USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1104 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 10 MET CE :methyl -111:sc= -0.768 (180deg=-0.767) USER MOD Set 1.2: A 51 HIS : no HD1:sc= -0.595 K(o=-1.4,f=-3.1) USER MOD Set 2.1: A 17 ASN : amide:sc= -0.14 X(o=-0.14,f=-0.21) USER MOD Set 2.2: A 55 SER OG : rot 140:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.133 X(o=-0.13,f=-0.35) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -160:sc= -8.21! (180deg=-8.91!) USER MOD Single : A 35 MET CE :methyl -129:sc= -1.22 (180deg=-2.57!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.301 X(o=-0.3,f=0) USER MOD Single : A 39 THR OG1 : rot 78:sc= -1.23 USER MOD Single : A 40 LYS NZ :NH3+ 156:sc= -0.156 (180deg=-0.689) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 153:sc= -2.97! (180deg=-4.26!) USER MOD Single : A 49 TYR OH : rot 30:sc= -0.0207 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 58 LYS NZ :NH3+ -161:sc= -0.0191 (180deg=-0.255) USER MOD Single : A 61 GLN : amide:sc= -0.757 K(o=-0.76,f=-1.5!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot -37:sc= 0.465 USER MOD Single : A 64 LYS NZ :NH3+ 144:sc= -0.275 (180deg=-0.941) USER MOD Single : A 67 TYR OH : rot 180:sc= -0.0523 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 1.82 (180deg=1.82) USER MOD Single : A 73 TYR OH : rot -130:sc= -2.4! USER MOD Single : A 77 SER OG : rot 78:sc= 0.395 USER MOD Single : A 81 GLN :FLIP amide:sc= -0.92 F(o=-2.2,f=-0.92) USER MOD Single : A 82 SER OG : rot 119:sc= 0.547 USER MOD Single : A 84 HIS :FLIP no HD1:sc= -0.189 F(o=-0.93,f=-0.19) USER MOD Single : A 85 GLN :FLIP amide:sc= -2.87! C(o=-4.5!,f=-2.9!) USER MOD Single : A 98 SER OG : rot -37:sc= 0.519 USER MOD Single : A 99 ASN : amide:sc= -0.387 K(o=-0.39,f=-1.2) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 150:sc= -0.839 USER MOD Single : A 106 GLN : amide:sc= 0.337 K(o=0.34,f=-1.3!) USER MOD Single : A 107 ASN : amide:sc= -1.93! K(o=-1.9!,f=-2.6) USER MOD Single : A 109 TYR OH : rot -151:sc= 0.975 USER MOD Single : A 111 CYS SG : rot 180:sc= -1.45 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 1.23 K(o=1.2,f=-0.01) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 ASN : amide:sc= -0.199 X(o=-0.2,f=0) USER MOD Single : A 130 ASN : amide:sc= -0.448 X(o=-0.45,f=-0.45) USER MOD Single : A 133 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.492) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0.285 K(o=0.29,f=-0.3) USER MOD Single : A 143 MET CE :methyl -161:sc= -3.59 (180deg=-5.55) USER MOD ----------------------------------------------------------------- ATOM 92 N MET A 10 -16.708 11.792 2.298 1.00 0.00 N ATOM 93 CA MET A 10 -15.431 11.149 2.009 1.00 0.00 C ATOM 94 C MET A 10 -15.635 9.876 1.195 1.00 0.00 C ATOM 95 O MET A 10 -14.849 8.934 1.294 1.00 0.00 O ATOM 96 CB MET A 10 -14.693 10.825 3.310 1.00 0.00 C ATOM 97 CG MET A 10 -14.257 12.058 4.085 1.00 0.00 C ATOM 98 SD MET A 10 -13.287 11.650 5.549 1.00 0.00 S ATOM 99 CE MET A 10 -11.776 11.050 4.797 1.00 0.00 C ATOM 0 HA MET A 10 -14.829 11.841 1.421 1.00 0.00 H new ATOM 0 HB2 MET A 10 -15.340 10.218 3.943 1.00 0.00 H new ATOM 0 HB3 MET A 10 -13.815 10.222 3.079 1.00 0.00 H new ATOM 0 HG2 MET A 10 -13.669 12.704 3.433 1.00 0.00 H new ATOM 0 HG3 MET A 10 -15.139 12.625 4.384 1.00 0.00 H new ATOM 0 HE1 MET A 10 -11.686 9.977 4.968 1.00 0.00 H new ATOM 0 HE2 MET A 10 -11.800 11.246 3.725 1.00 0.00 H new ATOM 0 HE3 MET A 10 -10.921 11.561 5.240 1.00 0.00 H new ATOM 109 N GLU A 11 -16.694 9.855 0.392 1.00 0.00 N ATOM 110 CA GLU A 11 -17.000 8.695 -0.438 1.00 0.00 C ATOM 111 C GLU A 11 -15.769 8.245 -1.219 1.00 0.00 C ATOM 112 O GLU A 11 -15.300 7.118 -1.063 1.00 0.00 O ATOM 113 CB GLU A 11 -18.141 9.019 -1.405 1.00 0.00 C ATOM 114 CG GLU A 11 -18.950 7.803 -1.821 1.00 0.00 C ATOM 115 CD GLU A 11 -20.137 7.552 -0.912 1.00 0.00 C ATOM 116 OE1 GLU A 11 -19.921 7.311 0.294 1.00 0.00 O ATOM 117 OE2 GLU A 11 -21.283 7.597 -1.407 1.00 0.00 O ATOM 0 H GLU A 11 -17.354 10.627 0.298 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.310 7.882 0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -18.806 9.745 -0.938 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -17.728 9.492 -2.296 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -19.303 7.939 -2.843 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -18.305 6.925 -1.820 1.00 0.00 H new ATOM 124 N ALA A 12 -15.251 9.134 -2.060 1.00 0.00 N ATOM 125 CA ALA A 12 -14.075 8.830 -2.864 1.00 0.00 C ATOM 126 C ALA A 12 -13.120 7.907 -2.114 1.00 0.00 C ATOM 127 O ALA A 12 -12.554 6.980 -2.692 1.00 0.00 O ATOM 128 CB ALA A 12 -13.364 10.113 -3.267 1.00 0.00 C ATOM 0 H ALA A 12 -15.628 10.071 -2.202 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.406 8.313 -3.765 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.487 9.870 -3.867 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.042 10.737 -3.850 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.053 10.653 -2.373 1.00 0.00 H new ATOM 134 N VAL A 13 -12.946 8.168 -0.822 1.00 0.00 N ATOM 135 CA VAL A 13 -12.060 7.361 0.008 1.00 0.00 C ATOM 136 C VAL A 13 -12.628 5.962 0.219 1.00 0.00 C ATOM 137 O VAL A 13 -12.070 4.974 -0.261 1.00 0.00 O ATOM 138 CB VAL A 13 -11.822 8.019 1.381 1.00 0.00 C ATOM 139 CG1 VAL A 13 -11.012 7.099 2.281 1.00 0.00 C ATOM 140 CG2 VAL A 13 -11.128 9.362 1.214 1.00 0.00 C ATOM 0 H VAL A 13 -13.407 8.932 -0.328 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.110 7.289 -0.521 1.00 0.00 H new ATOM 0 HB VAL A 13 -12.788 8.192 1.855 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -10.854 7.581 3.246 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -11.553 6.164 2.426 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.048 6.892 1.817 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.968 9.813 2.193 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.167 9.216 0.720 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.751 10.021 0.609 1.00 0.00 H new ATOM 150 N LYS A 14 -13.741 5.884 0.940 1.00 0.00 N ATOM 151 CA LYS A 14 -14.387 4.606 1.214 1.00 0.00 C ATOM 152 C LYS A 14 -14.309 3.685 0.000 1.00 0.00 C ATOM 153 O LYS A 14 -14.008 2.498 0.126 1.00 0.00 O ATOM 154 CB LYS A 14 -15.850 4.825 1.608 1.00 0.00 C ATOM 155 CG LYS A 14 -16.024 5.709 2.831 1.00 0.00 C ATOM 156 CD LYS A 14 -17.433 6.273 2.915 1.00 0.00 C ATOM 157 CE LYS A 14 -17.492 7.491 3.823 1.00 0.00 C ATOM 158 NZ LYS A 14 -17.378 7.118 5.260 1.00 0.00 N ATOM 0 H LYS A 14 -14.215 6.691 1.345 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.861 4.132 2.042 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -16.381 5.273 0.768 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.315 3.858 1.800 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -15.807 5.134 3.731 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.305 6.527 2.795 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -17.777 6.545 1.917 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -18.111 5.506 3.289 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.687 8.178 3.561 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.430 8.021 3.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -17.423 7.976 5.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.160 6.482 5.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -16.472 6.635 5.422 1.00 0.00 H new ATOM 172 N THR A 15 -14.582 4.240 -1.176 1.00 0.00 N ATOM 173 CA THR A 15 -14.542 3.470 -2.413 1.00 0.00 C ATOM 174 C THR A 15 -13.170 2.841 -2.625 1.00 0.00 C ATOM 175 O THR A 15 -13.061 1.653 -2.931 1.00 0.00 O ATOM 176 CB THR A 15 -14.887 4.345 -3.632 1.00 0.00 C ATOM 177 OG1 THR A 15 -16.210 4.877 -3.495 1.00 0.00 O ATOM 178 CG2 THR A 15 -14.789 3.542 -4.920 1.00 0.00 C ATOM 0 H THR A 15 -14.833 5.221 -1.298 1.00 0.00 H new ATOM 0 HA THR A 15 -15.289 2.682 -2.318 1.00 0.00 H new ATOM 0 HB THR A 15 -14.169 5.164 -3.678 1.00 0.00 H new ATOM 0 HG1 THR A 15 -16.421 5.434 -4.273 1.00 0.00 H new ATOM 0 HG21 THR A 15 -15.037 4.181 -5.767 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.774 3.163 -5.036 1.00 0.00 H new ATOM 0 HG23 THR A 15 -15.486 2.705 -4.881 1.00 0.00 H new ATOM 186 N PHE A 16 -12.124 3.644 -2.460 1.00 0.00 N ATOM 187 CA PHE A 16 -10.758 3.166 -2.634 1.00 0.00 C ATOM 188 C PHE A 16 -10.386 2.173 -1.536 1.00 0.00 C ATOM 189 O PHE A 16 -9.701 1.182 -1.788 1.00 0.00 O ATOM 190 CB PHE A 16 -9.779 4.341 -2.627 1.00 0.00 C ATOM 191 CG PHE A 16 -8.340 3.922 -2.523 1.00 0.00 C ATOM 192 CD1 PHE A 16 -7.760 3.687 -1.287 1.00 0.00 C ATOM 193 CD2 PHE A 16 -7.567 3.765 -3.662 1.00 0.00 C ATOM 194 CE1 PHE A 16 -6.437 3.301 -1.188 1.00 0.00 C ATOM 195 CE2 PHE A 16 -6.243 3.379 -3.570 1.00 0.00 C ATOM 196 CZ PHE A 16 -5.677 3.148 -2.331 1.00 0.00 C ATOM 0 H PHE A 16 -12.197 4.629 -2.206 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.697 2.657 -3.596 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.915 4.922 -3.539 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -10.019 4.998 -1.791 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -8.349 3.807 -0.390 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -8.004 3.946 -4.633 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.998 3.119 -0.218 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.652 3.258 -4.466 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.642 2.848 -2.256 1.00 0.00 H new ATOM 206 N ASN A 17 -10.841 2.447 -0.319 1.00 0.00 N ATOM 207 CA ASN A 17 -10.556 1.579 0.818 1.00 0.00 C ATOM 208 C ASN A 17 -11.015 0.151 0.541 1.00 0.00 C ATOM 209 O ASN A 17 -10.521 -0.799 1.147 1.00 0.00 O ATOM 210 CB ASN A 17 -11.241 2.112 2.078 1.00 0.00 C ATOM 211 CG ASN A 17 -10.356 3.062 2.860 1.00 0.00 C ATOM 212 OD1 ASN A 17 -10.102 2.857 4.047 1.00 0.00 O ATOM 213 ND2 ASN A 17 -9.882 4.111 2.197 1.00 0.00 N ATOM 0 H ASN A 17 -11.409 3.264 -0.094 1.00 0.00 H new ATOM 0 HA ASN A 17 -9.477 1.571 0.975 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -12.161 2.625 1.798 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -11.524 1.275 2.716 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.282 4.786 2.672 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -10.118 4.242 1.213 1.00 0.00 H new ATOM 220 N SER A 18 -11.962 0.008 -0.380 1.00 0.00 N ATOM 221 CA SER A 18 -12.491 -1.304 -0.736 1.00 0.00 C ATOM 222 C SER A 18 -11.611 -1.977 -1.785 1.00 0.00 C ATOM 223 O SER A 18 -11.282 -3.157 -1.669 1.00 0.00 O ATOM 224 CB SER A 18 -13.922 -1.175 -1.261 1.00 0.00 C ATOM 225 OG SER A 18 -14.457 -2.443 -1.599 1.00 0.00 O ATOM 0 H SER A 18 -12.379 0.784 -0.894 1.00 0.00 H new ATOM 0 HA SER A 18 -12.496 -1.923 0.161 1.00 0.00 H new ATOM 0 HB2 SER A 18 -14.549 -0.702 -0.505 1.00 0.00 H new ATOM 0 HB3 SER A 18 -13.934 -0.526 -2.137 1.00 0.00 H new ATOM 0 HG SER A 18 -15.373 -2.334 -1.930 1.00 0.00 H new ATOM 231 N GLU A 19 -11.235 -1.217 -2.809 1.00 0.00 N ATOM 232 CA GLU A 19 -10.395 -1.741 -3.880 1.00 0.00 C ATOM 233 C GLU A 19 -9.006 -2.097 -3.356 1.00 0.00 C ATOM 234 O GLU A 19 -8.455 -3.147 -3.690 1.00 0.00 O ATOM 235 CB GLU A 19 -10.278 -0.719 -5.013 1.00 0.00 C ATOM 236 CG GLU A 19 -11.613 -0.139 -5.448 1.00 0.00 C ATOM 237 CD GLU A 19 -12.467 -1.140 -6.200 1.00 0.00 C ATOM 238 OE1 GLU A 19 -11.895 -1.979 -6.928 1.00 0.00 O ATOM 239 OE2 GLU A 19 -13.707 -1.086 -6.062 1.00 0.00 O ATOM 0 H GLU A 19 -11.498 -0.238 -2.919 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.863 -2.647 -4.265 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.625 0.093 -4.693 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -9.800 -1.193 -5.871 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -12.157 0.210 -4.570 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -11.438 0.731 -6.081 1.00 0.00 H new ATOM 246 N LEU A 20 -8.446 -1.216 -2.535 1.00 0.00 N ATOM 247 CA LEU A 20 -7.121 -1.435 -1.965 1.00 0.00 C ATOM 248 C LEU A 20 -7.017 -2.828 -1.351 1.00 0.00 C ATOM 249 O LEU A 20 -6.145 -3.615 -1.717 1.00 0.00 O ATOM 250 CB LEU A 20 -6.818 -0.374 -0.906 1.00 0.00 C ATOM 251 CG LEU A 20 -5.365 -0.290 -0.438 1.00 0.00 C ATOM 252 CD1 LEU A 20 -5.072 -1.370 0.592 1.00 0.00 C ATOM 253 CD2 LEU A 20 -4.415 -0.407 -1.621 1.00 0.00 C ATOM 0 H LEU A 20 -8.889 -0.343 -2.249 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.389 -1.356 -2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -7.108 0.599 -1.302 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -7.448 -0.566 -0.038 1.00 0.00 H new ATOM 0 HG LEU A 20 -5.211 0.682 0.031 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -4.033 -1.294 0.913 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -5.728 -1.240 1.452 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.244 -2.351 0.150 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -3.385 -0.345 -1.268 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -4.571 -1.364 -2.120 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -4.607 0.404 -2.324 1.00 0.00 H new ATOM 265 N TYR A 21 -7.913 -3.124 -0.416 1.00 0.00 N ATOM 266 CA TYR A 21 -7.922 -4.422 0.250 1.00 0.00 C ATOM 267 C TYR A 21 -8.452 -5.508 -0.681 1.00 0.00 C ATOM 268 O TYR A 21 -8.110 -6.682 -0.541 1.00 0.00 O ATOM 269 CB TYR A 21 -8.773 -4.361 1.519 1.00 0.00 C ATOM 270 CG TYR A 21 -8.099 -3.645 2.667 1.00 0.00 C ATOM 271 CD1 TYR A 21 -7.917 -2.268 2.641 1.00 0.00 C ATOM 272 CD2 TYR A 21 -7.642 -4.345 3.777 1.00 0.00 C ATOM 273 CE1 TYR A 21 -7.300 -1.609 3.688 1.00 0.00 C ATOM 274 CE2 TYR A 21 -7.027 -3.694 4.829 1.00 0.00 C ATOM 275 CZ TYR A 21 -6.858 -2.326 4.779 1.00 0.00 C ATOM 276 OH TYR A 21 -6.243 -1.675 5.824 1.00 0.00 O ATOM 0 H TYR A 21 -8.642 -2.484 -0.102 1.00 0.00 H new ATOM 0 HA TYR A 21 -6.896 -4.671 0.521 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -9.714 -3.860 1.292 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -9.020 -5.376 1.830 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.263 -1.703 1.788 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -7.770 -5.417 3.818 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -7.165 -0.538 3.651 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.681 -4.253 5.686 1.00 0.00 H new ATOM 0 HH TYR A 21 -5.993 -2.326 6.513 1.00 0.00 H new ATOM 286 N SER A 22 -9.289 -5.106 -1.632 1.00 0.00 N ATOM 287 CA SER A 22 -9.871 -6.044 -2.585 1.00 0.00 C ATOM 288 C SER A 22 -8.810 -7.001 -3.122 1.00 0.00 C ATOM 289 O SER A 22 -9.126 -8.088 -3.607 1.00 0.00 O ATOM 290 