOM 1762 CB GLU A 118 11.098 -11.520 7.644 1.00 0.00 C ATOM 1763 CG GLU A 118 10.926 -12.664 8.628 1.00 0.00 C ATOM 1764 CD GLU A 118 11.368 -12.295 10.027 1.00 0.00 C ATOM 1765 OE1 GLU A 118 12.587 -12.172 10.257 1.00 0.00 O ATOM 1766 OE2 GLU A 118 10.496 -12.116 10.905 1.00 0.00 O ATOM 0 H GLU A 118 11.052 -9.856 5.775 1.00 0.00 H new ATOM 0 HA GLU A 118 11.222 -12.754 5.887 1.00 0.00 H new ATOM 0 HB2 GLU A 118 12.143 -11.209 7.641 1.00 0.00 H new ATOM 0 HB3 GLU A 118 10.513 -10.667 7.987 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.879 -12.967 8.649 1.00 0.00 H new ATOM 0 HG3 GLU A 118 11.500 -13.524 8.284 1.00 0.00 H new ATOM 1773 N ALA A 119 8.373 -11.314 6.745 1.00 0.00 N ATOM 1774 CA ALA A 119 6.946 -11.570 6.838 1.00 0.00 C ATOM 1775 C ALA A 119 6.129 -10.312 6.582 1.00 0.00 C ATOM 1776 O ALA A 119 6.584 -9.194 6.838 1.00 0.00 O ATOM 1777 CB ALA A 119 6.608 -12.147 8.203 1.00 0.00 C ATOM 0 H ALA A 119 8.675 -10.430 7.153 1.00 0.00 H new ATOM 0 HA ALA A 119 6.687 -12.294 6.065 1.00 0.00 H new ATOM 0 HB1 ALA A 119 5.536 -12.335 8.263 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.149 -13.082 8.347 1.00 0.00 H new ATOM 0 HB3 ALA A 119 6.896 -11.438 8.979 1.00 0.00 H new ATOM 1783 N LEU A 120 4.923 -10.517 6.069 1.00 0.00 N ATOM 1784 CA LEU A 120 3.968 -9.441 5.838 1.00 0.00 C ATOM 1785 C LEU A 120 2.922 -9.430 6.942 1.00 0.00 C ATOM 1786 O LEU A 120 2.338 -10.464 7.258 1.00 0.00 O ATOM 1787 CB LEU A 120 3.271 -9.623 4.485 1.00 0.00 C ATOM 1788 CG LEU A 120 4.089 -9.203 3.265 1.00 0.00 C ATOM 1789 CD1 LEU A 120 3.433 -9.696 1.987 1.00 0.00 C ATOM 1790 CD2 LEU A 120 4.235 -7.693 3.229 1.00 0.00 C ATOM 0 H LEU A 120 4.578 -11.438 5.800 1.00 0.00 H new ATOM 0 HA LEU A 120 4.510 -8.495 5.836 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.998 -10.672 4.374 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.343 -9.051 4.494 1.00 0.00 H new ATOM 0 HG LEU A 120 5.079 -9.653 3.341 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.030 -9.387 1.129 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.365 -10.784 2.009 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.432 -9.271 1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 120 4.820 -7.405 2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.248 -7.233 3.173 1.00 0.00 H new ATOM 0 HD23 LEU A 120 4.742 -7.355 4.133 1.00 0.00 H new ATOM 1802 N THR A 121 2.693 -8.272 7.534 1.00 0.00 N ATOM 1803 CA THR A 121 1.688 -8.147 8.572 1.00 0.00 C ATOM 1804 C THR A 121 0.783 -6.951 8.310 1.00 0.00 C ATOM 1805 O THR A 121 1.258 -5.856 8.009 1.00 0.00 O ATOM 1806 CB THR A 121 2.330 -8.020 9.973 1.00 0.00 C ATOM 1807 OG1 THR A 121 3.367 -7.028 9.961 1.00 0.00 O ATOM 1808 CG2 THR A 121 2.898 -9.353 10.437 1.00 0.00 C ATOM 0 H THR A 121 3.188 -7.408 7.314 1.00 0.00 H new ATOM 0 HA THR A 121 1.089 -9.058 8.551 1.00 0.00 H new ATOM 0 HB THR A 121 1.550 -7.714 10.671 1.00 0.00 H new ATOM 0 HG1 THR A 121 3.466 -6.669 9.054 1.00 0.00 H new ATOM 0 HG21 THR A 121 3.343 -9.235 11.425 1.00 0.00 H new ATOM 0 HG22 THR A 121 2.098 -10.092 10.486 1.00 0.00 H new ATOM 0 HG23 THR A 121 3.660 -9.689 9.733 1.00 0.00 H new ATOM 1816 N ALA A 122 -0.522 -7.168 8.397 1.00 0.00 N ATOM 1817 CA ALA A 122 -1.482 -6.089 8.233 1.00 0.00 C ATOM 1818 C ALA A 122 -2.129 -5.772 9.568 1.00 0.00 C ATOM 1819 O ALA A 122 -2.539 -6.675 10.302 1.00 0.00 O ATOM 1820 CB ALA A 122 -2.538 -6.453 7.199 1.00 0.00 C ATOM 0 H ALA A 122 -0.938 -8.081 8.580 1.00 0.00 H new ATOM 0 HA ALA A 122 -0.956 -5.205 7.874 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.244 -5.629 7.095 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.057 -6.643 6.239 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.070 -7.348 7.522 1.00 0.00 H new ATOM 1826 N TRP A 123 -2.208 -4.492 9.887 1.00 0.00 N ATOM 1827 CA TRP A 123 -2.647 -4.068 11.203 1.00 0.00 C ATOM 1828 C TRP A 123 -3.790 -3.071 11.110 1.00 0.00 C ATOM 1829 O TRP A 123 -3.800 -2.195 10.241 1.00 0.00 O ATOM 1830 CB TRP A 123 -1.473 -3.446 11.961 1.00 0.00 C ATOM 1831 CG TRP A 123 -0.278 -4.344 12.028 1.00 0.00 C ATOM 1832 CD1 TRP A 123 0.722 -4.452 11.101 1.00 0.00 C ATOM 1833 CD2 TRP A 123 0.035 -5.277 13.068 1.00 0.00 C ATOM 1834 NE1 TRP A 123 1.640 -5.390 11.508 1.00 0.00 N ATOM 1835 CE2 TRP A 123 1.240 -5.908 12.712 1.00 0.00 C ATOM 1836 CE3 TRP A 123 -0.585 -5.634 14.267 1.00 0.00 C