CB SER A 22 -10.525 -5.288 -3.743 1.00 0.00 C ATOM 291 OG SER A 22 -11.240 -6.172 -4.589 1.00 0.00 O ATOM 0 H SER A 22 -9.579 -4.137 -1.763 1.00 0.00 H new ATOM 0 HA SER A 22 -10.632 -6.627 -2.065 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.201 -4.529 -3.350 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.761 -4.767 -4.319 1.00 0.00 H new ATOM 0 HG SER A 22 -11.650 -5.665 -5.321 1.00 0.00 H new ATOM 297 N LEU A 23 -7.550 -6.588 -3.031 1.00 0.00 N ATOM 298 CA LEU A 23 -6.441 -7.407 -3.507 1.00 0.00 C ATOM 299 C LEU A 23 -6.537 -8.827 -2.958 1.00 0.00 C ATOM 300 O LEU A 23 -6.173 -9.790 -3.632 1.00 0.00 O ATOM 301 CB LEU A 23 -5.107 -6.780 -3.099 1.00 0.00 C ATOM 302 CG LEU A 23 -4.609 -5.632 -3.978 1.00 0.00 C ATOM 303 CD1 LEU A 23 -3.287 -5.093 -3.453 1.00 0.00 C ATOM 304 CD2 LEU A 23 -4.465 -6.089 -5.422 1.00 0.00 C ATOM 0 H LEU A 23 -7.272 -5.691 -2.632 1.00 0.00 H new ATOM 0 HA LEU A 23 -6.497 -7.453 -4.595 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.198 -6.415 -2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.348 -7.562 -3.092 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.345 -4.829 -3.944 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.948 -4.277 -4.091 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.422 -4.726 -2.435 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.543 -5.889 -3.456 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.110 -5.259 -6.033 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.750 -6.910 -5.474 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.432 -6.426 -5.795 1.00 0.00 H new ATOM 316 N ASN A 24 -7.032 -8.949 -1.730 1.00 0.00 N ATOM 317 CA ASN A 24 -7.178 -10.252 -1.091 1.00 0.00 C ATOM 318 C ASN A 24 -7.866 -11.242 -2.026 1.00 0.00 C ATOM 319 O ASN A 24 -7.604 -12.444 -1.974 1.00 0.00 O ATOM 320 CB ASN A 24 -7.977 -10.119 0.207 1.00 0.00 C ATOM 321 CG ASN A 24 -7.368 -9.110 1.161 1.00 0.00 C ATOM 322 OD1 ASN A 24 -6.147 -9.018 1.288 1.00 0.00 O ATOM 323 ND2 ASN A 24 -8.218 -8.347 1.837 1.00 0.00 N ATOM 0 H ASN A 24 -7.338 -8.162 -1.158 1.00 0.00 H new ATOM 0 HA ASN A 24 -6.182 -10.630 -0.860 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.999 -9.822 -0.028 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -8.032 -11.091 0.697 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -7.867 -7.650 2.493 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -9.223 -8.458 1.700 1.00 0.00 H new ATOM 330 N ASP A 25 -8.745 -10.729 -2.879 1.00 0.00 N ATOM 331 CA ASP A 25 -9.469 -11.568 -3.827 1.00 0.00 C ATOM 332 C ASP A 25 -8.534 -12.092 -4.913 1.00 0.00 C ATOM 333 O ASP A 25 -8.709 -13.204 -5.413 1.00 0.00 O ATOM 334 CB ASP A 25 -10.618 -10.783 -4.462 1.00 0.00 C ATOM 335 CG ASP A 25 -11.669 -11.688 -5.074 1.00 0.00 C ATOM 336 OD1 ASP A 25 -11.356 -12.868 -5.335 1.00 0.00 O ATOM 337 OD2 ASP A 25 -12.805 -11.215 -5.292 1.00 0.00 O ATOM 0 H ASP A 25 -8.974 -9.736 -2.934 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.878 -12.419 -3.282 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -11.083 -10.150 -3.706 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -10.220 -10.121 -5.231 1.00 0.00 H new ATOM 342 N TYR A 26 -7.543 -11.285 -5.274 1.00 0.00 N ATOM 343 CA TYR A 26 -6.583 -11.665 -6.303 1.00 0.00 C ATOM 344 C TYR A 26 -5.189 -11.842 -5.710 1.00 0.00 C ATOM 345 O TYR A 26 -4.648 -10.931 -5.082 1.00 0.00 O ATOM 346 CB TYR A 26 -6.548 -10.612 -7.412 1.00 0.00 C ATOM 347 CG TYR A 26 -7.880 -9.938 -7.649 1.00 0.00 C ATOM 348 CD1 TYR A 26 -8.395 -9.030 -6.732 1.00 0.00 C ATOM 349 CD2 TYR A 26 -8.624 -10.207 -8.792 1.00 0.00 C ATOM 350 CE1 TYR A 26 -9.612 -8.412 -6.944 1.00 0.00 C ATOM 351 CE2 TYR A 26 -9.841 -9.593 -9.013 1.00 0.00 C ATOM 352 CZ TYR A 26 -10.331 -8.696 -8.086 1.00 0.00 C ATOM 353 OH TYR A 26 -11.543 -8.082 -8.302 1.00 0.00 O ATOM 0 H TYR A 26 -7.383 -10.363 -4.869 1.00 0.00 H new ATOM 0 HA TYR A 26 -6.901 -12.618 -6.726 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.807 -9.854 -7.159 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.219 -11.083 -8.338 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -7.834 -8.803 -5.838 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.244 -10.908 -9.520 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.998 -7.710 -6.220 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -10.406 -9.814 -9.906 1.00 0.00 H new ATOM 0 HH TYR A 26 -11.919 -8.391 -9.153 1.00 0.00 H new ATOM 363 N LYS A 27 -4.612 -13.021 -5.913 1.00 0.00 N ATOM 364 CA LYS A 27 -3.280 -13.320 -5.401 1.00 0.00 C ATOM 365 C LYS A 27 -2.217 -13.055 -6.462 1.00 0.00 C ATOM 366 O LYS A 27 -2.410 -13.321 -7.648 1.00 0.00 O ATOM 367 CB LYS A 27 -3.203 -14.777 -4.939 1.00 0.00 C ATOM 368 CG LYS A 27 -3.068 -15.770 -6.081 1.00 0.00 C ATOM 369 CD LYS A 27 -3.683 -17.114 -5.726 1.00 0.00 C ATOM 370 CE LYS A 27 -5.202 -17.066 -5.789 1.00 0.00 C ATOM 371 NZ LYS A 27 -5.705 -17.234 -7.181 1.00 0.00 N ATOM 0 H LYS A 27 -5.046 -13.786 -6.429 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.090 -12.665 -4.550 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -2.353 -14.892 -4.266 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -4.098 -15.015 -4.365 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -3.553 -15.370 -6.971 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -2.014 -15.904 -6.325 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.313 -17.877 -6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -3.368 -17.406 -4.724 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -5.617 -17.850 -5.156 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -5.552 -16.115 -5.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -6.744 -17.195 -7.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -5.330 -16.471 -7.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -5.392 -18.153 -7.555 1.00 0.00 H new ATOM 385 N PRO A 28 -1.066 -12.520 -6.027 1.00 0.00 N ATOM 386 CA PRO A 28 0.051 -12.210 -6.924 1.00 0.00 C ATOM 387 C PRO A 28 0.382 -13.367 -7.861 1.00 0.00 C ATOM 388 O PRO A 28 0.465 -14.525 -7.450 1.00 0.00 O ATOM 389 CB PRO A 28 1.215 -11.949 -5.965 1.00 0.00 C ATOM 390 CG PRO A 28 0.569 -11.503 -4.699 1.00 0.00 C ATOM 391 CD PRO A 28 -0.767 -12.177 -4.627 1.00 0.00 C ATOM 0 HA PRO A 28 -0.175 -11.370 -7.580 1.00 0.00 H new ATOM 0 HB2 PRO A 28 1.810 -12.849 -5.810 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.887 -11.186 -6.357 1.00 0.00 H new ATOM 0 HG2 PRO A 28 1.182 -11.770 -3.838 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.455 -10.419 -4.685 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.733 -13.065 -3.996 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.526 -11.517 -4.207 1.00 0.00 H new ATOM 399 N PRO A 29 0.576 -13.050 -9.149 1.00 0.00 N ATOM 400 CA PRO A 29 0.479 -11.675 -9.650 1.00 0.00 C ATOM 401 C PRO A 29 -0.953 -11.152 -9.635 1.00 0.00 C ATOM 402 O PRO A 29 -1.905 -11.927 -9.535 1.00 0.00 O ATOM 403 CB PRO A 29 0.994 -11.784 -11.087 1.00 0.00 C ATOM 404 CG PRO A 29 0.740 -13.200 -11.474 1.00 0.00 C ATOM 405 CD PRO A 29 0.904 -14.009 -10.218 1.00 0.00 C ATOM 0 HA PRO A 29 1.043 -10.976 -9.033 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.471 -11.093 -11.748 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.055 -11.541 -11.147 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -0.262 -13.318 -11.886 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.441 -13.526 -12.242 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.236 -14.870 -10.204 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.919 -14.392 -10.116 1.00 0.00 H new ATOM 413 N ILE A 30 -1.099 -9.836 -9.736 1.00 0.00 N ATOM 414 CA ILE A 30 -2.415 -9.211 -9.736 1.00 0.00 C ATOM 415 C ILE A 30 -2.838 -8.819 -11.148 1.00 0.00 C ATOM 416 O ILE A 30 -2.017 -8.382 -11.954 1.00 0.00 O ATOM 417 CB ILE A 30 -2.445 -7.960 -8.838 1.00 0.00 C ATOM 418 CG1 ILE A 30 -2.175 -8.344 -7.381 1.00 0.00 C ATOM 419 CG2 ILE A 30 -3.784 -7.248 -8.964 1.00 0.00 C ATOM 420 CD1 ILE A 30 -3.228 -9.257 -6.793 1.00 0.00 C ATOM 0 H ILE A 30 -0.321 -9.181 -9.819 1.00 0.00 H new ATOM 0 HA ILE A 30 -3.114 -9.949 -9.341 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.661 -7.278 -9.166 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.204 -8.834 -7.317 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.115 -7.437 -6.780 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.789 -6.366 -8.323 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.939 -6.945 -9.999 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -4.585 -7.922 -8.660 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.973 -9.488 -5.759 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.198 -8.761 -6.825 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.273 -10.180 -7.371 1.00 0.00 H new ATOM 432 N SER A 31 -4.125 -8.979 -11.439 1.00 0.00 N ATOM 433 CA SER A 31 -4.658 -8.644 -12.755 1.00 0.00 C ATOM 434 C SER A 31 -4.366 -7.188 -13.105 1.00 0.00 C ATOM 435 O SER A 31 -4.706 -6.275 -12.351 1.00 0.00 O ATOM 436 CB SER A 31 -6.166 -8.898 -12.798 1.00 0.00 C ATOM 437 OG SER A 31 -6.450 -10.286 -12.770 1.00 0.00 O ATOM 0 H SER A 31 -4.818 -9.338 -10.782 1.00 0.00 H new ATOM 0 HA SER A 31 -4.168 -9.282 -13.491 1.00 0.00 H new ATOM 0 HB2 SER A 31 -6.645 -8.408 -11.950 1.00 0.00 H new ATOM 0 HB3 SER A 31 -6.587 -8.456 -13.701 1.00 0.00 H new ATOM 0 HG SER A 31 -7.420 -10.422 -12.797 1.00 0.00 H new ATOM 443 N LYS A 32 -3.734 -6.977 -14.254 1.00 0.00 N ATOM 444 CA LYS A 32 -3.396 -5.633 -14.707 1.00 0.00 C ATOM 445 C LYS A 32 -4.591 -4.696 -14.569 1.00 0.00 C ATOM 446 O LYS A 32 -4.434 -3.514 -14.266 1.00 0.00 O ATOM 447 CB LYS A 32 -2.926 -5.666 -16.163 1.00 0.00 C ATOM 448 CG LYS A 32 -1.425 -5.851 -16.314 1.00 0.00 C ATOM 449 CD LYS A 32 -0.971 -7.193 -15.765 1.00 0.00 C ATOM 450 CE LYS A 32 0.463 -7.133 -15.261 1.00 0.00 C ATOM 451 NZ LYS A 32 1.439 -7.508 -16.322 1.00 0.00 N ATOM 0 H LYS A 32 -3.445 -7.721 -14.890 1.00 0.00 H new ATOM 0 HA LYS A 32 -2.588 -5.258 -14.079 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.438 -6.476 -16.683 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -3.220 -4.737 -16.652 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -1.152 -5.776 -17.367 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.904 -5.048 -15.792 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -1.631 -7.497 -14.952 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -1.053 -7.952 -16.543 1.00 0.00 H new ATOM 0 HE2 LYS A 32 0.681 -6.126 -14.906 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.577 -7.803 -14.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.405 -7.455 -15.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.247 -8.478 -16.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 1.348 -6.853 -17.125 1.00 0.00 H new ATOM 465 N ALA A 33 -5.787 -5.232 -14.794 1.00 0.00 N ATOM 466 CA ALA A 33 -7.009 -4.444 -14.691 1.00 0.00 C ATOM 467 C ALA A 33 -7.306 -4.079 -13.241 1.00 0.00 C ATOM 468 O ALA A 33 -7.898 -3.036 -12.960 1.00 0.00 O ATOM 469 CB ALA A 33 -8.179 -5.204 -15.297 1.00 0.00 C ATOM 0 H ALA A 33 -5.935 -6.209 -15.049 1.00 0.00 H new ATOM 0 HA ALA A 33 -6.864 -3.519 -15.248 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.085 -4.604 -15.213 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -7.975 -5.408 -16.348 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -8.317 -6.145 -14.764 1.00 0.00 H new ATOM 475 N LYS A 34 -6.893 -4.945 -12.321 1.00 0.00 N ATOM 476 CA LYS A 34 -7.115 -4.714 -10.898 1.00 0.00 C ATOM 477 C LYS A 34 -6.372 -3.468 -10.427 1.00 0.00 C ATOM 478 O LYS A 34 -6.981 -2.527 -9.918 1.00 0.00 O ATOM 479 CB LYS A 34 -6.660 -5.929 -10.087 1.00 0.00 C ATOM 480 CG LYS A 34 -6.653 -5.691 -8.586 1.00 0.00 C ATOM 481 CD LYS A 34 -8.064 -5.600 -8.030 1.00 0.00 C ATOM 482 CE LYS A 34 -8.117 -4.734 -6.781 1.00 0.00 C ATOM 483 NZ LYS A 34 -7.356 -5.341 -5.653 1.00 0.00 N ATOM 0 H LYS A 34 -6.403 -5.813 -12.536 1.00 0.00 H new ATOM 0 HA LYS A 34 -8.183 -4.559 -10.742 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.316 -6.770 -10.310 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -5.657 -6.213 -10.406 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.117 -6.501 -8.091 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.114 -4.770 -8.365 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.729 -5.187 -8.789 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.429 -6.600 -7.796 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.710 -3.748 -7.005 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -9.155 -4.590 -6.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -7.678 -4.928 -4.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.516 -6.368 -5.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.341 -5.151 -5.777 1.00 0.00 H new ATOM 497 N MET A 35 -5.055 -3.468 -10.602 1.00 0.00 N ATOM 498 CA MET A 35 -4.230 -2.335 -10.196 1.00 0.00 C ATOM 499 C MET A 35 -4.814 -1.025 -10.714 1.00 0.00 C ATOM 500 O MET A 35 -4.723 0.012 -10.055 1.00 0.00 O ATOM 501 CB MET A 35 -2.800 -2.508 -10.711 1.00 0.00 C ATOM 502 CG MET A 35 -2.129 -3.783 -10.226 1.00 0.00 C ATOM 503 SD MET A 35 -2.592 -4.211 -8.536 1.00 0.00 S ATOM 504 CE MET A 35 -0.980 -4.343 -7.767 1.00 0.00 C ATOM 0 H MET A 35 -4.536 -4.239 -11.022 1.00 0.00 H new ATOM 0 HA MET A 35 -4.215 -2.300 -9.107 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.812 -2.506 -11.801 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.204 -1.651 -10.397 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.395 -4.605 -10.891 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.047 -3.664 -10.283 1.00 0.00 H new ATOM 0 HE1 MET A 35 -0.907 -5.292 -7.236 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.206 -4.295 -8.533 1.00 0.00 H new ATOM 0 HE3 MET A 35 -0.845 -3.522 -7.063 1.00 0.00 H new ATOM 514 N THR A 36 -5.416 -1.077 -11.899 1.00 0.00 N ATOM 515 CA THR A 36 -6.013 0.106 -12.505 1.00 0.00 C ATOM 516 C THR A 36 -7.288 0.513 -11.776 1.00 0.00 C ATOM 517 O THR A 36 -7.530 1.697 -11.545 1.00 0.00 O ATOM 518 CB THR A 36 -6.339 -0.129 -13.993 1.00 0.00 C ATOM 519 OG1 THR A 36 -5.127 -0.262 -14.744 1.00 0.00 O ATOM 520 CG2 THR A 36 -7.166 1.018 -14.553 1.00 0.00 C ATOM 0 H THR A 36 -5.503 -1.926 -12.457 1.00 0.00 H new ATOM 0 HA THR A 36 -5.279 0.908 -12.423 1.00 0.00 H new ATOM 0 HB THR A 36 -6.920 -1.048 -14.075 1.00 0.00 H new ATOM 0 HG1 THR A 36 -5.342 -0.413 -15.688 1.00 0.00 H new ATOM 0 HG21 THR A 36 -7.384 0.830 -15.604 1.00 0.00 H new ATOM 0 HG22 THR A 36 -8.100 1.098 -13.997 1.00 0.00 H new ATOM 0 HG23 THR A 36 -6.607 1.949 -14.459 1.00 0.00 H new ATOM 528 N GLN A 37 -8.100 -0.476 -11.416 1.00 0.00 N ATOM 529 CA GLN A 37 -9.351 -0.219 -10.712 1.00 0.00 C ATOM 530 C GLN A 37 -9.098 0.534 -9.410 1.00 0.00 C ATOM 531 O GLN A 37 -9.853 1.438 -9.048 1.00 0.00 O ATOM 532 CB GLN A 37 -10.077 -1.534 -10.422 1.00 0.00 C ATOM 533 CG GLN A 37 -10.544 -2.260 -11.673 1.00 0.00 C ATOM 534 CD GLN A 37 -11.896 -1.776 -12.158 1.00 0.00 C ATOM 535 OE1 GLN A 37 -12.915 -2.435 -11.952 1.00 0.00 O ATOM 536 NE2 GLN A 37 -11.911 -0.618 -12.808 1.00 0.00 N ATOM 0 H GLN A 37 -7.914 -1.462 -11.600 1.00 0.00 H new ATOM 0 HA GLN A 37 -9.979 0.401 -11.353 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -9.413 -2.189 -9.858 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -10.939 -1.331 -9.787 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -9.808 -2.122 -12.465 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -10.597 -3.330 -11.469 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -11.042 -0.105 -12.956 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -12.792 -0.242 -13.159 1.00 0.00 H new ATOM 545 N ILE A 38 -8.034 0.156 -8.711 1.00 0.00 N ATOM 546 CA ILE A 38 -7.682 0.797 -7.450 1.00 0.00 C ATOM 547 C ILE A 38 -7.185 2.221 -7.676 1.00 0.00 C ATOM 548 O ILE A 38 -7.690 3.170 -7.075 1.00 0.00 O ATOM 549 CB ILE A 38 -6.600 0.002 -6.696 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.922 -1.494 -6.725 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.481 0.496 -5.262 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.989 -2.330 -5.878 1.00 0.00 C ATOM 0 H ILE A 38 -7.400 -0.591 -8.996 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.589 0.823 -6.846 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.643 0.158 -7.194 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.945 -1.644 -6.380 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.878 -1.847 -7.755 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.712 -0.076 -4.743 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.210 1.552 -5.262 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.436 0.367 -4.752 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -6.277 -3.379 -5.947 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.967 -2.210 -6.236 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -6.050 -2.004 -4.840 1.00 0.00 H new ATOM 564 N THR A 39 -6.193 2.364 -8.549 1.00 0.00 N ATOM 565 CA THR A 39 -5.628 3.672 -8.856 1.00 0.00 C ATOM 566 C THR A 39 -6.719 4.668 -9.230 1.00 0.00 C ATOM 567 O THR A 39 -6.660 5.839 -8.854 1.00 0.00 O ATOM 568 CB THR A 39 -4.609 3.587 -10.009 1.00 0.00 C ATOM 569 OG1 THR A 39 -3.537 2.707 -9.652 1.00 0.00 O ATOM 570 CG2 THR A 39 -4.053 4.963 -10.342 1.00 0.00 C ATOM 0 H THR A 39 -5.764 1.590 -9.056 1.00 0.00 H new ATOM 0 HA THR A 39 -5.119 4.016 -7.955 1.00 0.00 H new ATOM 0 HB THR A 39 -5.121 3.197 -10.889 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.831 1.777 -9.750 1.00 0.00 H new ATOM 0 HG21 THR A 39 -3.336 4.878 -11.159 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.868 5.622 -10.642 1.00 0.00 H new ATOM 0 HG23 THR A 39 -3.556 5.377 -9.465 1.00 0.00 H new ATOM 578 N LYS A 40 -7.715 4.197 -9.972 1.00 0.00 N ATOM 579 CA LYS A 40 -8.822 5.046 -10.395 1.00 0.00 C ATOM 580 C LYS A 40 -9.578 5.597 -9.190 1.00 0.00 C ATOM 581 O LYS A 40 -9.987 6.757 -9.179 1.00 0.00 O ATOM 582 CB LYS A 40 -9.779 4.260 -11.295 1.00 0.00 C ATOM 583 CG LYS A 40 -9.253 4.047 -12.703 1.00 0.00 C ATOM 584 CD LYS A 40 -9.801 2.769 -13.316 1.00 0.00 C ATOM 585 CE LYS A 40 -11.228 2.954 -13.808 1.00 0.00 C ATOM 586 NZ LYS A 40 -11.317 3.988 -14.876 1.00 0.00 N ATOM 0 H LYS A 40 -7.778 3.231 -10.293 1.00 0.00 H new ATOM 0 HA LYS A 40 -8.410 5.884 -10.957 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.978 3.290 -10.840 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -10.731 4.788 -11.348 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.527 4.898 -13.327 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.164 4.004 -12.683 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.166 2.461 -14.147 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.771 1.968 -12.577 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.607 2.005 -14.189 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.866 3.240 -12.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.163 3.816 -15.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.381 4.931 -14.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.470 3.940 -15.477 1.00 0.00 H new ATOM 600 N ALA A 41 -9.758 4.756 -8.176 1.00 0.00 N ATOM 601 CA ALA A 41 -10.461 5.161 -6.965 1.00 0.00 C ATOM 602 C ALA A 41 -9.630 6.147 -6.151 1.00 0.00 C ATOM 603 O ALA A 41 -10.140 7.164 -5.682 1.00 0.00 O ATOM 604 CB ALA A 41 -10.808 3.941 -6.124 1.00 0.00 C ATOM 0 H ALA A 41 -9.427 3.791 -8.169 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.384 5.661 -7.260 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.333 4.258 -5.223 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.447 3.272 -6.700 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.893 3.418 -5.846 1.00 0.00 H new ATOM 610 N ALA A 42 -8.348 5.839 -5.988 1.00 0.00 N ATOM 611 CA ALA A 42 -7.446 6.700 -5.232 1.00 0.00 C ATOM 612 C ALA A 42 -7.409 8.107 -5.819 1.00 0.00 C ATOM 613 O ALA A 42 -7.848 9.066 -5.184 1.00 0.00 O ATOM 614 CB ALA A 42 -6.047 6.101 -5.201 1.00 0.00 C ATOM 0 H ALA A 42 -7.910 5.000 -6.369 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.821 6.771 -4.211 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.384 6.754 -4.633 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -6.082 5.120 -4.728 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.672 6.000 -6.219 1.00 0.00 H new ATOM 620 N ILE A 43 -6.882 8.222 -7.033 1.00 0.00 N ATOM 621 CA ILE A 43 -6.788 9.512 -7.705 1.00 0.00 C ATOM 622 C ILE A 43 -8.103 10.278 -7.611 1.00 0.00 C ATOM 623 O ILE A 43 -8.120 11.509 -7.628 1.00 0.00 O ATOM 624 CB ILE A 43 -6.408 9.347 -9.189 1.00 0.00 C ATOM 625 CG1 ILE A 43 -5.056 8.642 -9.316 1.00 0.00 C ATOM 626 CG2 ILE A 43 -6.371 10.702 -9.880 1.00 0.00 C ATOM 627 CD1 ILE A 43 -3.873 9.555 -9.081 1.00 0.00 C ATOM 0 H ILE A 43 -6.514 7.438 -7.571 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.005 10.076 -7.198 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.165 8.733 -9.677 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.016 7.819 -8.603 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.975 8.205 -10.311 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -6.101 10.569 -10.928 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.353 11.171 -9.815 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.632 11.339 -9.393 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.949 8.987 -9.187 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.888 10.365 -9.811 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.929 9.972 -8.075 1.00 0.00 H new ATOM 639 N LYS A 44 -9.204 9.541 -7.510 1.00 0.00 N ATOM 640 CA LYS A 44 -10.525 10.150 -7.409 1.00 0.00 C ATOM 641 C LYS A 44 -10.747 10.743 -6.021 1.00 0.00 C ATOM 642 O LYS A 44 -11.429 11.756 -5.870 1.00 0.00 O ATOM 643 CB LYS A 44 -11.611 9.114 -7.712 1.00 0.00 C ATOM 644 CG LYS A 44 -11.993 9.047 -9.180 1.00 0.00 C ATOM 645 CD LYS A 44 -13.112 10.021 -9.511 1.00 0.00 C ATOM 646 CE LYS A 44 -12.631 11.463 -9.447 1.00 0.00 C ATOM 647 NZ LYS A 44 -13.560 12.388 -10.154 1.00 0.00 N ATOM 0 H LYS A 44 -9.208 8.521 -7.496 1.00 0.00 H new ATOM 0 HA LYS A 44 -10.583 10.955 -8.142 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.265 8.132 -7.390 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.499 9.348 -7.124 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.121 9.271 -9.794 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.306 8.033 -9.429 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -13.498 9.809 -10.508 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -13.937 9.880 -8.813 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -12.537 11.769 -8.405 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -11.638 11.535 -9.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -13.198 13.361 -10.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.631 12.112 -11.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.501 12.338 -9.714 1.00 0.00 H new ATOM 661 N ALA A 45 -10.165 10.105 -5.010 1.00 0.00 N ATOM 662 CA ALA A 45 -10.297 10.572 -3.636 1.00 0.00 C ATOM 663 C ALA A 45 -9.123 11.462 -3.244 1.00 0.00 C ATOM 664 O ALA A 45 -8.881 11.701 -2.060 1.00 0.00 O ATOM 665 CB ALA A 45 -10.405 9.389 -2.685 1.00 0.00 C ATOM 0 H ALA A 45 -9.598 9.264 -5.117 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.209 11.165 -3.566 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.503 9.752 -1.662 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.280 8.793 -2.944 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.509 8.773 -2.767 1.00 0.00 H new ATOM 671 N ILE A 46 -8.397 11.951 -4.244 1.00 0.00 N ATOM 672 CA ILE A 46 -7.249 12.815 -4.002 1.00 0.00 C ATOM 673 C ILE A 46 -7.573 13.883 -2.963 1.00 0.00 C ATOM 674 O ILE A 46 -6.805 14.109 -2.028 1.00 0.00 O ATOM 675 CB ILE A 46 -6.779 13.502 -5.298 1.00 0.00 C ATOM 676 CG1 ILE A 46 -5.318 13.939 -5.169 1.00 0.00 C ATOM 677 CG2 ILE A 46 -7.667 14.695 -5.618 1.00 0.00 C ATOM 678 CD1 ILE A 46 -4.576 13.962 -6.487 1.00 0.00 C ATOM 0 H ILE A 46 -8.584 11.763 -5.229 1.00 0.00 H new ATOM 0 HA ILE A 46 -6.448 12.178 -3.626 1.00 0.00 H new ATOM 0 HB ILE A 46 -6.854 12.787 -6.118 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.283 14.933 -4.724 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.805 13.264 -4.484 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -7.322 15.170 -6.537 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -8.696 14.358 -5.748 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -7.621 15.413 -4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.547 14.281 -6.320 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.580 12.964 -6.924 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -5.065 14.658 -7.168 1.00 0.00 H new ATOM 690 N LYS A 47 -8.717 14.537 -3.132 1.00 0.00 N ATOM 691 CA LYS A 47 -9.147 15.579 -2.208 1.00 0.00 C ATOM 692 C LYS A 47 -9.020 15.111 -0.762 1.00 0.00 C ATOM 693 O LYS A 47 -8.678 15.892 0.126 1.00 0.00 O ATOM 694 CB LYS A 47 -10.595 15.982 -2.499 1.00 0.00 C ATOM 695 CG LYS A 47 -11.511 14.802 -2.772 1.00 0.00 C ATOM 696 CD LYS A 47 -12.502 15.111 -3.882 1.00 0.00 C ATOM 697 CE LYS A 47 -13.670 14.137 -3.874 1.00 0.00 C ATOM 698 NZ LYS A 47 -14.124 13.826 -2.490 1.00 0.00 N ATOM 0 H LYS A 47 -9.364 14.363 -3.901 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.500 16.444 -2.350 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -10.984 16.545 -1.651 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -10.611 16.651 -3.360 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -10.914 13.933 -3.048 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.052 14.542 -1.862 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -12.875 16.129 -3.765 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -11.996 15.066 -4.846 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -14.499 14.560 -4.442 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -13.377 13.215 -4.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -15.131 13.565 -2.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -13.567 13.033 -2.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -13.992 14.662 -1.885 1.00 0.00 H new ATOM 712 N PHE A 48 -9.295 13.831 -0.533 1.00 0.00 N ATOM 713 CA PHE A 48 -9.210 13.259 0.806 1.00 0.00 C ATOM 714 C PHE A 48 -8.104 12.211 0.880 1.00 0.00 C ATOM 715 O PHE A 48 -8.044 11.421 1.823 1.00 0.00 O ATOM 716 CB PHE A 48 -10.549 12.633 1.202 1.00 0.00 C ATOM 717 CG PHE A 48 -11.736 13.481 0.845 1.00 0.00 C ATOM 718 CD1 PHE A 48 -11.653 14.864 0.885 1.00 0.00 C ATOM 719 CD2 PHE A 48 -12.934 12.896 0.470 1.00 0.00 C ATOM 720 CE1 PHE A 48 -12.744 15.647 0.558 1.00 0.00 C ATOM 721 CE2 PHE A 48 -14.029 13.674 0.141 1.00 0.00 C ATOM 722 CZ PHE A 48 -13.933 15.051 0.185 1.00 0.00 C ATOM 0 H PHE A 48 -9.578 13.171 -1.257 1.00 0.00 H new ATOM 0 HA PHE A 48 -8.972 14.062 1.503 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -10.646 11.663 0.714 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.552 12.451 2.277 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -10.725 15.335 1.175 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -13.014 11.820 0.434 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -12.667 16.724 0.594 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -14.958 13.206 -0.150 1.00 0.00 H new ATOM 0 HZ PHE A 48 -14.786 15.661 -0.072 1.00 0.00 H new ATOM 732 N TYR A 49 -7.231 12.209 -0.121 1.00 0.00 N ATOM 733 CA TYR A 49 -6.128 11.257 -0.172 1.00 0.00 C ATOM 734 C TYR A 49 -5.545 11.024 1.218 1.00 0.00 C ATOM 735 O TYR A 49 -5.131 9.914 1.554 1.00 0.00 O ATOM 736 CB TYR A 49 -5.036 11.759 -1.118 1.00 0.00 C ATOM 737 CG TYR A 49 -3.987 12.608 -0.435 1.00 0.00 C ATOM 738 CD1 TYR A 49 -4.318 13.831 0.135 1.00 0.00 C ATOM 739 CD2 TYR A 49 -2.665 12.187 -0.361 1.00 0.00 C ATOM 740 CE1 TYR A 49 -3.363 14.610 0.759 1.00 0.00 C ATOM 741 CE2 TYR A 49 -1.704 12.959 0.262 1.00 0.00 C ATOM 742 CZ TYR A 49 -2.058 14.170 0.820 1.00 0.00 C ATOM 743 OH TYR A 49 -1.103 14.942 1.441 1.00 0.00 O ATOM 0 H TYR A 49 -7.266 12.856 -0.908 1.00 0.00 H new ATOM 0 HA TYR A 49 -6.516 10.310 -0.547 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -4.550 10.903 -1.586 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.498 12.339 -1.917 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -5.340 14.179 0.089 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -2.384 11.240 -0.798 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -3.637 15.559 1.197 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -0.681 12.616 0.312 1.00 0.00 H new ATOM 0 HH TYR A 49 -1.521 15.467 2.155 1.00 0.00 H new ATOM 753 N LYS A 50 -5.515 12.079 2.025 1.00 0.00 N ATOM 754 CA LYS A 50 -4.985 11.993 3.380 1.00 0.00 C ATOM 755 C LYS A 50 -5.329 10.649 4.014 1.00 0.00 C ATOM 756 O LYS A 50 -4.592 10.144 4.862 1.00 0.00 O ATOM 757 CB LYS A 50 -5.539 13.131 4.240 1.00 0.00 C ATOM 758 CG LYS A 50 -5.127 14.512 3.760 1.00 0.00 C ATOM 759 CD LYS A 50 -5.877 15.606 4.501 1.00 0.00 C ATOM 760 CE LYS A 50 -5.627 16.972 3.880 1.00 0.00 C ATOM 761 NZ LYS A 50 -6.608 17.986 4.357 1.00 0.00 N ATOM 0 H LYS A 50 -5.852 13.005 1.763 1.00 0.00 H new ATOM 0 HA LYS A 50 -3.900 12.082 3.325 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -6.627 13.069 4.252 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -5.201 12.997 5.267 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -4.055 14.643 3.904 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -5.318 14.599 2.690 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.945 15.389 4.488 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -5.567 15.618 5.546 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.617 17.302 4.123 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -5.685 16.893 2.