ATOM 1837 CZ2 TRP A 123 1.835 -6.882 13.511 1.00 0.00 C ATOM 1838 CZ3 TRP A 123 0.005 -6.600 15.058 1.00 0.00 C ATOM 1839 CH2 TRP A 123 1.204 -7.215 14.679 1.00 0.00 C ATOM 0 H TRP A 123 -1.974 -3.729 9.252 1.00 0.00 H new ATOM 0 HA TRP A 123 -3.009 -4.944 11.741 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -1.191 -2.510 11.478 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -1.792 -3.199 12.974 1.00 0.00 H new ATOM 0 HD1 TRP A 123 0.781 -3.884 10.184 1.00 0.00 H new ATOM 0 HE1 TRP A 123 2.482 -5.657 10.997 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -1.509 -5.163 14.570 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 2.760 -7.357 13.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.467 -6.886 15.986 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.640 -7.967 15.321 1.00 0.00 H new ATOM 1850 N ALA A 124 -4.753 -3.220 12.000 1.00 0.00 N ATOM 1851 CA ALA A 124 -5.845 -2.275 12.112 1.00 0.00 C ATOM 1852 C ALA A 124 -5.662 -1.435 13.363 1.00 0.00 C ATOM 1853 O ALA A 124 -5.382 -1.968 14.441 1.00 0.00 O ATOM 1854 CB ALA A 124 -7.180 -3.005 12.143 1.00 0.00 C ATOM 0 H ALA A 124 -4.800 -3.995 12.661 1.00 0.00 H new ATOM 0 HA ALA A 124 -5.842 -1.619 11.242 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -7.989 -2.280 12.227 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -7.302 -3.580 11.225 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -7.206 -3.679 12.999 1.00 0.00 H new ATOM 1860 N LEU A 125 -5.805 -0.129 13.216 1.00 0.00 N ATOM 1861 CA LEU A 125 -5.612 0.788 14.326 1.00 0.00 C ATOM 1862 C LEU A 125 -6.853 0.833 15.198 1.00 0.00 C ATOM 1863 O LEU A 125 -7.978 0.849 14.690 1.00 0.00 O ATOM 1864 CB LEU A 125 -5.296 2.194 13.805 1.00 0.00 C ATOM 1865 CG LEU A 125 -5.066 3.257 14.880 1.00 0.00 C ATOM 1866 CD1 LEU A 125 -3.825 2.936 15.701 1.00 0.00 C ATOM 1867 CD2 LEU A 125 -4.952 4.634 14.244 1.00 0.00 C ATOM 0 H LEU A 125 -6.055 0.321 12.336 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.772 0.432 14.923 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -4.407 2.139 13.177 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.117 2.519 13.167 1.00 0.00 H new ATOM 0 HG LEU A 125 -5.923 3.258 15.554 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.681 3.706 16.459 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -3.950 1.968 16.186 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -2.954 2.904 15.047 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.788 5.381 15.021 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -4.113 4.645 13.548 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.872 4.864 13.707 1.00 0.00 H new ATOM 1879 N ALA A 126 -6.642 0.831 16.506 1.00 0.00 N ATOM 1880 CA ALA A 126 -7.729 0.984 17.454 1.00 0.00 C ATOM 1881 C ALA A 126 -8.308 2.390 17.353 1.00 0.00 C ATOM 1882 O ALA A 126 -7.589 3.330 17.014 1.00 0.00 O ATOM 1883 CB ALA A 126 -7.242 0.697 18.865 1.00 0.00 C ATOM 0 H ALA A 126 -5.722 0.724 16.934 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.515 0.268 17.216 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -8.068 0.816 19.566 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.864 -0.324 18.919 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -6.444 1.393 19.123 1.00 0.00 H new ATOM 1889 N PRO A 127 -9.608 2.551 17.643 1.00 0.00 N ATOM 1890 CA PRO A 127 -10.310 3.835 17.494 1.00 0.00 C ATOM 1891 C PRO A 127 -9.613 5.002 18.196 1.00 0.00 C ATOM 1892 O PRO A 127 -9.659 6.139 17.719 1.00 0.00 O ATOM 1893 CB PRO A 127 -11.670 3.566 18.139 1.00 0.00 C ATOM 1894 CG PRO A 127 -11.869 2.099 17.986 1.00 0.00 C ATOM 1895 CD PRO A 127 -10.507 1.490 18.132 1.00 0.00 C ATOM 0 HA PRO A 127 -10.356 4.140 16.448 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -11.677 3.861 19.188 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -12.462 4.128 17.645 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -12.553 1.715 18.743 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -12.303 1.861 17.015 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -10.293 1.227 19.168 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -10.409 0.577 17.544 1.00 0.00 H new ATOM 1903 N ASP A 128 -8.956 4.723 19.314 1.00 0.00 N ATOM 1904 CA ASP A 128 -8.318 5.777 20.099 1.00 0.00 C ATOM 1905 C ASP A 128 -6.821 5.862 19.786 1.00 0.00 C ATOM 1906 O ASP A 128 -6.062 6.491 