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -6.404 18.903 3.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -7.570 17.684 4.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -6.536 18.080 5.390 1.00 0.00 H new ATOM 775 N HIS A 51 -6.452 10.073 3.596 1.00 0.00 N ATOM 776 CA HIS A 51 -6.892 8.785 4.122 1.00 0.00 C ATOM 777 C HIS A 51 -6.350 7.638 3.275 1.00 0.00 C ATOM 778 O HIS A 51 -5.825 6.657 3.802 1.00 0.00 O ATOM 779 CB HIS A 51 -8.419 8.724 4.168 1.00 0.00 C ATOM 780 CG HIS A 51 -8.999 9.199 5.465 1.00 0.00 C ATOM 781 ND1 HIS A 51 -9.948 8.488 6.169 1.00 0.00 N ATOM 782 CD2 HIS A 51 -8.758 10.318 6.185 1.00 0.00 C ATOM 783 CE1 HIS A 51 -10.267 9.152 7.266 1.00 0.00 C ATOM 784 NE2 HIS A 51 -9.558 10.266 7.300 1.00 0.00 N ATOM 0 H HIS A 51 -7.073 10.477 2.895 1.00 0.00 H new ATOM 0 HA HIS A 51 -6.501 8.681 5.134 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -8.823 9.328 3.356 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -8.739 7.697 3.991 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -8.065 11.106 5.930 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -10.985 8.837 8.009 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -9.598 10.972 8.035 1.00 0.00 H new ATOM 792 N VAL A 52 -6.482 7.768 1.958 1.00 0.00 N ATOM 793 CA VAL A 52 -6.005 6.743 1.038 1.00 0.00 C ATOM 794 C VAL A 52 -4.573 6.335 1.363 1.00 0.00 C ATOM 795 O VAL A 52 -4.315 5.199 1.763 1.00 0.00 O ATOM 796 CB VAL A 52 -6.071 7.226 -0.423 1.00 0.00 C ATOM 797 CG1 VAL A 52 -5.120 6.420 -1.296 1.00 0.00 C ATOM 798 CG2 VAL A 52 -7.495 7.138 -0.950 1.00 0.00 C ATOM 0 H VAL A 52 -6.915 8.573 1.505 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.661 5.881 1.158 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.760 8.270 -0.456 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.181 6.776 -2.325 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.100 6.540 -0.930 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.397 5.366 -1.259 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.522 7.483 -1.983 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.837 6.104 -0.904 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.148 7.764 -0.341 1.00 0.00 H new ATOM 808 N VAL A 53 -3.643 7.269 1.189 1.00 0.00 N ATOM 809 CA VAL A 53 -2.236 7.007 1.466 1.00 0.00 C ATOM 810 C VAL A 53 -2.074 6.103 2.682 1.00 0.00 C ATOM 811 O VAL A 53 -1.381 5.087 2.624 1.00 0.00 O ATOM 812 CB VAL A 53 -1.459 8.316 1.705 1.00 0.00 C ATOM 813 CG1 VAL A 53 -0.044 8.017 2.177 1.00 0.00 C ATOM 814 CG2 VAL A 53 -1.441 9.163 0.442 1.00 0.00 C ATOM 0 H VAL A 53 -3.839 8.214 0.858 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.828 6.506 0.588 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.966 8.882 2.487 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.490 8.953 2.341 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.083 7.453 3.109 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.476 7.430 1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.888 10.084 0.629 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.959 8.607 -0.362 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.463 9.406 0.152 1.00 0.00 H new ATOM 824 N GLN A 54 -2.717 6.480 3.783 1.00 0.00 N ATOM 825 CA GLN A 54 -2.643 5.702 5.014 1.00 0.00 C ATOM 826 C GLN A 54 -3.047 4.252 4.767 1.00 0.00 C ATOM 827 O GLN A 54 -2.283 3.328 5.047 1.00 0.00 O ATOM 828 CB GLN A 54 -3.543 6.319 6.086 1.00 0.00 C ATOM 829 CG GLN A 54 -3.315 5.745 7.475 1.00 0.00 C ATOM 830 CD GLN A 54 -4.190 6.398 8.527 1.00 0.00 C ATOM 831 OE1 GLN A 54 -5.340 6.750 8.264 1.00 0.00 O ATOM 832 NE2 GLN A 54 -3.648 6.564 9.728 1.00 0.00 N ATOM 0 H GLN A 54 -3.294 7.318 3.847 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.610 5.718 5.363 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.375 7.396 6.115 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.585 6.167 5.805 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -3.512 4.673 7.458 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.268 5.872 7.749 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -2.691 6.257 9.902 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -4.189 6.998 10.476 1.00 0.00 H new ATOM 841 N SER A 55 -4.253 4.060 4.241 1.00 0.00 N ATOM 842 CA SER A 55 -4.760 2.722 3.960 1.00 0.00 C ATOM 843 C SER A 55 -3.737 1.908 3.173 1.00 0.00 C ATOM 844 O SER A 55 -3.528 0.725 3.442 1.00 0.00 O ATOM 845 CB SER A 55 -6.073 2.805 3.180 1.00 0.00 C ATOM 846 OG SER A 55 -7.174 2.992 4.052 1.00 0.00 O ATOM 0 H SER A 55 -4.897 4.814 4.001 1.00 0.00 H new ATOM 0 HA SER A 55 -4.942 2.221 4.911 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.025 3.629 2.468 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.214 1.892 2.602 1.00 0.00 H new ATOM 0 HG SER A 55 -7.802 3.630 3.654 1.00 0.00 H new ATOM 852 N VAL A 56 -3.103 2.551 2.198 1.00 0.00 N ATOM 853 CA VAL A 56 -2.101 1.888 1.371 1.00 0.00 C ATOM 854 C VAL A 56 -0.906 1.443 2.206 1.00 0.00 C ATOM 855 O VAL A 56 -0.219 0.482 1.861 1.00 0.00 O ATOM 856 CB VAL A 56 -1.608 2.810 0.240 1.00 0.00 C ATOM 857 CG1 VAL A 56 -0.522 2.123 -0.574 1.00 0.00 C ATOM 858 CG2 VAL A 56 -2.769 3.229 -0.650 1.00 0.00 C ATOM 0 H VAL A 56 -3.265 3.530 1.961 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.581 1.013 0.933 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.180 3.708 0.687 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.186 2.790 -1.368 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.319 1.879 0.075 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -0.920 1.208 -1.012 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -2.403 3.880 -1.444 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -3.228 2.344 -1.090 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.509 3.764 -0.055 1.00 0.00 H new ATOM 868 N GLU A 57 -0.664 2.148 3.306 1.00 0.00 N ATOM 869 CA GLU A 57 0.449 1.825 4.191 1.00 0.00 C ATOM 870 C GLU A 57 0.043 0.766 5.211 1.00 0.00 C ATOM 871 O GLU A 57 0.866 -0.039 5.649 1.00 0.00 O ATOM 872 CB GLU A 57 0.938 3.083 4.913 1.00 0.00 C ATOM 873 CG GLU A 57 1.456 4.160 3.975 1.00 0.00 C ATOM 874 CD GLU A 57 1.895 5.412 4.710 1.00 0.00 C ATOM 875 OE1 GLU A 57 2.532 5.282 5.776 1.00 0.00 O ATOM 876 OE2 GLU A 57 1.603 6.522 4.217 1.00 0.00 O ATOM 0 H GLU A 57 -1.223 2.946 3.606 1.00 0.00 H new ATOM 0 HA GLU A 57 1.260 1.426 3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.120 3.492 5.506 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.730 2.807 5.609 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.296 3.765 3.403 1.00 0.00 H new ATOM 0 HG3 GLU A 57 0.676 4.418 3.259 1.00 0.00 H new ATOM 883 N LYS A 58 -1.231 0.772 5.587 1.00 0.00 N ATOM 884 CA LYS A 58 -1.749 -0.188 6.555 1.00 0.00 C ATOM 885 C LYS A 58 -1.959 -1.553 5.909 1.00 0.00 C ATOM 886 O LYS A 58 -1.370 -2.548 6.331 1.00 0.00 O ATOM 887 CB LYS A 58 -3.066 0.316 7.149 1.00 0.00 C ATOM 888 CG LYS A 58 -2.972 1.710 7.745 1.00 0.00 C ATOM 889 CD LYS A 58 -2.090 1.728 8.982 1.00 0.00 C ATOM 890 CE LYS A 58 -1.556 3.124 9.266 1.00 0.00 C ATOM 891 NZ LYS A 58 -0.543 3.545 8.259 1.00 0.00 N ATOM 0 H LYS A 58 -1.925 1.432 5.236 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.014 -0.293 7.353 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.830 0.313 6.371 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.395 -0.379 7.922 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.571 2.399 7.001 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.970 2.065 8.003 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -2.659 1.373 9.841 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.256 1.039 8.846 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.382 3.835 9.270 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -1.111 3.147 10.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 0.023 4.329 8.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 0.081 2.743 8.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -1.025 3.857 7.392 1.00 0.00 H new ATOM 905 N PHE A 59 -2.801 -1.593 4.881 1.00 0.00 N ATOM 906 CA PHE A 59 -3.089 -2.837 4.176 1.00 0.00 C ATOM 907 C PHE A 59 -1.816 -3.655 3.977 1.00 0.00 C ATOM 908 O PHE A 59 -1.855 -4.886 3.956 1.00 0.00 O ATOM 909 CB PHE A 59 -3.736 -2.541 2.822 1.00 0.00 C ATOM 910 CG PHE A 59 -3.569 -3.651 1.823 1.00 0.00 C ATOM 911 CD1 PHE A 59 -2.456 -3.699 1.000 1.00 0.00 C ATOM 912 CD2 PHE A 59 -4.526 -4.647 1.708 1.00 0.00 C ATOM 913 CE1 PHE A 59 -2.299 -4.719 0.080 1.00 0.00 C ATOM 914 CE2 PHE A 59 -4.375 -5.669 0.791 1.00 0.00 C ATOM 915 CZ PHE A 59 -3.261 -5.705 -0.025 1.00 0.00 C ATOM 0 H PHE A 59 -3.296 -0.778 4.518 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.783 -3.419 4.783 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.799 -2.353 2.970 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.304 -1.627 2.414 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -1.702 -2.930 1.078 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -5.400 -4.624 2.343 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -1.426 -4.745 -0.555 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.128 -6.440 0.712 1.00 0.00 H new ATOM 0 HZ PHE A 59 -3.142 -6.502 -0.744 1.00 0.00 H new ATOM 925 N ILE A 60 -0.691 -2.963 3.832 1.00 0.00 N ATOM 926 CA ILE A 60 0.592 -3.626 3.635 1.00 0.00 C ATOM 927 C ILE A 60 1.024 -4.371 4.893 1.00 0.00 C ATOM 928 O ILE A 60 1.552 -5.481 4.818 1.00 0.00 O ATOM 929 CB ILE A 60 1.691 -2.620 3.245 1.00 0.00 C ATOM 930 CG1 ILE A 60 1.512 -2.174 1.793 1.00 0.00 C ATOM 931 CG2 ILE A 60 3.068 -3.233 3.452 1.00 0.00 C ATOM 932 CD1 ILE A 60 2.442 -1.052 1.386 1.00 0.00 C ATOM 0 H ILE A 60 -0.642 -1.944 3.847 1.00 0.00 H new ATOM 0 HA ILE A 60 0.458 -4.339 2.821 1.00 0.00 H new ATOM 0 HB ILE A 60 1.606 -1.743 3.887 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.677 -3.028 1.136 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.481 -1.852 1.645 1.00 0.00 H new ATOM 0 HG21 ILE A 60 3.834 -2.510 3.172 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.191 -3.505 4.500 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.166 -4.124 2.832 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.259 -0.788 0.345 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.262 -0.183 2.018 1.00 0.00 H new ATOM 0 HD13 ILE A 60 3.476 -1.377 1.502 1.00 0.00 H new ATOM 944 N GLN A 61 0.796 -3.754 6.048 1.00 0.00 N ATOM 945 CA GLN A 61 1.161 -4.361 7.323 1.00 0.00 C ATOM 946 C GLN A 61 0.134 -5.408 7.742 1.00 0.00 C ATOM 947 O GLN A 61 0.414 -6.268 8.577 1.00 0.00 O ATOM 948 CB GLN A 61 1.283 -3.287 8.406 1.00 0.00 C ATOM 949 CG GLN A 61 -0.056 -2.754 8.888 1.00 0.00 C ATOM 950 CD GLN A 61 -0.002 -2.245 10.315 1.00 0.00 C ATOM 951 OE1 GLN A 61 1.068 -2.167 10.919 1.00 0.00 O ATOM 952 NE2 GLN A 61 -1.160 -1.896 10.863 1.00 0.00 N ATOM 0 H GLN A 61 0.361 -2.835 6.127 1.00 0.00 H new ATOM 0 HA GLN A 61 2.125 -4.854 7.199 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.827 -3.700 9.255 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.876 -2.459 8.019 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -0.380 -1.947 8.230 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.804 -3.543 8.816 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -2.023 -1.977 10.326 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -1.186 -1.547 11.821 1.00 0.00 H new ATOM 961 N LYS A 62 -1.057 -5.328 7.157 1.00 0.00 N ATOM 962 CA LYS A 62 -2.127 -6.269 7.468 1.00 0.00 C ATOM 963 C LYS A 62 -2.122 -7.440 6.491 1.00 0.00 C ATOM 964 O LYS A 62 -2.489 -8.560 6.849 1.00 0.00 O ATOM 965 CB LYS A 62 -3.483 -5.562 7.428 1.00 0.00 C ATOM 966 CG LYS A 62 -3.477 -4.194 8.089 1.00 0.00 C ATOM 967 CD LYS A 62 -3.639 -4.303 9.595 1.00 0.00 C ATOM 968 CE LYS A 62 -5.104 -4.254 10.003 1.00 0.00 C ATOM 969 NZ LYS A 62 -5.266 -3.969 11.455 1.00 0.00 N ATOM 0 H LYS A 62 -1.305 -4.621 6.465 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.956 -6.657 8.472 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -3.796 -5.453 6.390 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -4.225 -6.190 7.920 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.543 -3.682 7.859 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -4.284 -3.587 7.678 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -3.194 -5.235 9.943 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.098 -3.491 10.080 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -5.617 -3.487 9.423 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.579 -5.205 9.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -6.278 -3.944 11.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -4.798 -4.714 12.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -4.835 -3.049 11.678 1.00 0.00 H new ATOM 983 N CYS A 63 -1.705 -7.175 5.259 1.00 0.00 N ATOM 984 CA CYS A 63 -1.652 -8.207 4.230 1.00 0.00 C ATOM 985 C CYS A 63 -0.687 -9.320 4.626 1.00 0.00 C ATOM 986 O CYS A 63 -0.143 -9.321 5.730 1.00 0.00 O ATOM 987 CB CYS A 63 -1.230 -7.602 2.891 1.00 0.00 C ATOM 988 SG CYS A 63 0.526 -7.180 2.792 1.00 0.00 S ATOM 0 H CYS A 63 -1.398 -6.253 4.948 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.649 -8.634 4.128 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.469 -8.307 2.095 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.819 -6.703 2.709 1.00 0.00 H new ATOM 0 HG CYS A 63 0.926 -6.716 3.938 1.00 0.00 H new ATOM 994 N LYS A 64 -0.481 -10.268 3.717 1.00 0.00 N ATOM 995 CA LYS A 64 0.418 -11.388 3.970 1.00 0.00 C ATOM 996 C LYS A 64 1.779 -11.150 3.322 1.00 0.00 C ATOM 997 O LYS A 64 1.915 -10.374 2.376 1.00 0.00 O ATOM 998 CB LYS A 64 -0.191 -12.687 3.440 1.00 0.00 C ATOM 999 CG LYS A 64 -1.555 -13.004 4.029 1.00 0.00 C ATOM 1000 CD LYS A 64 -2.675 -12.400 3.198 1.00 0.00 C ATOM 1001 CE LYS A 64 -4.002 -12.438 3.940 1.00 0.00 C ATOM 1002 NZ LYS A 64 -3.885 -11.878 5.315 1.00 0.00 N ATOM 0 H LYS A 64 -0.925 -10.283 2.799 1.00 0.00 H new ATOM 0 HA LYS A 64 0.558 -11.473 5.048 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.279 -12.621 2.356 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.489 -13.511 3.655 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.685 -14.085 4.086 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.610 -12.622 5.048 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -2.427 -11.369 2.946 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.767 -12.945 2.258 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -4.747 -11.873 3.380 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.357 -13.467 3.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -4.757 -11.365 5.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -3.740 -12.652 5.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -3.076 -11.226 5.356 1.00 0.00 H new ATOM 1016 N PRO A 65 2.809 -11.835 3.840 1.00 0.00 N ATOM 1017 CA PRO A 65 4.177 -11.716 3.325 1.00 0.00 C ATOM 1018 C PRO A 65 4.236 -11.833 1.806 1.00 0.00 C ATOM 1019 O PRO A 65 5.194 -11.383 1.178 1.00 0.00 O ATOM 1020 CB PRO A 65 4.905 -12.892 3.980 1.00 0.00 C ATOM 1021 CG PRO A 65 4.143 -13.161 5.232 1.00 0.00 C ATOM 1022 CD PRO A 65 2.719 -12.778 4.968 1.00 0.00 C ATOM 0 HA PRO A 65 4.616 -10.745 3.553 1.00 0.00 H new ATOM 0 HB2 PRO A 65 4.914 -13.765 3.327 1.00 0.00 H new ATOM 0 HB3 PRO A 65 5.944 -12.644 4.195 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.215 -14.213 5.509 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.550 -12.584 6.063 1.00 0.00 H new ATOM 0 HD2 PRO A 65 2.112 -13.647 4.715 1.00 0.00 H new ATOM 0 HD3 PRO A 65 2.262 -12.313 5.842 1.00 0.00 H new ATOM 1030 N GLU A 66 3.207 -12.438 1.222 1.00 0.00 N ATOM 1031 CA GLU A 66 3.144 -12.613 -0.224 1.00 0.00 C ATOM 1032 C GLU A 66 2.576 -11.367 -0.898 1.00 0.00 C ATOM 1033 O GLU A 66 2.901 -11.068 -2.048 1.00 0.00 O ATOM 1034 CB GLU A 66 2.289 -13.832 -0.576 1.00 0.00 C ATOM 1035 CG GLU A 66 0.815 -13.656 -0.250 1.00 0.00 C ATOM 1036 CD GLU A 66 -0.060 -14.691 -0.930 1.00 0.00 C ATOM 1037 OE1 GLU A 66 -0.191 -14.634 -2.171 1.00 0.00 O ATOM 1038 OE2 GLU A 66 -0.615 -15.557 -0.221 1.00 0.00 O ATOM 0 H GLU A 66 2.406 -12.815 1.728 1.00 0.00 H new ATOM 0 HA GLU A 66 4.158 -12.773 -0.590 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.394 -14.044 -1.640 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.670 -14.700 -0.038 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.675 -13.720 0.829 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.496 -12.659 -0.554 1.00 0.00 H new ATOM 1045 N TYR A 67 1.726 -10.646 -0.176 1.00 0.00 N ATOM 1046 CA TYR A 67 1.110 -9.435 -0.704 1.00 0.00 C ATOM 1047 C TYR A 67 1.968 -8.210 -0.399 1.00 0.00 C ATOM 1048 O TYR A 67 1.459 -7.095 -0.280 1.00 0.00 O ATOM 1049 CB TYR A 67 -0.289 -9.251 -0.115 1.00 0.00 C ATOM 1050 CG TYR A 67 -1.320 -10.192 -0.697 1.00 0.00 C ATOM 1051 CD1 TYR A 67 -1.938 -9.913 -1.909 1.00 0.00 C ATOM 1052 CD2 TYR A 67 -1.674 -11.361 -0.035 1.00 0.00 C ATOM 1053 CE1 TYR A 67 -2.881 -10.770 -2.444 1.00 0.00 C ATOM 1054 CE2 TYR A 67 -2.614 -12.225 -0.563 1.00 0.00 C ATOM 1055 CZ TYR A 67 -3.215 -11.924 -1.768 1.00 0.00 C ATOM 1056 OH TYR A 67 -4.152 -12.781 -2.298 1.00 0.00 O ATOM 0 H TYR A 67 1.448 -10.879 0.777 1.00 0.00 H new ATOM 0 HA TYR A 67 1.030 -9.540 -1.786 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.242 -9.399 0.964 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.612 -8.223 -0.282 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.677 -9.011 -2.443 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.206 -11.599 0.909 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.354 -10.537 -3.387 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.877 -13.130 -0.036 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.271 -13.547 -1.698 1.00 0.00 H new ATOM 1066 N LYS A 68 3.273 -8.426 -0.275 1.00 0.00 N ATOM 1067 CA LYS A 68 4.204 -7.342 0.014 1.00 0.00 C ATOM 1068 C LYS A 68 4.605 -6.614 -1.265 1.00 0.00 C ATOM 1069 O LYS A 68 5.015 -5.453 -1.228 1.00 0.00 O ATOM 1070 CB LYS A 68 5.450 -7.886 0.717 1.00 0.00 C ATOM 1071 CG LYS A 68 5.172 -8.446 2.101 1.00 0.00 C ATOM 1072 CD LYS A 68 4.267 -7.527 2.903 1.00 0.00 C ATOM 1073 CE LYS A 68 4.280 -7.884 4.382 1.00 0.00 C ATOM 1074 NZ LYS A 68 3.816 -6.752 5.230 1.00 0.00 N ATOM 0 H LYS A 68 3.710 -9.343 -0.370 1.00 0.00 H new ATOM 0 HA LYS A 68 3.704 -6.632 0.673 1.00 0.00 H new ATOM 0 HB2 LYS A 68 5.893 -8.668 0.100 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.188 -7.088 0.799 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.707 -9.428 2.011 1.00 0.00 H new ATOM 0 HG3 LYS A 68 6.113 -8.587 2.633 1.00 0.00 H new ATOM 0 HD2 LYS A 68 4.589 -6.494 2.774 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.248 -7.593 2.521 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.641 -8.751 4.552 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.290 -8.169 4.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 3.840 -7.035 6.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.440 -5.933 5.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 2.843 -6.496 4.966 1.00 0.00 H new ATOM 1088 N VAL A 69 4.484 -7.302 -2.395 1.00 0.00 N ATOM 1089 CA VAL A 69 4.831 -6.720 -3.686 1.00 0.00 C ATOM 1090 C VAL A 69 3.698 -5.852 -4.221 1.00 0.00 C ATOM 1091 O VAL A 69 3.900 -4.714 -4.643 1.00 0.00 O ATOM 1092 CB VAL A 69 5.161 -7.811 -4.723 1.00 0.00 C ATOM 1093 CG1 VAL A 69 4.745 -7.366 -6.116 1.00 0.00 C ATOM 1094 CG2 VAL A 69 6.643 -8.152 -4.684 1.00 0.00 C ATOM 0 H VAL A 69 4.148 -8.264 -2.443 1.00 0.00 H new ATOM 0 HA VAL A 69 5.714 -6.101 -3.527 1.00 0.00 H new ATOM 0 HB VAL A 69 4.598 -8.710 -4.471 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.986 -8.149 -6.835 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.672 -7.176 -6.132 1.00 0.00 H new ATOM 0 HG13 VAL A 69 5.279 -6.453 -6.381 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.858 -8.924 -5.423 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.228 -7.260 -4.910 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.907 -8.516 -3.691 1.00 0.00 H new ATOM 1104 N PRO A 70 2.474 -6.401 -4.203 1.00 0.00 N ATOM 1105 CA PRO A 70 1.282 -5.693 -4.681 1.00 0.00 C ATOM 1106 C PRO A 70 1.184 -4.278 -4.122 1.00 0.00 C ATOM 1107 O PRO A 70 0.991 -3.318 -4.866 1.00 0.00 O ATOM 1108 CB PRO A 70 0.127 -6.554 -4.164 1.00 0.00 C ATOM 1109 CG PRO A 70 0.704 -7.921 -4.029 1.00 0.00 C ATOM 1110 CD PRO A 70 2.159 -7.753 -3.713 1.00 0.00 C ATOM 0 HA PRO A 70 1.288 -5.570 -5.764 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.245 -6.185 -3.208 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -0.714 -6.546 -4.857 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.199 -8.476 -3.238 1.00 0.00 H new ATOM 0 HG3 PRO A 70 0.572 -8.488 -4.951 1.00 0.00 H new ATOM 0 HD2 PRO A 70 2.349 -7.845 -2.644 1.00 0.00 H new ATOM 0 HD3 PRO A 70 2.766 -8.510 -4.210 1.00 0.00 H new ATOM 1118 N GLY A 71 1.319 -4.157 -2.804 1.00 0.00 N ATOM 1119 CA GLY A 71 1.243 -2.855 -2.168 1.00 0.00 C ATOM 1120 C GLY A 71 2.072 -1.809 -2.887 1.00 0.00 C ATOM 1121 O GLY A 71 1.600 -0.700 -3.141 1.00 0.00 O ATOM 0 H GLY A 71 1.479 -4.937 -2.167 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.203 -2.530 -2.135 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.584 -2.938 -1.136 1.00 0.00 H new ATOM 1125 N LEU A 72 3.311 -2.160 -3.214 1.00 0.00 N ATOM 1126 CA LEU A 72 4.208 -1.242 -3.907 1.00 0.00 C ATOM 1127 C LEU A 72 3.586 -0.753 -5.211 1.00 0.00 C ATOM 1128 O LEU A 72 3.542 0.449 -5.477 1.00 0.00 O ATOM 1129 CB LEU A 72 5.547 -1.925 -4.192 1.00 0.00 C ATOM 1130 CG LEU A 72 6.773 -1.012 -4.221 1.00 0.00 C ATOM 1131 CD1 LEU A 72 6.513 0.204 -5.097 1.00 0.00 C ATOM 1132 CD2 LEU A 72 7.152 -0.583 -2.811 1.00 0.00 C ATOM 0 H LEU A 72 3.717 -3.073 -3.010 1.00 0.00 H new ATOM 0 HA LEU A 72 4.376 -0.380 -3.261 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.709 -2.693 -3.436 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.475 -2.434 -5.153 1.00 0.00 H new ATOM 0 HG LEU A 72 7.607 -1.570 -4.647 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.397 0.842 -5.105 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.290 -0.121 -6.113 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.665 0.763 -4.701 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.027 0.066 -2.851 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.320 -0.043 -2.359 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.381 -1.464 -2.212 1.00 0.00 H new ATOM 1144 N TYR A 73 3.105 -1.691 -6.019 1.00 0.00 N ATOM 1145 CA TYR A 73 2.485 -1.355 -7.295 1.00 0.00 C ATOM 1146 C TYR A 73 1.343 -0.362 -7.102 1.00 0.00 C ATOM 1147 O TYR A 73 1.211 0.604 -7.854 1.00 0.00 O ATOM 1148 CB TYR A 73 1.965 -2.619 -7.982 1.00 0.00 C ATOM 1149 CG TYR A 73 3.055 -3.602 -8.346 1.00 0.00 C ATOM 1150 CD1 TYR A 73 4.395 -3.281 -8.166 1.00 0.00 C ATOM 1151 CD2 TYR A 73 2.746 -4.851 -8.870 1.00 0.00 C ATOM 1152 CE1 TYR A 73 5.395 -4.176 -8.498 1.00 0.00 C ATOM 1153 CE2 TYR A 73 3.738 -5.752 -9.203 1.00 0.00 C ATOM 1154 CZ TYR A 73 5.061 -5.410 -9.016 1.00 0.00 C ATOM 1155 OH TYR A 73 6.053 -6.304 -9.348 1.00 0.00 O ATOM 0 H TYR A 73 3.132 -2.690 -5.813 1.00 0.00 H new ATOM 0 HA TYR A 73 3.243 -0.891 -7.926 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.248 -3.111 -7.325 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.426 -2.336 -8.886 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.660 -2.316 -7.760 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.711 -5.122 -9.020 1.00 0.00 H new ATOM 0 HE1 TYR A 73 6.432 -3.911 -8.353 1.00 0.00 H new ATOM 0 HE2 TYR A 73 3.479 -6.719 -9.608 1.00 0.00 H new ATOM 0 HH TYR A 73 5.900 -6.640 -10.256 1.00 0.00 H new ATOM 1165 N VAL A 74 0.520 -0.607 -6.088 1.00 0.00 N ATOM 1166 CA VAL A 74 -0.611 0.266 -5.793 1.00 0.00 C ATOM 1167 C VAL A 74 -0.146 1.690 -5.509 1.00 0.00 C ATOM 1168 O VAL A 74 -0.810 2.656 -5.885 1.00 0.00 O ATOM 1169 CB VAL A 74 -1.418 -0.250 -4.586 1.00 0.00 C ATOM 1170 CG1 VAL A 74 -2.523 0.731 -4.225 1.00 0.00 C ATOM 1171 CG2 VAL A 74 -1.991 -1.628 -4.879 1.00 0.00 C ATOM 0 H VAL A 74 0.615 -1.403 -5.457 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.251 0.265 -6.675 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.747 -0.335 -3.731 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -3.083 0.350 -3.371 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.084 1.696 -3.971 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.195 0.851 -5.075 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -2.558 -1.977 -4.016 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.649 -1.572 -5.747 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.178 -2.324 -5.085 1.00 0.00 H new ATOM 1181 N ILE A 75 0.997 1.811 -4.843 1.00 0.00 N ATOM 1182 CA ILE A 75 1.551 3.118 -4.510 1.00 0.00 C ATOM 1183 C ILE A 75 2.079 3.824 -5.754 1.00 0.00 C ATOM 1184 O ILE A 75 1.916 5.035 -5.910 1.00 0.00 O ATOM 1185 CB ILE A 75 2.689 3.001 -3.478 1.00 0.00 C ATOM 1186 CG1 ILE A 75 2.142 2.502 -2.139 1.00 0.00 C ATOM 1187 CG2 ILE A 75 3.387 4.341 -3.305 1.00 0.00 C ATOM 1188 CD1 ILE A 75 3.222 2.107 -1.156 1.00 0.00 C ATOM 0 H ILE A 75 1.557 1.021 -4.523 1.00 0.00 H new ATOM 0 HA ILE A 75 0.739 3.704 -4.079 1.00 0.00 H new ATOM 0 HB ILE A 75 3.419 2.278 -3.843 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.525 3.282 -1.694 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.493 1.645 -2.317 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.188 4.242 -2.573 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.805 4.659 -4.260 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.668 5.083 -2.958 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.762 1.763 -0.229 1.00 0.00 H new ATOM 0 HD12 ILE A 75 3.825 1.305 -1.581 1.00 0.00 H new ATOM 0 HD13 ILE A 75 3.857 2.968 -0.948 1.00 0.00 H new ATOM 1200 N ASP A 76 2.711 3.060 -6.638 1.00 0.00 N ATOM 1201 CA ASP A 76 3.261 3.612 -7.871 1.00 0.00 C ATOM 1202 C ASP A 76 2.146 4.044 -8.818 1.00 0.00 C ATOM 1203 O ASP A 76 2.065 5.208 -9.208 1.00 0.00 O ATOM 1204 CB ASP A 76 4.161 2.584 -8.558 1.00 0.00 C ATOM 1205 CG ASP A 76 4.778 1.607 -7.577 1.00 0.00 C ATOM 1206 OD1 ASP A 76 5.070 2.018 -6.434 1.00 0.00 O ATOM 1207 OD2 ASP A 76 4.969 0.431 -7.951 1.00 0.00 O ATOM 0 H ASP A 76 2.855 2.057 -6.524 1.00 0.00 H new ATOM 0 HA ASP A 76 3.855 4.489 -7.614 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.580 2.033 -9.298 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.954 3.102 -9.097 1.00 0.00 H new ATOM 1212 N SER A 77 1.288 3.097 -9.184 1.00 0.00 N ATOM 1213 CA SER A 77 0.180 3.378 -10.090 1.00 0.00 C ATOM 1214 C SER A 77 -0.527 4.672 -9.698 1.00 0.00 C ATOM 1215 O SER A 77 -1.049 5.390 -10.551 1.00 0.00 O ATOM 1216 CB SER A 77 -0.817 2.217 -10.086 1.00 0.00 C ATOM 1217 OG SER A 77 -0.188 1.004 -10.462 1.00 0.00 O ATOM 0 H SER A 77 1.339 2.129 -8.867 1.00 0.00 H new ATOM 0 HA SER A 77 0.585 3.496 -11.095 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.253 2.111 -9.093 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.636 2.434 -10.772 1.00 0.00 H new ATOM 0 HG SER A 77 0.317 0.648 -9.701 1.00 0.00 H new ATOM 1223 N ILE A 78 -0.541 4.961 -8.401 1.00 0.00 N ATOM 1224 CA ILE A 78 -1.183 6.168 -7.895 1.00 0.00 C ATOM 1225 C ILE A 78 -0.289 7.389 -8.089 1.00 0.00 C ATOM 1226 O ILE A 78 -0.622 8.301 -8.847 1.00 0.00 O ATOM 1227 CB ILE A 78 -1.533 6.036 -6.401 1.00 0.00 C ATOM 1228 CG1 ILE A 78 -2.711 5.076 -6.215 1.00 0.00 C ATOM 1229 CG2 ILE A 78 -1.855 7.400 -5.810 1.00 0.00 C ATOM 1230 CD1 ILE A 78 -2.756 4.435 -4.846 1.00 0.00 C ATOM 0 H ILE A 78 -0.115 4.376 -7.682 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.103 6.298 -8.466 1.00 0.00 H new ATOM 0 HB ILE A 78 -0.670 5.629 -5.874 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.641 5.618 -6.385 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.655 4.294 -6.972 