20.520 1.00 0.00 O ATOM 1907 CB ASP A 128 -8.547 5.531 21.592 1.00 0.00 C ATOM 1908 CG ASP A 128 -8.218 6.741 22.444 1.00 0.00 C ATOM 1909 OD1 ASP A 128 -8.737 7.839 22.149 1.00 0.00 O ATOM 1910 OD2 ASP A 128 -7.467 6.591 23.431 1.00 0.00 O ATOM 0 H ASP A 128 -8.850 3.784 19.697 1.00 0.00 H new ATOM 0 HA ASP A 128 -8.769 6.732 19.829 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -9.588 5.251 21.754 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -7.936 4.688 21.915 1.00 0.00 H new ATOM 1915 N ARG A 129 -6.423 5.210 18.687 1.00 0.00 N ATOM 1916 CA ARG A 129 -5.051 5.248 18.145 1.00 0.00 C ATOM 1917 C ARG A 129 -3.989 4.927 19.203 1.00 0.00 C ATOM 1918 O ARG A 129 -2.845 5.373 19.107 1.00 0.00 O ATOM 1919 CB ARG A 129 -4.763 6.604 17.468 1.00 0.00 C ATOM 1920 CG ARG A 129 -4.501 7.763 18.423 1.00 0.00 C ATOM 1921 CD ARG A 129 -4.399 9.087 17.687 1.00 0.00 C ATOM 1922 NE ARG A 129 -5.671 9.461 17.066 1.00 0.00 N ATOM 1923 CZ ARG A 129 -6.081 10.718 16.896 1.00 0.00 C ATOM 1924 NH1 ARG A 129 -5.314 11.729 17.281 1.00 0.00 N ATOM 1925 NH2 ARG A 129 -7.263 10.958 16.343 1.00 0.00 N ATOM 0 H ARG A 129 -7.055 4.629 18.136 1.00 0.00 H new ATOM 0 HA ARG A 129 -4.990 4.463 17.391 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.898 6.490 16.815 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -5.610 6.862 16.833 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -5.304 7.817 19.158 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -3.577 7.580 18.972 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -4.090 9.867 18.383 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -3.626 9.019 16.921 1.00 0.00 H new ATOM 0 HE ARG A 129 -6.283 8.712 16.743 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -4.406 11.546 17.709 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -5.632 12.689 17.149 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -7.856 10.182 16.049 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -7.579 11.919 16.212 1.00 0.00 H new ATOM 1939 N SER A 130 -4.353 4.120 20.187 1.00 0.00 N ATOM 1940 CA SER A 130 -3.435 3.779 21.262 1.00 0.00 C ATOM 1941 C SER A 130 -2.695 2.464 21.000 1.00 0.00 C ATOM 1942 O SER A 130 -1.585 2.264 21.499 1.00 0.00 O ATOM 1943 CB SER A 130 -4.196 3.726 22.584 1.00 0.00 C ATOM 1944 OG SER A 130 -5.483 3.160 22.405 1.00 0.00 O ATOM 0 H SER A 130 -5.275 3.690 20.264 1.00 0.00 H new ATOM 0 HA SER A 130 -2.672 4.556 21.314 1.00 0.00 H new ATOM 0 HB2 SER A 130 -3.633 3.138 23.309 1.00 0.00 H new ATOM 0 HB3 SER A 130 -4.290 4.731 22.994 1.00 0.00 H new ATOM 0 HG SER A 130 -5.425 2.407 21.781 1.00 0.00 H new ATOM 1950 N GLU A 131 -3.299 1.568 20.221 1.00 0.00 N ATOM 1951 CA GLU A 131 -2.654 0.305 19.880 1.00 0.00 C ATOM 1952 C GLU A 131 -3.172 -0.243 18.551 1.00 0.00 C ATOM 1953 O GLU A 131 -4.154 0.257 17.996 1.00 0.00 O ATOM 1954 CB GLU A 131 -2.852 -0.744 20.987 1.00 0.00 C ATOM 1955 CG GLU A 131 -4.303 -1.128 21.255 1.00 0.00 C ATOM 1956 CD GLU A 131 -5.021 -0.155 22.168 1.00 0.00 C ATOM 1957 OE1 GLU A 131 -4.871 -0.270 23.406 1.00 0.00 O ATOM 1958 OE2 GLU A 131 -5.750 0.719 21.659 1.00 0.00 O ATOM 0 H GLU A 131 -4.227 1.693 19.817 1.00 0.00 H new ATOM 0 HA GLU A 131 -1.588 0.510 19.782 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -2.297 -1.643 20.719 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -2.416 -0.363 21.910 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -4.837 -1.187 20.307 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -4.332 -2.123 21.700 1.00 0.00 H new ATOM 1965 N PHE A 132 -2.492 -1.266 18.045 1.00 0.00 N ATOM 1966 CA PHE A 132 -2.897 -1.940 16.818 1.00 0.00 C ATOM 1967 C PHE A 132 -3.332 -3.367 17.110 1.00 0.00 C ATOM 1968 O PHE A 132 -2.874 -3.985 18.072 1.00 0.00 O ATOM 1969 CB PHE A 132 -1.749 -1.990 15.805 1.00 0.00 C ATOM 1970 CG PHE A 132 -1.371 -0.668 15.206 1.00 0.00 C ATOM 1971 CD1 PHE A 132 -2.038 -0.186 14.091 1.00 0.00 C ATOM 1972 CD2 PHE A 132 -0.341 0.083 15.744 1.00 0.00 C ATOM 1973 CE1 PHE A 132 -1.682 1.022 13.525 1.00 0.00 C ATOM 1974 CE2 PHE A 132 0.015 1.291 15.184 1.00 0.00 C ATOM 1975 CZ PHE A 132 -0.655 1.763 14.073 1.00 0.00 C ATOM 0 H PHE A 132 -1.649 -1.650 18.472 1.00 0.00 H new ATOM 0 HA PHE A 132 -3.727 -1.370 16.401 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -0.872 -2.414 16.294 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -2.025 -2.671 15.000 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -2.844 -0.761 13.660 1.00 0.00 H new ATOM 0 HD2 PHE A 132 0.189 -0.281 16.612 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -2.207 1.387 12.654 1.00 0.00 H new ATOM 0 HE2 PHE A 132 0.819 1.869 15.615 1.00 0.00 H new ATOM 0 HZ PHE A 132 -0.376 2.710 13.634 1.00 0.00 H new ATOM 1985 N HIS A 133 -4.219 -3.883 16.277 1.00 0.00 N ATOM 1986 CA HIS A 133 -4.556 -5.294 16.307 1.00 0.00 C ATOM 1987 C HIS A 133 -4.384 -5.884 14.918 1.00 0.00 C ATOM 1988 O HIS A 133 -4.769 -5.271 13.921 1.00 0.00 O ATOM 1989 CB HIS A 133 -5.967 -5.550 16.847 1.00 0.00 C ATOM 1990 CG HIS A 133 -7.025 -4.631 16.330 1.00 0.00 C ATOM 1991 ND1 HIS A 133 -8.000 -5.020 15.444 1.00 0.00 N ATOM 1992 CD2 HIS A 133 -7.277 -3.344 16.627 1.00 0.00 C ATOM 1993 CE1 HIS A 133 -8.813 -4.005 15.220 1.00 0.00 C ATOM 1994 NE2 HIS A 133 -8.399 -2.970 15.931 1.00 0.00 N ATOM 0 H HIS A 133 -4.719 -3.344 15.570 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.874 -5.789 16.998 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -6.250 -6.575 16.606 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -5.942 -5.473 17.934 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -6.701 -2.718 17.293 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -9.672 -4.018 14.566 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -8.839 -2.050 15.958 1.00 0.00 H new ATOM 2003 N ARG A 134 -3.784 -7.061 14.858 1.00 0.00 N ATOM 2004 CA ARG A 134 -3.419 -7.673 13.591 1.00 0.00 C ATOM 2005 C ARG A 134 -4.628 -8.255 12.870 1.00 0.00 C ATOM 2006 O ARG A 134 -5.569 -8.747 13.495 1.00 0.00 O ATOM 2007 CB ARG A 134 -2.365 -8.750 13.816 1.00 0.00 C ATOM 2008 CG ARG A 134 -1.924 -9.450 12.544 1.00 0.00 C ATOM 2009 CD ARG A 134 -0.558 -10.056 12.729 1.00 0.00 C ATOM 2010 NE ARG A 134 -0.395 -11.324 12.010 1.00 0.00 N ATOM 2011 CZ ARG A 134 0.524 -12.241 12.323 1.00 0.00 C ATOM 2012 NH1 ARG A 134 1.357 -12.023 13.332 1.00 0.00 N ATOM 2013 NH2 ARG A 134 0.602 -13.377 11.640 1.00 0.00 N ATOM 0 H ARG A 134 -3.538 -7.615 15.678 1.00 0.00 H new ATOM 0 HA ARG A 134 -3.006 -6.892 12.953 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -1.494 -8.299 14.292 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -2.760 -9.492 14.510 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -2.642 -10.227 12.281 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -1.906 -8.740 11.717 1.00 0.00 H new ATOM 0 HD2 ARG A 134 0.197 -9.349 12.385 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -0.380 -10.221 13.792 1.00 0.00 H new ATOM 0 HE ARG A 134 -1.019 -11.516 11.226 1.00 0.00 H new ATOM 0 HH11 ARG A 134 1.295 -11.157 13.867 1.00 0.00 H new ATOM 0 HH12 ARG A 134 2.060 -12.722 13.573 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -0.043 -13.554 10.870 1.00 0.00 H new ATOM 0 HH22 ARG A 134 1.307 -14.072 11.885 1.00 0.00 H new ATOM 2027 N GLU A 135 -4.588 -8.186 11.551 1.00 0.00 N ATOM 2028 CA GLU A 135 -5.628 -8.752 10.713 1.00 0.00 C ATOM 2029 C GLU A 135 -4.979 -9.638 9.663 1.00 0.00 C ATOM 2030 O GLU A 135 -3.804 -9.457 9.331 1.00 0.00 O ATOM 2031 CB GLU A 135 -6.455 -7.645 10.047 1.00 0.00 C ATOM 2032 CG GLU A 135 -7.635 -8.162 9.234 1.00 0.00 C ATOM 2033 CD GLU A 135 -8.438 -7.055 8.580 1.00 0.00 C ATOM 2034 OE1 GLU A 135 -9.204 -6.371 9.292 1.00 0.00 O ATOM 2035 OE2 GLU A 135 -8.322 -6.879 7.348 1.00 0.00 O ATOM 0 H GLU A 135 -3.834 -7.736 11.032 1.00 0.00 H new ATOM 0 HA GLU A 135 -6.306 -9.345 11.327 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -6.825 -6.968 10.817 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -5.805 -7.061 9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -7.268 -8.840 8.464 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -8.290 -8.742 9.884 1.00 0.00 H new ATOM 2042 N ASP A 136 -5.718 -10.607 9.160 1.00 0.00 N ATOM 2043 CA ASP A 136 -5.189 -11.496 8.143 1.00 0.00 C ATOM 2044 C ASP A 136 -5.637 -11.051 6.766 1.00 0.00 C ATOM 2045 O ASP A 136 -6.730 -10.507 6.600 1.00 0.00 O ATOM 2046 CB ASP A 136 -5.613 -12.943 8.390 1.00 0.00 C ATOM 2047 CG ASP A 136 -4.878 -13.572 9.554 1.00 0.00 C ATOM 2048 OD1 ASP A 136 -3.636 -13.663 9.502 1.00 0.00 O ATOM 2049 OD2 ASP A 136 -5.538 -13.990 10.528 1.00 0.00 O ATOM 0 H ASP A 136 -6.681 -10.799 9.436 1.00 0.00 H new ATOM 0 HA ASP A 136 -4.101 -11.449 8.197 