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -2.100 7.290 -4.754 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -0.991 8.055 -5.915 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.705 7.833 -6.337 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.616 3.768 -4.785 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.842 3.865 -4.681 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -2.843 5.210 -4.084 1.00 0.00 H new ATOM 1242 N VAL A 79 0.848 7.398 -7.402 1.00 0.00 N ATOM 1243 CA VAL A 79 1.792 8.505 -7.500 1.00 0.00 C ATOM 1244 C VAL A 79 2.019 8.906 -8.954 1.00 0.00 C ATOM 1245 O VAL A 79 2.017 10.090 -9.290 1.00 0.00 O ATOM 1246 CB VAL A 79 3.146 8.147 -6.860 1.00 0.00 C ATOM 1247 CG1 VAL A 79 4.137 9.289 -7.032 1.00 0.00 C ATOM 1248 CG2 VAL A 79 2.966 7.803 -5.390 1.00 0.00 C ATOM 0 H VAL A 79 1.138 6.651 -6.771 1.00 0.00 H new ATOM 0 HA VAL A 79 1.354 9.344 -6.959 1.00 0.00 H new ATOM 0 HB VAL A 79 3.548 7.270 -7.368 1.00 0.00 H new ATOM 0 HG11 VAL A 79 5.088 9.018 -6.573 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.288 9.483 -8.094 1.00 0.00 H new ATOM 0 HG13 VAL A 79 3.746 10.186 -6.552 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.933 7.553 -4.954 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.542 8.659 -4.865 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.294 6.950 -5.296 1.00 0.00 H new ATOM 1258 N ARG A 80 2.215 7.910 -9.812 1.00 0.00 N ATOM 1259 CA ARG A 80 2.445 8.159 -11.230 1.00 0.00 C ATOM 1260 C ARG A 80 1.293 8.955 -11.836 1.00 0.00 C ATOM 1261 O ARG A 80 1.510 9.939 -12.543 1.00 0.00 O ATOM 1262 CB ARG A 80 2.615 6.836 -11.981 1.00 0.00 C ATOM 1263 CG ARG A 80 3.867 6.069 -11.587 1.00 0.00 C ATOM 1264 CD ARG A 80 4.253 5.050 -12.648 1.00 0.00 C ATOM 1265 NE ARG A 80 3.573 3.772 -12.452 1.00 0.00 N ATOM 1266 CZ ARG A 80 2.351 3.513 -12.902 1.00 0.00 C ATOM 1267 NH1 ARG A 80 1.677 4.439 -13.570 1.00 0.00 N ATOM 1268 NH2 ARG A 80 1.800 2.326 -12.683 1.00 0.00 N ATOM 0 H ARG A 80 2.219 6.924 -9.550 1.00 0.00 H new ATOM 0 HA ARG A 80 3.359 8.744 -11.327 1.00 0.00 H new ATOM 0 HB2 ARG A 80 1.742 6.209 -11.798 1.00 0.00 H new ATOM 0 HB3 ARG A 80 2.644 7.037 -13.052 1.00 0.00 H new ATOM 0 HG2 ARG A 80 4.690 6.767 -11.435 1.00 0.00 H new ATOM 0 HG3 ARG A 80 3.700 5.561 -10.637 1.00 0.00 H new ATOM 0 HD2 ARG A 80 4.008 5.443 -13.635 1.00 0.00 H new ATOM 0 HD3 ARG A 80 5.332 4.894 -12.626 1.00 0.00 H new ATOM 0 HE ARG A 80 4.064 3.038 -11.941 1.00 0.00 H new ATOM 0 HH11 ARG A 80 2.097 5.353 -13.739 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.738 4.237 -13.915 1.00 0.00 H new ATOM 0 HH21 ARG A 80 2.315 1.612 -12.169 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.861 2.128 -13.029 1.00 0.00 H new ATOM 1282 N GLN A 81 0.068 8.521 -11.555 1.00 0.00 N ATOM 1283 CA GLN A 81 -1.117 9.193 -12.074 1.00 0.00 C ATOM 1284 C GLN A 81 -1.241 10.600 -11.499 1.00 0.00 C ATOM 1285 O GLN A 81 -1.121 11.589 -12.222 1.00 0.00 O ATOM 1286 CB GLN A 81 -2.373 8.383 -11.746 1.00 0.00 C ATOM 1287 CG GLN A 81 -2.744 7.375 -12.821 1.00 0.00 C ATOM 1288 CD GLN A 81 -2.713 7.969 -14.215 1.00 0.00 C ATOM 1289 OE1 GLN A 81 -3.177 9.207 -14.342 1.00 0.00 O flip ATOM 1290 NE2 GLN A 81 -2.277 7.324 -15.169 1.00 0.00 N flip ATOM 0 H GLN A 81 -0.129 7.708 -10.971 1.00 0.00 H new ATOM 0 HA GLN A 81 -1.015 9.270 -13.156 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.220 7.857 -10.804 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.208 9.067 -11.597 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.056 6.531 -12.775 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -3.741 6.985 -12.619 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -1.930 6.375 -15.027 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -2.263 7.738 -16.101 1.00 0.00 H new ATOM 1299 N SER A 82 -1.483 10.682 -10.195 1.00 0.00 N ATOM 1300 CA SER A 82 -1.627 11.968 -9.523 1.00 0.00 C ATOM 1301 C SER A 82 -0.519 12.929 -9.945 1.00 0.00 C ATOM 1302 O SER A 82 -0.772 14.101 -10.224 1.00 0.00 O ATOM 1303 CB SER A 82 -1.603 11.780 -8.005 1.00 0.00 C ATOM 1304 OG SER A 82 -0.526 10.947 -7.611 1.00 0.00 O ATOM 0 H SER A 82 -1.584 9.873 -9.582 1.00 0.00 H new ATOM 0 HA SER A 82 -2.586 12.396 -9.814 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.514 12.750 -7.517 1.00 0.00 H new ATOM 0 HB3 SER A 82 -2.545 11.342 -7.675 1.00 0.00 H new ATOM 0 HG SER A 82 0.074 11.446 -7.018 1.00 0.00 H new ATOM 1310 N ARG A 83 0.709 12.423 -9.991 1.00 0.00 N ATOM 1311 CA ARG A 83 1.856 13.235 -10.378 1.00 0.00 C ATOM 1312 C ARG A 83 1.674 13.797 -11.785 1.00 0.00 C ATOM 1313 O ARG A 83 2.185 14.870 -12.107 1.00 0.00 O ATOM 1314 CB ARG A 83 3.140 12.407 -10.311 1.00 0.00 C ATOM 1315 CG ARG A 83 4.377 13.163 -10.767 1.00 0.00 C ATOM 1316 CD ARG A 83 5.429 12.220 -11.332 1.00 0.00 C ATOM 1317 NE ARG A 83 6.623 12.935 -11.775 1.00 0.00 N ATOM 1318 CZ ARG A 83 7.499 13.487 -10.943 1.00 0.00 C ATOM 1319 NH1 ARG A 83 7.316 13.406 -9.632 1.00 0.00 N ATOM 1320 NH2 ARG A 83 8.562 14.121 -11.422 1.00 0.00 N ATOM 0 H ARG A 83 0.935 11.454 -9.765 1.00 0.00 H new ATOM 0 HA ARG A 83 1.932 14.068 -9.679 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.290 12.067 -9.286 1.00 0.00 H new ATOM 0 HB3 ARG A 83 3.021 11.517 -10.928 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.099 13.895 -11.525 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.797 13.717 -9.927 1.00 0.00 H new ATOM 0 HD2 ARG A 83 5.705 11.488 -10.573 1.00 0.00 H new ATOM 0 HD3 ARG A 83 5.006 11.666 -12.170 1.00 0.00 H new ATOM 0 HE ARG A 83 6.793 13.015 -12.777 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.501 12.919 -9.260 1.00 0.00 H new ATOM 0 HH12 ARG A 83 7.991 13.831 -8.996 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.707 14.185 -12.430 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.234 14.545 -10.782 1.00 0.00 H new ATOM 1334 N HIS A 84 0.943 13.065 -12.619 1.00 0.00 N ATOM 1335 CA HIS A 84 0.693 13.491 -13.992 1.00 0.00 C ATOM 1336 C HIS A 84 -0.623 14.257 -14.092 1.00 0.00 C ATOM 1337 O HIS A 84 -0.635 15.449 -14.400 1.00 0.00 O ATOM 1338 CB HIS A 84 0.665 12.281 -14.926 1.00 0.00 C ATOM 1339 CG HIS A 84 0.161 12.598 -16.301 1.00 0.00 C ATOM 1340 ND1 HIS A 84 -1.098 12.791 -16.759 1.00 0.00 N flip ATOM 1341 CD2 HIS A 84 0.991 12.749 -17.391 1.00 0.00 C flip ATOM 1342 CE1 HIS A 84 -1.006 13.053 -18.104 1.00 0.00 C flip ATOM 1343 NE2 HIS A 84 0.266 13.022 -18.460 1.00 0.00 N flip ATOM 0 H HIS A 84 0.513 12.174 -12.369 1.00 0.00 H new ATOM 0 HA HIS A 84 1.503 14.155 -14.294 1.00 0.00 H new ATOM 0 HB2 HIS A 84 1.671 11.868 -15.003 1.00 0.00 H new ATOM 0 HB3 HIS A 84 0.035 11.507 -14.486 1.00 0.00 H new ATOM 0 HD2 HIS A 84 2.067 12.658 -17.373 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -1.838 13.252 -18.763 1.00 0.00 H new ATOM 0 HE2 HIS A 84 0.626 13.182 -19.401 1.00 0.00 H new ATOM 1351 N GLN A 85 -1.727 13.565 -13.832 1.00 0.00 N ATOM 1352 CA GLN A 85 -3.047 14.181 -13.894 1.00 0.00 C ATOM 1353 C GLN A 85 -3.029 15.572 -13.269 1.00 0.00 C ATOM 1354 O GLN A 85 -3.337 16.564 -13.929 1.00 0.00 O ATOM 1355 CB GLN A 85 -4.077 13.302 -13.183 1.00 0.00 C ATOM 1356 CG GLN A 85 -4.748 12.289 -14.097 1.00 0.00 C ATOM 1357 CD GLN A 85 -6.168 11.971 -13.673 1.00 0.00 C ATOM 1358 OE1 GLN A 85 -6.324 10.935 -12.856 1.00 0.00 O flip ATOM 1359 NE2 GLN A 85 -7.115 12.647 -14.074 1.00 0.00 N flip ATOM 0 H GLN A 85 -1.734 12.578 -13.576 1.00 0.00 H new ATOM 0 HA GLN A 85 -3.326 14.278 -14.943 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -3.588 12.773 -12.365 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -4.841 13.940 -12.738 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -4.755 12.674 -15.117 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -4.162 11.370 -14.107 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -6.950 13.435 -14.701 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -8.065 12.420 -13.779 1.00 0.00 H new ATOM 1449 N ASP A 91 0.934 16.872 -7.096 1.00 0.00 N ATOM 1450 CA ASP A 91 0.866 15.545 -6.495 1.00 0.00 C ATOM 1451 C ASP A 91 0.742 15.641 -4.978 1.00 0.00 C ATOM 1452 O ASP A 91 1.176 16.619 -4.369 1.00 0.00 O ATOM 1453 CB ASP A 91 2.106 14.730 -6.867 1.00 0.00 C ATOM 1454 CG ASP A 91 1.906 13.242 -6.653 1.00 0.00 C ATOM 1455 OD1 ASP A 91 0.951 12.869 -5.940 1.00 0.00 O ATOM 1456 OD2 ASP A 91 2.705 12.451 -7.197 1.00 0.00 O ATOM 0 HA ASP A 91 -0.020 15.042 -6.883 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.358 14.913 -7.912 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.953 15.069 -6.271 1.00 0.00 H new ATOM 1461 N VAL A 92 0.145 14.619 -4.372 1.00 0.00 N ATOM 1462 CA VAL A 92 -0.037 14.588 -2.926 1.00 0.00 C ATOM 1463 C VAL A 92 0.465 13.275 -2.337 1.00 0.00 C ATOM 1464 O VAL A 92 0.974 13.239 -1.216 1.00 0.00 O ATOM 1465 CB VAL A 92 -1.517 14.778 -2.542 1.00 0.00 C ATOM 1466 CG1 VAL A 92 -2.015 16.142 -2.994 1.00 0.00 C ATOM 1467 CG2 VAL A 92 -2.368 13.666 -3.137 1.00 0.00 C ATOM 0 H VAL A 92 -0.221 13.802 -4.861 1.00 0.00 H new ATOM 0 HA VAL A 92 0.546 15.413 -2.516 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.602 14.729 -1.456 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.062 16.258 -2.714 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.423 16.922 -2.516 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.917 16.225 -4.076 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.410 13.816 -2.856 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.279 13.681 -4.223 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.025 12.703 -2.759 1.00 0.00 H new ATOM 1477 N PHE A 93 0.319 12.197 -3.100 1.00 0.00 N ATOM 1478 CA PHE A 93 0.758 10.879 -2.653 1.00 0.00 C ATOM 1479 C PHE A 93 2.278 10.765 -2.709 1.00 0.00 C ATOM 1480 O PHE A 93 2.886 10.041 -1.921 1.00 0.00 O ATOM 1481 CB PHE A 93 0.121 9.787 -3.516 1.00 0.00 C ATOM 1482 CG PHE A 93 -1.374 9.895 -3.612 1.00 0.00 C ATOM 1483 CD1 PHE A 93 -1.962 10.775 -4.507 1.00 0.00 C ATOM 1484 CD2 PHE A 93 -2.192 9.117 -2.809 1.00 0.00 C ATOM 1485 CE1 PHE A 93 -3.337 10.877 -4.597 1.00 0.00 C ATOM 1486 CE2 PHE A 93 -3.568 9.214 -2.895 1.00 0.00 C ATOM 1487 CZ PHE A 93 -4.141 10.095 -3.791 1.00 0.00 C ATOM 0 H PHE A 93 -0.099 12.209 -4.030 1.00 0.00 H new ATOM 0 HA PHE A 93 0.439 10.748 -1.619 1.00 0.00 H new ATOM 0 HB2 PHE A 93 0.546 9.833 -4.519 1.00 0.00 H new ATOM 0 HB3 PHE A 93 0.381 8.812 -3.104 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -1.338 11.388 -5.141 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -1.749 8.426 -2.107 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.783 11.568 -5.297 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -4.194 8.602 -2.263 1.00 0.00 H new ATOM 0 HZ PHE A 93 -5.216 10.172 -3.861 1.00 0.00 H new ATOM 1497 N ALA A 94 2.886 11.484 -3.646 1.00 0.00 N ATOM 1498 CA ALA A 94 4.335 11.465 -3.805 1.00 0.00 C ATOM 1499 C ALA A 94 5.029 12.036 -2.573 1.00 0.00 C ATOM 1500 O ALA A 94 5.817 11.364 -1.907 1.00 0.00 O ATOM 1501 CB ALA A 94 4.741 12.240 -5.049 1.00 0.00 C ATOM 0 H ALA A 94 2.397 12.088 -4.307 1.00 0.00 H new ATOM 0 HA ALA A 94 4.649 10.428 -3.919 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.826 12.217 -5.154 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.281 11.786 -5.927 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.407 13.274 -4.959 1.00 0.00 H new ATOM 1507 N PRO A 95 4.733 13.307 -2.262 1.00 0.00 N ATOM 1508 CA PRO A 95 5.318 13.997 -1.109 1.00 0.00 C ATOM 1509 C PRO A 95 4.803 13.449 0.218 1.00 0.00 C ATOM 1510 O PRO A 95 5.470 13.559 1.247 1.00 0.00 O ATOM 1511 CB PRO A 95 4.870 15.448 -1.298 1.00 0.00 C ATOM 1512 CG PRO A 95 3.623 15.356 -2.108 1.00 0.00 C ATOM 1513 CD PRO A 95 3.803 14.168 -3.012 1.00 0.00 C ATOM 0 HA PRO A 95 6.400 13.873 -1.067 1.00 0.00 H new ATOM 0 HB2 PRO A 95 4.685 15.933 -0.340 1.00 0.00 H new ATOM 0 HB3 PRO A 95 5.633 16.034 -1.810 1.00 0.00 H new ATOM 0 HG2 PRO A 95 2.750 15.230 -1.468 1.00 0.00 H new ATOM 0 HG3 PRO A 95 3.465 16.266 -2.687 1.00 0.00 H new ATOM 0 HD2 PRO A 95 2.856 13.664 -3.206 1.00 0.00 H new ATOM 0 HD3 PRO A 95 4.214 14.457 -3.979 1.00 0.00 H new ATOM 1521 N ARG A 96 3.614 12.857 0.186 1.00 0.00 N ATOM 1522 CA ARG A 96 3.009 12.292 1.387 1.00 0.00 C ATOM 1523 C ARG A 96 3.617 10.930 1.712 1.00 0.00 C ATOM 1524 O ARG A 96 3.891 10.623 2.872 1.00 0.00 O ATOM 1525 CB ARG A 96 1.496 12.157 1.207 1.00 0.00 C ATOM 1526 CG ARG A 96 0.806 11.454 2.363 1.00 0.00 C ATOM 1527 CD ARG A 96 0.443 12.429 3.472 1.00 0.00 C ATOM 1528 NE ARG A 96 -0.354 11.796 4.520 1.00 0.00 N ATOM 1529 CZ ARG A 96 0.137 10.916 5.385 1.00 0.00 C ATOM 1530 NH1 ARG A 96 1.415 10.567 5.329 1.00 0.00 N ATOM 1531 NH2 ARG A 96 -0.651 10.383 6.310 1.00 0.00 N ATOM 0 H ARG A 96 3.050 12.756 -0.658 1.00 0.00 H new ATOM 0 HA ARG A 96 3.210 12.969 2.218 1.00 0.00 H new ATOM 0 HB2 ARG A 96 1.063 13.150 1.086 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.296 11.608 0.287 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -0.096 10.959 2.003 1.00 0.00 H new ATOM 0 HG3 ARG A 96 1.459 10.677 2.760 1.00 0.00 H new ATOM 0 HD2 ARG A 96 1.355 12.838 3.907 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -0.113 13.267 3.050 1.00 0.00 H new ATOM 0 HE ARG A 96 -1.341 12.043 4.591 1.00 0.00 H new ATOM 0 HH11 ARG A 96 2.024 10.975 4.620 1.00 0.00 H new ATOM 0 HH12 ARG A 96 1.789 9.891 5.995 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -1.635 10.649 6.357 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.273 9.707 6.974 1.00 0.00 H new ATOM 1545 N PHE A 97 3.824 10.119 0.681 1.00 0.00 N ATOM 1546 CA PHE A 97 4.397 8.789 0.857 1.00 0.00 C ATOM 1547 C PHE A 97 5.844 8.880 1.332 1.00 0.00 C ATOM 1548 O PHE A 97 6.294 8.072 2.144 1.00 0.00 O ATOM 1549 CB PHE A 97 4.327 8.003 -0.454 1.00 0.00 C ATOM 1550 CG PHE A 97 3.009 7.314 -0.670 1.00 0.00 C ATOM 1551 CD1 PHE A 97 2.420 6.582 0.349 1.00 0.00 C ATOM 1552 CD2 PHE A 97 2.360 7.399 -1.891 1.00 0.00 C ATOM 1553 CE1 PHE A 97 1.209 5.947 0.152 1.00 0.00 C ATOM 1554 CE2 PHE A 97 1.148 6.766 -2.093 1.00 0.00 C ATOM 1555 CZ PHE A 97 0.571 6.040 -1.069 1.00 0.00 C ATOM 0 H PHE A 97 3.604 10.359 -0.286 1.00 0.00 H new ATOM 0 HA PHE A 97 3.815 8.267 1.617 1.00 0.00 H new ATOM 0 HB2 PHE A 97 4.514 8.682 -1.286 1.00 0.00 H new ATOM 0 HB3 PHE A 97 5.123 7.259 -0.465 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.913 6.507 1.307 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.806 7.966 -2.694 1.00 0.00 H new ATOM 0 HE1 PHE