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -6.686 -12.976 8.581 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -5.431 -13.530 7.490 1.00 0.00 H new ATOM 2054 N ILE A 137 -4.795 -11.292 5.784 1.00 0.00 N ATOM 2055 CA ILE A 137 -5.082 -10.883 4.427 1.00 0.00 C ATOM 2056 C ILE A 137 -5.949 -11.930 3.742 1.00 0.00 C ATOM 2057 O ILE A 137 -5.636 -13.124 3.760 1.00 0.00 O ATOM 2058 CB ILE A 137 -3.793 -10.664 3.597 1.00 0.00 C ATOM 2059 CG1 ILE A 137 -2.956 -9.501 4.149 1.00 0.00 C ATOM 2060 CG2 ILE A 137 -4.141 -10.408 2.141 1.00 0.00 C ATOM 2061 CD1 ILE A 137 -2.152 -9.845 5.386 1.00 0.00 C ATOM 0 H ILE A 137 -3.902 -11.771 5.902 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.611 -9.932 4.482 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.195 -11.572 3.670 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -2.275 -9.157 3.371 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -3.620 -8.669 4.381 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -3.225 -10.256 1.569 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.681 -11.266 1.740 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.767 -9.519 2.067 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -1.590 -8.969 5.710 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -2.826 -10.159 6.183 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -1.460 -10.655 5.156 1.00 0.00 H new ATOM 2073 N VAL A 138 -7.043 -11.482 3.155 1.00 0.00 N ATOM 2074 CA VAL A 138 -7.947 -12.375 2.456 1.00 0.00 C ATOM 2075 C VAL A 138 -7.872 -12.150 0.956 1.00 0.00 C ATOM 2076 O VAL A 138 -7.670 -11.024 0.491 1.00 0.00 O ATOM 2077 CB VAL A 138 -9.408 -12.202 2.928 1.00 0.00 C ATOM 2078 CG1 VAL A 138 -9.584 -12.732 4.344 1.00 0.00 C ATOM 2079 CG2 VAL A 138 -9.837 -10.743 2.859 1.00 0.00 C ATOM 0 H VAL A 138 -7.327 -10.502 3.149 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.630 -13.392 2.688 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.043 -12.779 2.256 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -10.620 -12.600 4.656 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.329 -13.792 4.370 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.929 -12.185 5.021 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.869 -10.651 3.197 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -9.191 -10.143 3.500 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.759 -10.389 1.831 1.00 0.00 H new ATOM 2089 N ARG A 139 -8.011 -13.227 0.203 1.00 0.00 N ATOM 2090 CA ARG A 139 -8.041 -13.140 -1.240 1.00 0.00 C ATOM 2091 C ARG A 139 -9.454 -12.789 -1.685 1.00 0.00 C ATOM 2092 O ARG A 139 -10.420 -13.374 -1.195 1.00 0.00 O ATOM 2093 CB ARG A 139 -7.585 -14.458 -1.879 1.00 0.00 C ATOM 2094 CG ARG A 139 -6.074 -14.660 -1.903 1.00 0.00 C ATOM 2095 CD ARG A 139 -5.501 -14.959 -0.522 1.00 0.00 C ATOM 2096 NE ARG A 139 -4.042 -15.096 -0.553 1.00 0.00 N ATOM 2097 CZ ARG A 139 -3.390 -16.235 -0.291 1.00 0.00 C ATOM 2098 NH1 ARG A 139 -4.064 -17.338 0.003 1.00 0.00 N ATOM 2099 NH2 ARG A 139 -2.065 -16.273 -0.337 1.00 0.00 N ATOM 0 H ARG A 139 -8.105 -14.173 0.572 1.00 0.00 H new ATOM 0 HA ARG A 139 -7.351 -12.362 -1.567 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -8.041 -15.287 -1.337 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -7.961 -14.500 -2.901 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -5.831 -15.480 -2.578 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -5.598 -13.765 -2.304 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -5.776 -14.159 0.166 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -5.944 -15.877 -0.136 1.00 0.00 H new ATOM 0 HE ARG A 139 -3.489 -14.272 -0.789 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -5.083 -17.321 0.030 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -3.563 -18.204 0.202 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -1.539 -15.432 -0.573 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -1.572 -17.143 -0.137 1.00 0.00 H new ATOM 2113 N PRO A 140 -9.597 -11.819 -2.599 1.00 0.00 N ATOM 2114 CA PRO A 140 -10.908 -11.325 -3.022 1.00 0.00 C ATOM 2115 C PRO A 140 -11.728 -12.399 -3.722 1.00 0.00 C ATOM 2116 O PRO A 140 -11.182 -13.390 -4.219 1.00 0.00 O ATOM 2117 CB PRO A 140 -10.580 -10.183 -3.991 1.00 0.00 C ATOM 2118 CG PRO A 140 -9.188 -10.449 -4.448 1.00 0.00 C ATOM 2119 CD PRO A 140 -8.500 -11.143 -3.307 1.00 0.00 C ATOM 0 HA PRO A 140 -11.513 -11.009 -2.172 1.00 0.00 H new ATOM 0 HB2 PRO A 140 -11.274 -10.167 -4.831 1.00 0.00 H new ATOM 0 HB3 PRO A 140 -10.654 -9.214 -3.498 1.00 0.00 H new ATOM 0 HG2 PRO A 140 -9.184 -11.072 -5.342 1.00 0.00 H new ATOM 0 HG3 PRO A 140 -8.678 -9.520 -4.704 1.00 0.00 H new ATOM 0 HD2 PRO A 140 -7.754 -11.854 -3.662 1.00 0.00 H new ATOM 0 HD3 PRO A 140 -7.983 -10.434 -2.660 1.00 0.00 H new ATOM 2127 N ASP A 141 -13.037 -12.199 -3.736 1.00 0.00 N ATOM 2128 CA ASP A 141 -13.962 -13.124 -4.374 1.00 0.00 C ATOM 2129 C ASP A 141 -13.557 -13.358 -5.826 1.00 0.00 C ATOM 2130 O ASP A 141 -13.308 -12.404 -6.570 1.00 0.00 O ATOM 2131 CB ASP A 141 -15.389 -12.573 -4.288 1.00 0.00 C ATOM 2132 CG ASP A 141 -15.824 -12.336 -2.850 1.00 0.00 C ATOM 2133 OD1 ASP A 141 -15.253 -11.441 -2.190 1.00 0.00 O ATOM 2134 OD2 ASP A 141 -16.733 -13.048 -2.368 1.00 0.00 O ATOM 0 H ASP A 141 -13.488 -11.392 -3.306 1.00 0.00 H new ATOM 0 HA ASP A 141 -13.927 -14.081 -3.854 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -15.450 -11.637 -4.844 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -16.077 -13.272 -4.764 1.00 0.00 H new ATOM 2139 N PRO A 142 -13.500 -14.632 -6.248 1.00 0.00 N ATOM 2140 CA PRO A 142 -12.951 -15.027 -7.554 1.00 0.00 C ATOM 2141 C PRO A 142 -13.862 -14.697 -8.735 1.00 0.00 C ATOM 2142 O PRO A 142 -13.992 -15.482 -9.674 1.00 0.00 O ATOM 2143 CB PRO A 142 -12.782 -16.540 -7.413 1.00 0.00 C ATOM 2144 CG PRO A 142 -13.820 -16.950 -6.429 1.00 0.00 C ATOM 2145 CD PRO A 142 -13.976 -15.797 -5.474 1.00 0.00 C ATOM 0 HA PRO A 142 -12.031 -14.486 -7.776 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -12.923 -17.044 -8.369 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -11.782 -16.795 -7.062 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -14.763 -17.171 -6.928 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -13.519 -17.855 -5.901 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -15.013 -15.673 -5.162 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -13.386 -15.944 -4.569 1.00 0.00 H new ATOM 2153 N GLU A 143 -14.456 -13.521 -8.699 1.00 0.00 N ATOM 2154 CA GLU A 143 -15.279 -13.036 -9.800 1.00 0.00 C ATOM 2155 C GLU A 143 -14.735 -11.706 -10.313 1.00 0.00 C ATOM 2156 O GLU A 143 -14.924 -11.351 -11.477 1.00 0.00 O ATOM 2157 CB GLU A 143 -16.734 -12.869 -9.355 1.00 0.00 C ATOM 2158 CG GLU A 143 -17.376 -14.157 -8.865 1.00 0.00 C ATOM 2159 CD GLU A 143 -18.853 -13.999 -8.577 1.00 0.00 C ATOM 2160 OE1 GLU A 143 -19.666 -14.203 -9.504 1.00 0.00 O ATOM 2161 OE2 GLU A 143 -19.210 -13.678 -7.426 1.00 0.00 O ATOM 0 H GLU A 143 -14.386 -12.875 -7.913 1.00 0.00 H new ATOM 0 HA GLU A 143 -15.246 -13.771 -10.605 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -16.778 -12.126 -8.559 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -17.317 -12.477 -10.189 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -17.237 -14.936 -9.615 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -16.867 -14.491 -7.961 1.00 0.00 H new ATOM 2168 N ALA A 144 -14.041 -10.990 -9.437 1.00 0.00 N ATOM 2169 CA ALA A 144 -13.511 -9.675 -9.764 1.00 0.00 C ATOM 2170 C ALA A 144 -12.158 -9.781 -10.460 1.00 0.00 C ATOM 2171 O ALA A 144 -11.399 -10.725 -10.223 1.00 0.00 O ATOM 2172 CB ALA A 144 -13.389 -8.836 -8.497 1.00 0.00 C ATOM 0 H ALA A 144 -13.832 -11.302 -8.489 1.00 0.00 H new ATOM 0 HA ALA A 144 -14.203 -9.190 -10.452 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -12.992 -7.853 -8.749 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -14.372 -8.724 -8.039 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -12.716 -9.331 -7.796 1.00 0.00 H new ATOM 2178 N PRO A 145 -11.858 -8.826 -11.355 1.00 0.00 N ATOM 2179 CA PRO A 145 -10.557 -8.745 -12.023 1.00 0.00 C ATOM 2180 C PRO A 145 -9.407 -8.634 -11.026 1.00 0.00 C ATOM 2181 O PRO A 145 -9.529 -7.973 -9.985 1.00 0.00 O ATOM 2182 CB PRO A 145 -10.652 -7.472 -12.868 1.00 0.00 C ATOM 2183 CG PRO A 145 -12.110 -7.221 -13.036 1.00 0.00 C ATOM 2184 CD PRO A 145 -12.778 -7.768 -11.806 1.00 0.00 C ATOM 0 HA PRO A 145 -10.350 -9.640 -12.610 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -10.163 -6.633 -12.372 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -10.161 -7.602 -13.833 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -12.311 -6.155 -13.146 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -12.488 -7.711 -13.934 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -12.909 -6.999 -11.045 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -13.768 -8.166 -12.030 1.00 0.00 H new ATOM 2192 N LEU A 146 -8.300 -9.292 -11.344 1.00 0.00 N ATOM 2193 CA LEU A 146 -7.133 -9.289 -10.478 1.00 0.00 C ATOM 2194 C LEU A 146 -6.473 -7.913 -10.483 1.00 0.00 C ATOM 2195 O LEU A 146 -6.585 -7.155 -9.518 1.00 0.00 O ATOM 2196 CB LEU A 146 -6.133 -10.356 -10.939 1.00 0.00 C ATOM 2197 CG LEU A 146 -6.703 -11.769 -11.083 1.00 0.00 C ATOM 2198 CD1 LEU A 146 -5.634 -12.731 -11.579 1.00 0.00 C ATOM 2199 CD2 LEU A 146 -7.283 -12.254 -9.762 1.00 0.00 C ATOM 0 H LEU A 146 -8.188 -9.836 -12.199 1.00 0.00 H new ATOM 0 HA LEU A 146 -7.451 -9.519 -9.461 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -5.718 -10.050 -11.899 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -5.306 -10.386 -10.229 1.00 0.00 H new ATOM 0 HG LEU A 146 -7.506 -11.737 -11.819 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -6.060 -13.730 -11.675 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -5.267 -12.398 -12.550 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -4.808 -12.755 -10.868 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -7.683 -13.260 -9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -6.500 -12.266 -9.004 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -8.082 -11.583 -9.447 1.00 0.00 H new ATOM 2211 N GLU A 147 -5.791 -7.607 -11.575 1.00 0.00 N ATOM 2212 CA GLU A 147 -5.180 -6.312 -11.777 1.00 0.00 C ATOM 2213 C GLU A 147 -6.098 -5.461 -12.653 1.00 0.00 C ATOM 2214 O GLU A 147 -6.870 -6.011 -13.440 1.00 0.00 O ATOM 2215 CB GLU A 147 -3.820 -6.534 -12.447 1.00 0.00 C ATOM 2216 CG GLU A 147 -2.835 -5.392 -12.311 1.00 0.00 C ATOM 2217 CD GLU A 147 -3.072 -4.264 -13.295 1.00 0.00 C ATOM 2218 OE1 GLU A 147 -2.927 -4.492 -14.517 1.00 0.00 O ATOM 2219 OE2 GLU A 147 -3.401 -3.144 -12.857 1.00 0.00 O ATOM 0 H GLU A 147 -5.647 -8.257 -12.348 1.00 0.00 H new ATOM 0 HA GLU A 147 -5.033 -5.788 -10.833 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -3.369 -7.433 -12.026 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -3.983 -6.726 -13.507 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -2.889 -4.996 -11.297 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -1.825 -5.777 -12.449 1.00 0.00 H new ATOM 2226 N HIS A 148 -6.013 -4.138 -12.502 1.00 0.00 N ATOM 2227 CA HIS A 148 -6.805 -3.191 -13.299 1.00 0.00 C ATOM 2228 C HIS A 148 -8.271 -3.172 -12.881 1.00 0.00 C ATOM 2229 O HIS A 148 -8.982 -4.170 -12.985 1.00 0.00 O ATOM 2230 CB HIS A 148 -6.697 -3.490 -14.799 1.00 0.00 C ATOM 2231 CG HIS A 148 -5.832 -2.521 -15.546 1.00 0.00 C ATOM 2232 ND1 HIS A 148 -4.463 -2.639 -15.635 1.00 0.00 N ATOM 2233 CD2 HIS A 148 -6.156 -1.410 -16.250 1.00 0.00 C ATOM 2234 CE1 HIS A 148 -3.983 -1.645 -16.357 1.00 0.00 C ATOM 2235 NE2 HIS A 148 -4.989 -0.883 -16.743 1.00 0.00 N ATOM 0 H HIS A 148 -5.395 -3.690 -11.825 1.00 0.00 H new ATOM 0 HA HIS A 148 -6.385 -2.204 -13.106 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -6.299 -4.496 -14.932 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -7.696 -3.482 -15.235 1.00 0.00 H new ATOM 0 HD1 HIS A 148 -3.907 -3.380 -15.209 1.00 0.00 H new ATOM 0 HD2 HIS A 148 -7.149 -1.012 -16.396 1.00 0.00 H new ATOM 0 HE1 HIS A 148 -2.942 -1.482 -16.593 1.00 0.00 H new ATOM 2244 N HIS A 149 -8.726 -2.013 -12.416 1.00 0.00 N ATOM 2245 CA HIS A 149 -10.130 -1.840 -12.060 1.00 0.00 C ATOM 2246 C HIS A 149 -10.931 -1.453 -13.302 1.00 0.00 C ATOM 2247 O HIS A 149 -12.159 -1.439 -13.288 1.00 0.00 O ATOM 2248 CB HIS A 149 -10.286 -0.778 -10.965 1.00 0.00 C ATOM 2249 CG HIS A 149 -11.650 -0.753 -10.337 1.00 0.00 C ATOM 2250 ND1 HIS A 149 -12.469 0.356 -10.346 1.00 0.00 N ATOM 2251 CD2 HIS A 149 -12.328 -1.713 -9.665 1.00 0.00 C ATOM 2252 CE1 HIS A 149 -13.591 0.075 -9.708 1.00 0.00 C ATOM 2253 NE2 HIS A 149 -13.526 -1.171 -9.284 1.00 0.00 N ATOM 0 H HIS A 149 -8.147 -1.184 -12.277 1.00 0.00 H new ATOM 0 HA HIS A 149 -10.513 -2.783 -11.669 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -9.542 -0.957 -10.189 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -10.073 0.203 -11.390 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -11.987 -2.718 -9.467 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -14.420 