A 97 0.761 5.378 0.953 1.00 0.00 H new ATOM 0 HE2 PHE A 97 0.653 6.839 -3.050 1.00 0.00 H new ATOM 0 HZ PHE A 97 -0.377 5.546 -1.223 1.00 0.00 H new ATOM 1565 N SER A 98 6.568 9.869 0.818 1.00 0.00 N ATOM 1566 CA SER A 98 7.966 10.064 1.186 1.00 0.00 C ATOM 1567 C SER A 98 8.110 10.253 2.692 1.00 0.00 C ATOM 1568 O SER A 98 9.146 9.932 3.273 1.00 0.00 O ATOM 1569 CB SER A 98 8.545 11.274 0.450 1.00 0.00 C ATOM 1570 OG SER A 98 7.880 12.467 0.829 1.00 0.00 O ATOM 0 H SER A 98 6.210 10.548 0.146 1.00 0.00 H new ATOM 0 HA SER A 98 8.521 9.172 0.895 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.609 11.362 0.669 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.452 11.128 -0.626 1.00 0.00 H new ATOM 0 HG SER A 98 6.927 12.282 0.962 1.00 0.00 H new ATOM 1576 N ASN A 99 7.063 10.778 3.319 1.00 0.00 N ATOM 1577 CA ASN A 99 7.072 11.012 4.759 1.00 0.00 C ATOM 1578 C ASN A 99 7.559 9.775 5.508 1.00 0.00 C ATOM 1579 O ASN A 99 8.622 9.791 6.127 1.00 0.00 O ATOM 1580 CB ASN A 99 5.672 11.396 5.243 1.00 0.00 C ATOM 1581 CG ASN A 99 5.213 12.729 4.686 1.00 0.00 C ATOM 1582 OD1 ASN A 99 6.025 13.542 4.244 1.00 0.00 O ATOM 1583 ND2 ASN A 99 3.905 12.960 4.704 1.00 0.00 N ATOM 0 H ASN A 99 6.197 11.050 2.853 1.00 0.00 H new ATOM 0 HA ASN A 99 7.759 11.833 4.964 1.00 0.00 H new ATOM 0 HB2 ASN A 99 4.964 10.620 4.951 1.00 0.00 H new ATOM 0 HB3 ASN A 99 5.666 11.439 6.332 1.00 0.00 H new ATOM 0 HD21 ASN A 99 3.537 13.840 4.342 1.00 0.00 H new ATOM 0 HD22 ASN A 99 3.268 12.257 5.080 1.00 0.00 H new ATOM 1590 N ASN A 100 6.774 8.704 5.445 1.00 0.00 N ATOM 1591 CA ASN A 100 7.126 7.459 6.117 1.00 0.00 C ATOM 1592 C ASN A 100 7.429 6.360 5.103 1.00 0.00 C ATOM 1593 O ASN A 100 7.462 5.178 5.444 1.00 0.00 O ATOM 1594 CB ASN A 100 5.990 7.015 7.042 1.00 0.00 C ATOM 1595 CG ASN A 100 5.299 8.187 7.711 1.00 0.00 C ATOM 1596 OD1 ASN A 100 4.209 8.593 7.307 1.00 0.00 O ATOM 1597 ND2 ASN A 100 5.932 8.737 8.741 1.00 0.00 N ATOM 0 H ASN A 100 5.891 8.674 4.936 1.00 0.00 H new ATOM 0 HA ASN A 100 8.022 7.637 6.712 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.259 6.445 6.468 1.00 0.00 H new ATOM 0 HB3 ASN A 100 6.387 6.346 7.806 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.516 9.529 9.231 1.00 0.00 H new ATOM 0 HD22 ASN A 100 6.834 8.368 9.042 1.00 0.00 H new ATOM 1604 N ILE A 101 7.652 6.760 3.855 1.00 0.00 N ATOM 1605 CA ILE A 101 7.954 5.810 2.792 1.00 0.00 C ATOM 1606 C ILE A 101 8.763 4.630 3.322 1.00 0.00 C ATOM 1607 O ILE A 101 8.522 3.482 2.948 1.00 0.00 O ATOM 1608 CB ILE A 101 8.735 6.479 1.645 1.00 0.00 C ATOM 1609 CG1 ILE A 101 9.049 5.457 0.550 1.00 0.00 C ATOM 1610 CG2 ILE A 101 10.015 7.109 2.172 1.00 0.00 C ATOM 1611 CD1 ILE A 101 7.983 5.372 -0.521 1.00 0.00 C ATOM 0 H ILE A 101 7.629 7.735 3.556 1.00 0.00 H new ATOM 0 HA ILE A 101 6.999 5.450 2.410 1.00 0.00 H new ATOM 0 HB ILE A 101 8.117 7.267 1.215 1.00 0.00 H new ATOM 0 HG12 ILE A 101 10.000 5.716 0.085 1.00 0.00 H new ATOM 0 HG13 ILE A 101 9.174 4.475 1.006 1.00 0.00 H new ATOM 0 HG21 ILE A 101 10.555 7.577 1.349 1.00 0.00 H new ATOM 0 HG22 ILE A 101 9.768 7.862 2.920 1.00 0.00 H new ATOM 0 HG23 ILE A 101 10.640 6.339 2.625 1.00 0.00 H new ATOM 0 HD11 ILE A 101 8.272 4.628 -1.264 1.00 0.00 H new ATOM 0 HD12 ILE A 101 7.035 5.083 -0.068 1.00 0.00 H new ATOM 0 HD13 ILE A 101 7.874 6.343 -1.004 1.00 0.00 H new ATOM 1623 N ILE A 102 9.720 4.922 4.195 1.00 0.00 N ATOM 1624 CA ILE A 102 10.562 3.885 4.779 1.00 0.00 C ATOM 1625 C ILE A 102 9.725 2.854 5.528 1.00 0.00 C ATOM 1626 O ILE A 102 9.749 1.666 5.205 1.00 0.00 O ATOM 1627 CB ILE A 102 11.604 4.482 5.743 1.00 0.00 C ATOM 1628 CG1 ILE A 102 12.414 5.574 5.041 1.00 0.00 C ATOM 1629 CG2 ILE A 102 12.523 3.391 6.272 1.00 0.00 C ATOM 1630 CD1 ILE A 102 13.379 5.040 4.006 1.00 0.00 C ATOM 0 H ILE A 102 9.932 5.867 4.514 1.00 0.00 H new ATOM 0 HA ILE A 102 11.080 3.398 3.953 1.00 0.00 H new ATOM 0 HB ILE A 102 11.081 4.930 6.588 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.728 6.272 4.561 1.00 0.00 H new ATOM 0 HG13 ILE A 102 12.971 6.139 5.788 1.00 0.00 H new ATOM 0 HG21 ILE A 102 13.254 3.829 6.952 1.00 0.00 H new ATOM 0 HG22 ILE A 102 11.933 2.645 6.805 1.00 0.00 H new ATOM 0 HG23 ILE A 102 13.041 2.916 5.439 1.00 0.00 H new ATOM 0 HD11 ILE A 102 13.919 5.870 3.549 1.00 0.00 H new ATOM 0 HD12 ILE A 102 14.089 4.365 4.484 1.00 0.00 H new ATOM 0 HD13 ILE A 102 12.826 4.500 3.237 1.00 0.00 H new ATOM 1642 N SER A 103 8.983 3.317 6.530 1.00 0.00 N ATOM 1643 CA SER A 103 8.139 2.435 7.327 1.00 0.00 C ATOM 1644 C SER A 103 7.204 1.625 6.434 1.00 0.00 C ATOM 1645 O SER A 103 6.854 0.487 6.751 1.00 0.00 O ATOM 1646 CB SER A 103 7.324 3.248 8.334 1.00 0.00 C ATOM 1647 OG SER A 103 6.996 2.470 9.472 1.00 0.00 O ATOM 0 H SER A 103 8.950 4.298 6.809 1.00 0.00 H new ATOM 0 HA SER A 103 8.786 1.744 7.867 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.892 4.126 8.641 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.411 3.609 7.861 1.00 0.00 H new ATOM 0 HG SER A 103 6.476 3.013 10.101 1.00 0.00 H new ATOM 1653 N THR A 104 6.803 2.219 5.315 1.00 0.00 N ATOM 1654 CA THR A 104 5.908 1.555 4.376 1.00 0.00 C ATOM 1655 C THR A 104 6.625 0.436 3.630 1.00 0.00 C ATOM 1656 O THR A 104 6.099 -0.668 3.491 1.00 0.00 O ATOM 1657 CB THR A 104 5.329 2.550 3.352 1.00 0.00 C ATOM 1658 OG1 THR A 104 4.457 3.477 4.009 1.00 0.00 O ATOM 1659 CG2 THR A 104 4.567 1.818 2.257 1.00 0.00 C ATOM 0 H THR A 104 7.084 3.159 5.037 1.00 0.00 H new ATOM 0 HA THR A 104 5.092 1.132 4.963 1.00 0.00 H new ATOM 0 HB THR A 104 6.158 3.092 2.896 1.00 0.00 H new ATOM 0 HG1 THR A 104 4.473 4.334 3.534 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.167 2.541 1.546 1.00 0.00 H new ATOM 0 HG22 THR A 104 5.240 1.134 1.740 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.747 1.253 2.700 1.00 0.00 H new ATOM 1667 N PHE A 105 7.831 0.727 3.152 1.00 0.00 N ATOM 1668 CA PHE A 105 8.621 -0.255 2.420 1.00 0.00 C ATOM 1669 C PHE A 105 9.068 -1.388 3.339 1.00 0.00 C ATOM 1670 O PHE A 105 9.136 -2.545 2.926 1.00 0.00 O ATOM 1671 CB PHE A 105 9.842 0.413 1.783 1.00 0.00 C ATOM 1672 CG PHE A 105 9.588 0.927 0.395 1.00 0.00 C ATOM 1673 CD1 PHE A 105 8.528 1.783 0.142 1.00 0.00 C ATOM 1674 CD2 PHE A 105 10.409 0.554 -0.657 1.00 0.00 C ATOM 1675 CE1 PHE A 105 8.292 2.258 -1.134 1.00 0.00 C ATOM 1676 CE2 PHE A 105 10.178 1.027 -1.935 1.00 0.00 C ATOM 1677 CZ PHE A 105 9.118 1.879 -2.174 1.00 0.00 C ATOM 0 H PHE A 105 8.282 1.636 3.259 1.00 0.00 H new ATOM 0 HA PHE A 105 7.994 -0.675 1.633 1.00 0.00 H new ATOM 0 HB2 PHE A 105 10.164 1.241 2.415 1.00 0.00 H new ATOM 0 HB3 PHE A 105 10.663 -0.303 1.752 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.879 2.082 0.952 1.00 0.00 H new ATOM 0 HD2 PHE A 105 11.238 -0.114 -0.476 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.463 2.925 -1.318 1.00 0.00 H new ATOM 0 HE2 PHE A 105 10.826 0.730 -2.746 1.00 0.00 H new ATOM 0 HZ PHE A 105 8.935 2.248 -3.172 1.00 0.00 H new ATOM 1687 N GLN A 106 9.374 -1.044 4.586 1.00 0.00 N ATOM 1688 CA GLN A 106 9.816 -2.031 5.564 1.00 0.00 C ATOM 1689 C GLN A 106 8.868 -3.226 5.598 1.00 0.00 C ATOM 1690 O GLN A 106 9.301 -4.376 5.533 1.00 0.00 O ATOM 1691 CB GLN A 106 9.908 -1.399 6.953 1.00 0.00 C ATOM 1692 CG GLN A 106 10.991 -0.338 7.068 1.00 0.00 C ATOM 1693 CD GLN A 106 12.343 -0.922 7.427 1.00 0.00 C ATOM 1694 OE1 GLN A 106 12.432 -1.909 8.158 1.00 0.00 O ATOM 1695 NE2 GLN A 106 13.406 -0.314 6.913 1.00 0.00 N ATOM 0 H GLN A 106 9.324 -0.090 4.943 1.00 0.00 H new ATOM 0 HA GLN A 106 10.804 -2.382 5.267 1.00 0.00 H new ATOM 0 HB2 GLN A 106 8.946 -0.953 7.205 1.00 0.00 H new ATOM 0 HB3 GLN A 106 10.098 -2.182 7.687 1.00 0.00 H new ATOM 0 HG2 GLN A 106 11.071 0.199 6.123 1.00 0.00 H new ATOM 0 HG3 GLN A 106 10.702 0.391 7.825 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.286 0.501 6.312 1.00 0.00 H new ATOM 0 HE22 GLN A 106 14.342 -0.662 7.119 1.00 0.00 H new ATOM 1704 N ASN A 107 7.573 -2.945 5.700 1.00 0.00 N ATOM 1705 CA ASN A 107 6.564 -3.997 5.744 1.00 0.00 C ATOM 1706 C ASN A 107 6.533 -4.775 4.432 1.00 0.00 C ATOM 1707 O ASN A 107 5.998 -5.883 4.367 1.00 0.00 O ATOM 1708 CB ASN A 107 5.185 -3.398 6.028 1.00 0.00 C ATOM 1709 CG ASN A 107 5.171 -2.551 7.286 1.00 0.00 C ATOM 1710 OD1 ASN A 107 6.153 -2.503 8.026 1.00 0.00 O ATOM 1711 ND2 ASN A 107 4.053 -1.878 7.533 1.00 0.00 N ATOM 0 H ASN A 107 7.198 -1.998 5.754 1.00 0.00 H new ATOM 0 HA ASN A 107 6.826 -4.685 6.548 1.00 0.00 H new ATOM 0 HB2 ASN A 107 4.875 -2.788 5.179 1.00 0.00 H new ATOM 0 HB3 ASN A 107 4.456 -4.202 6.126 1.00 0.00 H new ATOM 0 HD21 ASN A 107 3.984 -1.291 8.365 1.00 0.00 H new ATOM 0 HD22 ASN A 107 3.263 -1.948 6.891 1.00 0.00 H new ATOM 1718 N LEU A 108 7.108 -4.189 3.388 1.00 0.00 N ATOM 1719 CA LEU A 108 7.147 -4.827 2.077 1.00 0.00 C ATOM 1720 C LEU A 108 8.429 -5.635 1.903 1.00 0.00 C ATOM 1721 O LEU A 108 8.433 -6.678 1.248 1.00 0.00 O ATOM 1722 CB LEU A 108 7.041 -3.774 0.972 1.00 0.00 C ATOM 1723 CG LEU A 108 5.839 -2.832 1.056 1.00 0.00 C ATOM 1724 CD1 LEU A 108 6.073 -1.591 0.208 1.00 0.00 C ATOM 1725 CD2 LEU A 108 4.569 -3.548 0.619 1.00 0.00 C ATOM 0 H LEU A 108 7.554 -3.272 3.424 1.00 0.00 H new ATOM 0 HA LEU A 108 6.298 -5.507 2.006 1.00 0.00 H new ATOM 0 HB2 LEU A 108 7.950 -3.173 0.982 1.00 0.00 H new ATOM 0 HB3 LEU A 108 7.009 -4.287 0.011 1.00 0.00 H new ATOM 0 HG LEU A 108 5.718 -2.520 2.093 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.207 -0.933 0.280 1.00 0.00 H new ATOM 0 HD12 LEU A 108 6.959 -1.067 0.567 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.221 -1.883 -0.832 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.724 -2.863 0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.680 -3.889 -0.410 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.393 -4.405 1.269 1.00 0.00 H new ATOM 1737 N TYR A 109 9.514 -5.149 2.494 1.00 0.00 N ATOM 1738 CA TYR A 109 10.802 -5.826 2.404 1.00 0.00 C ATOM 1739 C TYR A 109 10.838 -7.051 3.312 1.00 0.00 C ATOM 1740 O TYR A 109 11.853 -7.742 3.402 1.00 0.00 O ATOM 1741 CB TYR A 109 11.933 -4.867 2.779 1.00 0.00 C ATOM 1742 CG TYR A 109 12.278 -3.881 1.685 1.00 0.00 C ATOM 1743 CD1 TYR A 109 12.468 -4.304 0.376 1.00 0.00 C ATOM 1744 CD2 TYR A 109 12.411 -2.526 1.962 1.00 0.00 C ATOM 1745 CE1 TYR A 109 12.784 -3.406 -0.626 1.00 0.00 C ATOM 1746 CE2 TYR A 109 12.725 -1.621 0.966 1.00 0.00 C ATOM 1747 CZ TYR A 109 12.911 -2.066 -0.326 1.00 0.00 C ATOM 1748 OH TYR A 109 13.224 -1.169 -1.321 1.00 0.00 O ATOM 0 H TYR A 109 9.528 -4.288 3.041 1.00 0.00 H new ATOM 0 HA TYR A 109 10.939 -6.155 1.374 1.00 0.00 H new ATOM 0 HB2 TYR A 109 11.649 -4.317 3.676 1.00 0.00 H new ATOM 0 HB3 TYR A 109 12.822 -5.446 3.028 1.00 0.00 H new ATOM 0 HD1 TYR A 109 12.367 -5.352 0.137 1.00 0.00 H new ATOM 0 HD2 TYR A 109 12.267 -2.174 2.973 1.00 0.00 H new ATOM 0 HE1 TYR A 109 12.931 -3.752 -1.639 1.00 0.00 H new ATOM 0 HE2 TYR A 109 12.824 -0.571 1.198 1.00 0.00 H new ATOM 0 HH TYR A 109 13.714 -0.412 -0.937 1.00 0.00 H new ATOM 1758 N ARG A 110 9.722 -7.315 3.984 1.00 0.00 N ATOM 1759 CA ARG A 110 9.624 -8.456 4.886 1.00 0.00 C ATOM 1760 C ARG A 110 9.473 -9.757 4.102 1.00 0.00 C ATOM 1761 O ARG A 110 9.696 -10.844 4.636 1.00 0.00 O ATOM 1762 CB ARG A 110 8.439 -8.281 5.837 1.00 0.00 C ATOM 1763 CG ARG A 110 8.339 -6.888 6.435 1.00 0.00 C ATOM 1764 CD ARG A 110 7.643 -6.910 7.787 1.00 0.00 C ATOM 1765 NE ARG A 110 8.341 -7.762 8.747 1.00 0.00 N ATOM 1766 CZ ARG A 110 7.853 -8.074 9.943 1.00 0.00 C ATOM 1767 NH1 ARG A 110 6.671 -7.608 10.323 1.00 0.00 N ATOM 1768 NH2 ARG A 110 8.547 -8.855 10.761 1.00 0.00 N ATOM 0 H ARG A 110 8.873 -6.754 3.921 1.00 0.00 H new ATOM 0 HA ARG A 110 10.544 -8.507 5.468 1.00 0.00 H new ATOM 0 HB2 ARG A 110 7.517 -8.504 5.300 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.521 -9.009 6.644 1.00 0.00 H new ATOM 0 HG2 ARG A 110 9.338 -6.466 6.546 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.792 -6.237 5.753 1.00 0.00 H new ATOM 0 HD2 ARG A 110 7.582 -5.895 8.180 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.620 -7.266 7.663 1.00 0.00 H new ATOM 0 HE ARG A 110 9.252 -8.138 8.485 1.00 0.00 H new ATOM 0 HH11 ARG A 110 6.134 -7.008 9.697 1.00 0.00 H new ATOM 0 HH12 ARG A 110 6.299 -7.849 11.242 1.00 0.00 H new ATOM 0 HH21 ARG A 110 9.456 -9.216 10.472 1.00 0.00 H new ATOM 0 HH22 ARG A 110 8.172 -9.094 11.679 1.00 0.00 H new ATOM 1782 N CYS A 111 9.094 -9.638 2.835 1.00 0.00 N ATOM 1783 CA CYS A 111 8.912 -10.804 1.978 1.00 0.00 C ATOM 1784 C CYS A 111 10.107 -11.746 2.080 1.00 0.00 C ATOM 1785 O CYS A 111 11.214 -11.346 2.443 1.00 0.00 O ATOM 1786 CB CYS A 111 8.712 -10.369 0.525 1.00 0.00 C ATOM 1787 SG CYS A 111 10.140 -9.525 -0.195 1.00 0.00 S ATOM 0 H CYS A 111 8.907 -8.746 2.378 1.00 0.00 H new ATOM 0 HA CYS A 111 8.023 -11.337 2.316 1.00 0.00 H new ATOM 0 HB2 CYS A 111 8.481 -11.247 -0.078 1.00 0.00 H new ATOM 0 HB3 CYS A 111 7.847 -9.708 0.470 1.00 0.00 H new ATOM 0 HG CYS A 111 9.876 -9.198 -1.425 1.00 0.00 H new ATOM 1793 N PRO A 112 9.880 -13.027 1.755 1.00 0.00 N ATOM 1794 CA PRO A 112 10.927 -14.053 1.804 1.00 0.00 C ATOM 1795 C PRO A 112 12.212 -13.603 1.119 1.00 0.00 C ATOM 1796 O PRO A 112 13.298 -14.090 1.433 1.00 0.00 O ATOM 1797 CB PRO A 112 10.303 -15.231 1.051 1.00 0.00 C ATOM 1798 CG PRO A 112 8.834 -15.047 1.208 1.00 0.00 C ATOM 1799 CD PRO A 112 8.586 -13.573 1.315 1.00 0.00 C ATOM 0 HA PRO A 112 11.219 -14.290 2.827 1.00 0.00 H new ATOM 0 HB2 PRO A 112 10.592 -15.227 0.000 1.00 0.00 H new ATOM 0 HB3 PRO A 112 10.629 -16.184 1.467 1.00 0.00 H new ATOM 0 HG2 PRO A 112 8.300 -15.467 0.356 1.00 0.00 H new ATOM 0 HG3 PRO A 112 8.473 -15.564 2.097 1.00 0.00 H new ATOM 0 HD2 PRO A 112 8.278 -13.149 0.359 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.795 -13.352 2.031 1.00 0.00 H new ATOM 1807 N GLY A 113 12.083 -12.668 0.182 1.00 0.00 N ATOM 1808 CA GLY A 113 13.243 -12.168 -0.532 1.00 0.00 C ATOM 1809 C GLY A 113 13.143 -12.390 -2.028 1.00 0.00 C ATOM 1810 O GLY A 113 13.634 -11.582 -2.817 1.00 0.00 O ATOM 0 H GLY A 113 11.196 -12.248 -0.095 1.00 0.00 H new ATOM 0 HA2 GLY A 113 13.357 -11.102 -0.333 1.00 0.00 H new ATOM 0 HA3 GLY A 113 14.139 -12.661 -0.154 1.00 0.00 H new ATOM 1814 N ASP A 114 12.508 -13.489 -2.420 1.00 0.00 N ATOM 1815 CA ASP A 114 12.345 -13.816 -3.832 1.00 0.00 C ATOM 1816 C ASP A 114 11.362 -12.861 -4.501 1.00 0.00 C ATOM 1817 O ASP A 114 11.093 -12.969 -5.698 1.00 0.00 O ATOM 1818 CB ASP