0.751 -9.559 1.00 0.00 H new ATOM 0 HE2 HIS A 149 -14.253 -1.655 -8.756 1.00 0.00 H new ATOM 2262 N HIS A 150 -10.215 -1.134 -14.372 1.00 0.00 N ATOM 2263 CA HIS A 150 -10.833 -0.815 -15.654 1.00 0.00 C ATOM 2264 C HIS A 150 -10.429 -1.876 -16.674 1.00 0.00 C ATOM 2265 O HIS A 150 -9.307 -2.377 -16.635 1.00 0.00 O ATOM 2266 CB HIS A 150 -10.415 0.585 -16.142 1.00 0.00 C ATOM 2267 CG HIS A 150 -10.937 1.716 -15.296 1.00 0.00 C ATOM 2268 ND1 HIS A 150 -10.700 3.045 -15.580 1.00 0.00 N ATOM 2269 CD2 HIS A 150 -11.680 1.710 -14.163 1.00 0.00 C ATOM 2270 CE1 HIS A 150 -11.272 3.800 -14.658 1.00 0.00 C ATOM 2271 NE2 HIS A 150 -11.872 3.014 -13.787 1.00 0.00 N ATOM 0 H HIS A 150 -9.196 -1.089 -14.377 1.00 0.00 H new ATOM 0 HA HIS A 150 -11.916 -0.809 -15.534 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -9.327 0.638 -16.168 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -10.765 0.720 -17.165 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -12.053 0.836 -13.649 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -11.251 4.879 -14.624 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -12.394 3.325 -12.968 1.00 0.00 H new ATOM 2280 N HIS A 151 -11.333 -2.210 -17.588 1.00 0.00 N ATOM 2281 CA HIS A 151 -11.117 -3.329 -18.510 1.00 0.00 C ATOM 2282 C HIS A 151 -10.364 -2.918 -19.772 1.00 0.00 C ATOM 2283 O HIS A 151 -10.322 -3.670 -20.746 1.00 0.00 O ATOM 2284 CB HIS A 151 -12.446 -3.977 -18.896 1.00 0.00 C ATOM 2285 CG HIS A 151 -12.882 -5.056 -17.952 1.00 0.00 C ATOM 2286 ND1 HIS A 151 -14.144 -5.118 -17.405 1.00 0.00 N ATOM 2287 CD2 HIS A 151 -12.217 -6.136 -17.482 1.00 0.00 C ATOM 2288 CE1 HIS A 151 -14.237 -6.192 -16.640 1.00 0.00 C ATOM 2289 NE2 HIS A 151 -13.080 -6.828 -16.672 1.00 0.00 N ATOM 0 H HIS A 151 -12.222 -1.726 -17.714 1.00 0.00 H new ATOM 0 HA HIS A 151 -10.497 -4.050 -17.976 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -13.217 -3.208 -18.937 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -12.359 -4.396 -19.899 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -11.195 -6.404 -17.704 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -15.111 -6.497 -16.083 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -12.864 -7.692 -16.175 1.00 0.00 H new ATOM 2298 N HIS A 152 -9.764 -1.741 -19.757 1.00 0.00 N ATOM 2299 CA HIS A 152 -8.930 -1.307 -20.871 1.00 0.00 C ATOM 2300 C HIS A 152 -7.687 -0.614 -20.346 1.00 0.00 C ATOM 2301 O HIS A 152 -7.646 -0.199 -19.187 1.00 0.00 O ATOM 2302 CB HIS A 152 -9.691 -0.375 -21.831 1.00 0.00 C ATOM 2303 CG HIS A 152 -10.044 0.963 -21.257 1.00 0.00 C ATOM 2304 ND1 HIS A 152 -9.188 2.045 -21.275 1.00 0.00 N ATOM 2305 CD2 HIS A 152 -11.181 1.395 -20.671 1.00 0.00 C ATOM 2306 CE1 HIS A 152 -9.786 3.083 -20.722 1.00 0.00 C ATOM 2307 NE2 HIS A 152 -11.000 2.716 -20.345 1.00 0.00 N ATOM 0 H HIS A 152 -9.836 -1.070 -18.992 1.00 0.00 H new ATOM 0 HA HIS A 152 -8.643 -2.194 -21.436 1.00 0.00 H new ATOM 0 HB2 HIS A 152 -9.085 -0.223 -22.724 1.00 0.00 H new ATOM 0 HB3 HIS A 152 -10.608 -0.872 -22.148 1.00 0.00 H new ATOM 0 HD1 HIS A 152 -8.242 2.043 -21.656 1.00 0.00 H new ATOM 0 HD2 HIS A 152 -12.070 0.809 -20.492 1.00 0.00 H new ATOM 0 HE1 HIS A 152 -9.357 4.066 -20.598 1.00 0.00 H new ATOM 2316 N HIS A 153 -6.681 -0.498 -21.191 1.00 0.00 N ATOM 2317 CA HIS A 153 -5.453 0.179 -20.811 1.00 0.00 C ATOM 2318 C HIS A 153 -5.343 1.506 -21.557 1.00 0.00 C ATOM 2319 O HIS A 153 -4.270 1.806 -22.111 1.00 0.00 O ATOM 2320 CB HIS A 153 -4.230 -0.715 -21.082 1.00 0.00 C ATOM 2321 CG HIS A 153 -4.029 -1.071 -22.529 1.00 0.00 C ATOM 2322 ND1 HIS A 153 -3.062 -0.488 -23.313 1.00 0.00 N ATOM 2323 CD2 HIS A 153 -4.677 -1.950 -23.330 1.00 0.00 C ATOM 2324 CE1 HIS A 153 -3.123 -0.986 -24.531 1.00 0.00 C ATOM 2325 NE2 HIS A 153 -4.095 -1.878 -24.571 1.00 0.00 N ATOM 2326 OXT HIS A 153 -6.357 2.238 -21.600 1.00 0.00 O ATOM 0 H HIS A 153 -6.688 -0.862 -22.144 1.00 0.00 H new ATOM 0 HA HIS A 153 -5.478 0.384 -19.741 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -3.337 -0.208 -20.718 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -4.332 -1.634 -20.505 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -5.499 -2.589 -23.045 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -2.485 -0.711 -25.358 1.00 0.00 H new ATOM 0 HE2 HIS A 153 -4.368 -2.423 -25.388 1.00 0.00 H new TER 2335 HIS A 153