A 114 11.864 -15.259 -3.991 1.00 0.00 C ATOM 1819 CG ASP A 114 12.182 -15.827 -5.360 1.00 0.00 C ATOM 1820 OD1 ASP A 114 12.129 -15.064 -6.347 1.00 0.00 O ATOM 1821 OD2 ASP A 114 12.485 -17.036 -5.444 1.00 0.00 O ATOM 0 H ASP A 114 12.098 -14.169 -1.780 1.00 0.00 H new ATOM 0 HA ASP A 114 13.314 -13.709 -4.319 1.00 0.00 H new ATOM 0 HB2 ASP A 114 12.329 -15.880 -3.226 1.00 0.00 H new ATOM 0 HB3 ASP A 114 10.788 -15.301 -3.824 1.00 0.00 H new ATOM 1826 N ASP A 115 10.827 -11.928 -3.721 1.00 0.00 N ATOM 1827 CA ASP A 115 9.873 -10.954 -4.238 1.00 0.00 C ATOM 1828 C ASP A 115 10.430 -9.538 -4.132 1.00 0.00 C ATOM 1829 O ASP A 115 9.868 -8.595 -4.689 1.00 0.00 O ATOM 1830 CB ASP A 115 8.549 -11.053 -3.479 1.00 0.00 C ATOM 1831 CG ASP A 115 7.879 -12.401 -3.657 1.00 0.00 C ATOM 1832 OD1 ASP A 115 8.237 -13.343 -2.919 1.00 0.00 O ATOM 1833 OD2 ASP A 115 6.996 -12.515 -4.533 1.00 0.00 O ATOM 0 H ASP A 115 11.038 -11.826 -2.728 1.00 0.00 H new ATOM 0 HA ASP A 115 9.697 -11.178 -5.290 1.00 0.00 H new ATOM 0 HB2 ASP A 115 8.728 -10.877 -2.418 1.00 0.00 H new ATOM 0 HB3 ASP A 115 7.876 -10.268 -3.824 1.00 0.00 H new ATOM 1838 N LYS A 116 11.538 -9.396 -3.413 1.00 0.00 N ATOM 1839 CA LYS A 116 12.173 -8.096 -3.233 1.00 0.00 C ATOM 1840 C LYS A 116 12.411 -7.416 -4.577 1.00 0.00 C ATOM 1841 O LYS A 116 12.326 -6.193 -4.688 1.00 0.00 O ATOM 1842 CB LYS A 116 13.499 -8.252 -2.486 1.00 0.00 C ATOM 1843 CG LYS A 116 13.365 -8.144 -0.977 1.00 0.00 C ATOM 1844 CD LYS A 116 14.672 -8.472 -0.275 1.00 0.00 C ATOM 1845 CE LYS A 116 14.592 -8.184 1.216 1.00 0.00 C ATOM 1846 NZ LYS A 116 15.783 -8.700 1.945 1.00 0.00 N ATOM 0 H LYS A 116 12.015 -10.166 -2.945 1.00 0.00 H new ATOM 0 HA LYS A 116 11.503 -7.471 -2.643 1.00 0.00 H new ATOM 0 HB2 LYS A 116 13.935 -9.220 -2.735 1.00 0.00 H new ATOM 0 HB3 LYS A 116 14.195 -7.490 -2.836 1.00 0.00 H new ATOM 0 HG2 LYS A 116 13.051 -7.135 -0.710 1.00 0.00 H new ATOM 0 HG3 LYS A 116 12.585 -8.822 -0.631 1.00 0.00 H new ATOM 0 HD2 LYS A 116 14.916 -9.523 -0.431 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.480 -7.888 -0.716 1.00 0.00 H new ATOM 0 HE2 LYS A 116 14.507 -7.109 1.374 1.00 0.00 H new ATOM 0 HE3 LYS A 116 13.690 -8.639 1.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 15.690 -8.484 2.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 15.850 -9.730 1.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 16.642 -8.247 1.572 1.00 0.00 H new ATOM 1860 N SER A 117 12.708 -8.216 -5.596 1.00 0.00 N ATOM 1861 CA SER A 117 12.960 -7.691 -6.932 1.00 0.00 C ATOM 1862 C SER A 117 11.827 -6.771 -7.377 1.00 0.00 C ATOM 1863 O SER A 117 12.065 -5.676 -7.889 1.00 0.00 O ATOM 1864 CB SER A 117 13.123 -8.837 -7.932 1.00 0.00 C ATOM 1865 OG SER A 117 13.852 -8.420 -9.073 1.00 0.00 O ATOM 0 H SER A 117 12.780 -9.231 -5.521 1.00 0.00 H new ATOM 0 HA SER A 117 13.883 -7.113 -6.899 1.00 0.00 H new ATOM 0 HB2 SER A 117 13.637 -9.671 -7.453 1.00 0.00 H new ATOM 0 HB3 SER A 117 12.141 -9.200 -8.237 1.00 0.00 H new ATOM 0 HG SER A 117 13.943 -9.171 -9.695 1.00 0.00 H new ATOM 1871 N LYS A 118 10.594 -7.222 -7.178 1.00 0.00 N ATOM 1872 CA LYS A 118 9.422 -6.442 -7.556 1.00 0.00 C ATOM 1873 C LYS A 118 9.358 -5.139 -6.766 1.00 0.00 C ATOM 1874 O LYS A 118 8.657 -4.202 -7.151 1.00 0.00 O ATOM 1875 CB LYS A 118 8.146 -7.254 -7.325 1.00 0.00 C ATOM 1876 CG LYS A 118 7.786 -8.164 -8.487 1.00 0.00 C ATOM 1877 CD LYS A 118 8.433 -9.531 -8.345 1.00 0.00 C ATOM 1878 CE LYS A 118 7.690 -10.586 -9.150 1.00 0.00 C ATOM 1879 NZ LYS A 118 6.538 -11.151 -8.394 1.00 0.00 N ATOM 0 H LYS A 118 10.380 -8.126 -6.756 1.00 0.00 H new ATOM 0 HA LYS A 118 9.504 -6.201 -8.616 1.00 0.00 H new ATOM 0 HB2 LYS A 118 8.267 -7.858 -6.426 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.318 -6.570 -7.140 1.00 0.00 H new ATOM 0 HG2 LYS A 118 6.703 -8.277 -8.540 1.00 0.00 H new ATOM 0 HG3 LYS A 118 8.105 -7.705 -9.423 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.469 -9.480 -8.679 1.00 0.00 H new ATOM 0 HD3 LYS A 118 8.450 -9.819 -7.294 1.00 0.00 H new ATOM 0 HE2 LYS A 118 7.333 -10.147 -10.082 1.00 0.00 H new ATOM 0 HE3 LYS A 118 8.377 -11.389 -9.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 6.058 -11.866 -8.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 6.881 -11.592 -7.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 5.869 -10.390 -8.160 1.00 0.00 H new ATOM 1893 N ILE A 119 10.094 -5.086 -5.661 1.00 0.00 N ATOM 1894 CA ILE A 119 10.122 -3.896 -4.819 1.00 0.00 C ATOM 1895 C ILE A 119 11.233 -2.944 -5.249 1.00 0.00 C ATOM 1896 O ILE A 119 11.064 -1.725 -5.228 1.00 0.00 O ATOM 1897 CB ILE A 119 10.320 -4.261 -3.336 1.00 0.00 C ATOM 1898 CG1 ILE A 119 9.288 -5.304 -2.903 1.00 0.00 C ATOM 1899 CG2 ILE A 119 10.221 -3.017 -2.466 1.00 0.00 C ATOM 1900 CD1 ILE A 119 9.552 -5.882 -1.530 1.00 0.00 C ATOM 0 H ILE A 119 10.679 -5.853 -5.328 1.00 0.00 H new ATOM 0 HA ILE A 119 9.158 -3.402 -4.938 1.00 0.00 H new ATOM 0 HB ILE A 119 11.315 -4.688 -3.212 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.298 -4.849 -2.912 1.00 0.00 H new ATOM 0 HG13 ILE A 119 9.274 -6.114 -3.633 1.00 0.00 H new ATOM 0 HG21 ILE A 119 10.363 -3.292 -1.421 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.991 -2.304 -2.762 1.00 0.00 H new ATOM 0 HG23 ILE A 119 9.238 -2.563 -2.591 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.781 -6.614 -1.289 1.00 0.00 H new ATOM 0 HD12 ILE A 119 10.528 -6.367 -1.521 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.537 -5.082 -0.790 1.00 0.00 H new ATOM 1912 N VAL A 120 12.371 -3.509 -5.642 1.00 0.00 N ATOM 1913 CA VAL A 120 13.509 -2.711 -6.081 1.00 0.00 C ATOM 1914 C VAL A 120 13.331 -2.245 -7.521 1.00 0.00 C ATOM 1915 O VAL A 120 14.004 -1.318 -7.972 1.00 0.00 O ATOM 1916 CB VAL A 120 14.826 -3.502 -5.967 1.00 0.00 C ATOM 1917 CG1 VAL A 120 14.885 -4.255 -4.647 1.00 0.00 C ATOM 1918 CG2 VAL A 120 14.976 -4.457 -7.142 1.00 0.00 C ATOM 0 H VAL A 120 12.529 -4.516 -5.665 1.00 0.00 H new ATOM 0 HA VAL A 120 13.558 -1.842 -5.425 1.00 0.00 H new ATOM 0 HB VAL A 120 15.657 -2.797 -5.992 1.00 0.00 H new ATOM 0 HG11 VAL A 120 15.822 -4.808 -4.585 1.00 0.00 H new ATOM 0 HG12 VAL A 120 14.826 -3.546 -3.821 1.00 0.00 H new ATOM 0 HG13 VAL A 120 14.049 -4.952 -4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 120 15.912 -5.008 -7.046 1.00 0.00 H new ATOM 0 HG22 VAL A 120 14.141 -5.158 -7.150 1.00 0.00 H new ATOM 0 HG23 VAL A 120 14.983 -3.890 -8.073 1.00 0.00 H new ATOM 1928 N ARG A 121 12.420 -2.894 -8.239 1.00 0.00 N ATOM 1929 CA ARG A 121 12.154 -2.547 -9.630 1.00 0.00 C ATOM 1930 C ARG A 121 11.424 -1.210 -9.726 1.00 0.00 C ATOM 1931 O ARG A 121 11.592 -0.468 -10.693 1.00 0.00 O ATOM 1932 CB ARG A 121 11.324 -3.643 -10.301 1.00 0.00 C ATOM 1933 CG ARG A 121 9.826 -3.477 -10.108 1.00 0.00 C ATOM 1934 CD ARG A 121 9.042 -4.461 -10.963 1.00 0.00 C ATOM 1935 NE ARG A 121 7.744 -3.925 -11.363 1.00 0.00 N ATOM 1936 CZ ARG A 121 7.596 -2.918 -12.217 1.00 0.00 C ATOM 1937 NH1 ARG A 121 8.661 -2.342 -12.758 1.00 0.00 N ATOM 1938 NH2 ARG A 121 6.382 -2.486 -12.532 1.00 0.00 N ATOM 0 H ARG A 121 11.854 -3.663 -7.880 1.00 0.00 H new ATOM 0 HA ARG A 121 13.110 -2.458 -10.146 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.545 -3.653 -11.368 1.00 0.00 H new ATOM 0 HB3 ARG A 121 11.628 -4.612 -9.904 1.00 0.00 H new ATOM 0 HG2 ARG A 121 9.575 -3.625 -9.058 1.00 0.00 H new ATOM 0 HG3 ARG A 121 9.536 -2.458 -10.365 1.00 0.00 H new ATOM 0 HD2 ARG A 121 9.621 -4.710 -11.852 1.00 0.00 H new ATOM 0 HD3 ARG A 121 8.896 -5.388 -10.408 1.00 0.00 H new ATOM 0 HE ARG A 121 6.905 -4.347 -10.965 1.00 0.00 H new ATOM 0 HH11 ARG A 121 9.596 -2.672 -12.519 1.00 0.00 H new ATOM 0 HH12 ARG A 121 8.545 -1.569 -13.413 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.560 -2.927 -12.118 1.00 0.00 H new ATOM 0 HH22 ARG A 121 6.270 -1.713 -13.188 1.00 0.00 H new ATOM 1952 N VAL A 122 10.612 -0.911 -8.717 1.00 0.00 N ATOM 1953 CA VAL A 122 9.857 0.336 -8.687 1.00 0.00 C ATOM 1954 C VAL A 122 10.774 1.528 -8.439 1.00 0.00 C ATOM 1955 O VAL A 122 10.714 2.530 -9.153 1.00 0.00 O ATOM 1956 CB VAL A 122 8.767 0.306 -7.599 1.00 0.00 C ATOM 1957 CG1 VAL A 122 7.842 1.506 -7.736 1.00 0.00 C ATOM 1958 CG2 VAL A 122 7.980 -0.994 -7.670 1.00 0.00 C ATOM 0 H VAL A 122 10.460 -1.515 -7.909 1.00 0.00 H new ATOM 0 HA VAL A 122 9.383 0.443 -9.663 1.00 0.00 H new ATOM 0 HB VAL A 122 9.250 0.360 -6.623 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.079 1.468 -6.959 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.420 2.424 -7.632 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.364 1.487 -8.715 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.214 -0.999 -6.894 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.507 -1.080 -8.648 1.00 0.00 H new ATOM 0 HG23 VAL A 122 8.655 -1.837 -7.518 1.00 0.00 H new ATOM 1968 N LEU A 123 11.622 1.414 -7.424 1.00 0.00 N ATOM 1969 CA LEU A 123 12.554 2.483 -7.082 1.00 0.00 C ATOM 1970 C LEU A 123 13.360 2.915 -8.303 1.00 0.00 C ATOM 1971 O LEU A 123 13.531 4.106 -8.556 1.00 0.00 O ATOM 1972 CB LEU A 123 13.499 2.026 -5.969 1.00 0.00 C ATOM 1973 CG LEU A 123 12.834 1.569 -4.670 1.00 0.00 C ATOM 1974 CD1 LEU A 123 13.882 1.123 -3.662 1.00 0.00 C ATOM 1975 CD2 LEU A 123 11.975 2.684 -4.090 1.00 0.00 C ATOM 0 H LEU A 123 11.684 0.592 -6.823 1.00 0.00 H new ATOM 0 HA LEU A 123 11.975 3.337 -6.731 1.00 0.00 H new ATOM 0 HB2 LEU A 123 14.108 1.206 -6.350 1.00 0.00 H new ATOM 0 HB3 LEU A 123 14.178 2.846 -5.737 1.00 0.00 H new ATOM 0 HG LEU A 123 12.189 0.719 -4.894 1.00 0.00 H new ATOM 0 HD11 LEU A 123 13.390 0.801 -2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 123 14.456 0.294 -4.076 1.00 0.00 H new ATOM 0 HD13 LEU A 123 14.552 1.954 -3.442 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.509 2.341 -3.166 1.00 0.00 H new ATOM 0 HD22 LEU A 123 12.599 3.553 -3.881 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.201 2.957 -4.807 1.00 0.00 H new ATOM 1987 N ASN A 124 13.850 1.937 -9.058 1.00 0.00 N ATOM 1988 CA ASN A 124 14.637 2.216 -10.254 1.00 0.00 C ATOM 1989 C ASN A 124 13.821 3.014 -11.267 1.00 0.00 C ATOM 1990 O ASN A 124 14.374 3.748 -12.087 1.00 0.00 O ATOM 1991 CB ASN A 124 15.122 0.911 -10.887 1.00 0.00 C ATOM 1992 CG ASN A 124 16.412 0.411 -10.266 1.00 0.00 C ATOM 1993 OD1 ASN A 124 17.503 0.819 -10.663 1.00 0.00 O ATOM 1994 ND2 ASN A 124 16.291 -0.476 -9.285 1.00 0.00 N ATOM 0 H ASN A 124 13.716 0.945 -8.863 1.00 0.00 H new ATOM 0 HA ASN A 124 15.501 2.811 -9.960 1.00 0.00 H new ATOM 0 HB2 ASN A 124 14.350 0.149 -10.778 1.00 0.00 H new ATOM 0 HB3 ASN A 124 15.272 1.063 -11.956 1.00 0.00 H new ATOM 0 HD21 ASN A 124 17.124 -0.848 -8.828 1.00 0.00 H new ATOM 0 HD22 ASN A 124 15.365 -0.786 -8.989 1.00 0.00 H new ATOM 2001 N LEU A 125 12.502 2.864 -11.206 1.00 0.00 N ATOM 2002 CA LEU A 125 11.609 3.571 -12.117 1.00 0.00 C ATOM 2003 C LEU A 125 11.298 4.971 -11.599 1.00 0.00 C ATOM 2004 O LEU A 125 11.213 5.925 -12.372 1.00 0.00 O ATOM 2005 CB LEU A 125 10.311 2.783 -12.303 1.00 0.00 C ATOM 2006 CG LEU A 125 10.354 1.649 -13.329 1.00 0.00 C ATOM 2007 CD1 LEU A 125 9.224 0.663 -13.082 1.00 0.00 C ATOM 2008 CD2 LEU A 125 10.280 2.207 -14.743 1.00 0.00 C ATOM 0 H LEU A 125 12.028 2.259 -10.535 1.00 0.00 H new ATOM 0 HA LEU A 125 12.112 3.664 -13.080 1.00 0.00 H new ATOM 0 HB2 LEU A 125 10.023 2.363 -11.339 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.525 3.480 -12.594 1.00 0.00 H new ATOM 0 HG LEU A 125 11.300 1.119 -13.218 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.271 -0.137 -13.821 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.323 0.239 -12.083 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.267 1.178 -13.165 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.312 1.387 -15.460 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.350 2.762 -14.867 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.125 2.873 -14.916 1.00 0.00 H new ATOM 2020 N TRP A 126 11.130 5.086 -10.286 1.00 0.00 N ATOM 2021 CA TRP A 126 10.830 6.371 -9.664 1.00 0.00 C ATOM 2022 C TRP A 126 11.978 7.354 -9.865 1.00 0.00 C ATOM 2023 O TRP A 126 11.769 8.482 -10.309 1.00 0.00 O ATOM 2024 CB TRP A 126 10.557 6.186 -8.171 1.00 0.00 C ATOM 2025 CG TRP A 126 9.166 5.709 -7.876 1.00 0.00 C ATOM 2026 CD1 TRP A 126 8.107 5.689 -8.738 1.00 0.00 C ATOM 2027 CD2 TRP A 126 8.685 5.185 -6.633 1.00 0.00 C ATOM 2028 NE1 TRP A 126 6.996 5.185 -8.106 1.00 0.00 N ATOM 2029 CE2 TRP A 126 7.325 4.868 -6.814 1.00 0.00 C ATOM 2030 CE3 TRP A 126 9.271 4.952 -5.386 1.00 0.00 C ATOM 2031 CZ2 TRP A 126 6.544 4.331 -5.794 1.00 0.00 C ATOM 2032 CZ3 TRP A 126 8.495 4.420 -4.375 1.00 0.00 C ATOM 2033 CH2 TRP A 126 7.144 4.113 -4.583 1.00 0.00 C ATOM 0 H TRP A 126 11.196 4.306 -9.632 1.00 0.00 H new ATOM 0 HA TRP A 126 9.939 6.779 -10.142 1.00 0.00 H new ATOM 0 HB2 TRP A 126 11.272 5.472 -7.764 1.00 0.00 H new ATOM 0 HB3 TRP A 126 10.725 7.133 -7.658 1.00 0.00 H new ATOM 0 HD1 TRP A 126 8.138 6.021 -9.765 1.00 0.00 H new ATOM 0 HE1 TRP A 126 6.076 5.066 -8.530 1.00 0.00 H new ATOM 0 HE3 TRP A 126 10.312 5.184 -5.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 5.502 4.095 -5.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 8.937 4.237 -3.407 1.00 0.00 H new ATOM 0 HH2 TRP A 126 6.565 3.696 -3.772 1.00 0.00 H new ATOM 2044 N GLN A 127 13.190 6.918 -9.536 1.00 0.00 N ATOM 2045 CA GLN A 127 14.370 7.761 -9.681 1.00 0.00 C ATOM 2046 C GLN A 127 14.548 8.206 -11.129 1.00 0.00 C ATOM 2047 O GLN A 127 15.180 9.226 -11.404 1.00 0.00 O ATOM 2048 CB GLN A 127 15.618 7.014 -9.208 1.00 0.00 C ATOM 2049 CG GLN A 127 16.687 7.923 -8.624 1.00 0.00 C ATOM 2050 CD GLN A 127 18.049 7.260 -8.564 1.00 0.00 C ATOM 2051 OE1 GLN A 127 18.563 6.778 -9.574 1.00 0.00 O ATOM 2052 NE2 GLN A 127 18.643 7.232 -7.377 1.00 0.00 N ATOM 0 H GLN A 127 13.380 5.986 -9.167 1.00 0.00 H new ATOM 0 HA GLN A 127 14.229 8.648 -9.063 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.328 6.279 -8.457 1.00 0.00 H new ATOM 0 HB3 GLN A 127 16.041 6.462 -10.048 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.755 8.830 -9.225 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.391 8.227 -7.620 1.00 0.00 H new ATOM 0 HE21 GLN A 127 18.181 7.643 -6.566 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.561 6.799 -7.276 1.00 0.00 H new ATOM 2061 N LYS A 128 13.986 7.433 -12.053 1.00 0.00 N ATOM 2062 CA LYS A 128 14.080 7.747 -13.473 1.00 0.00 C ATOM 2063 C LYS A 128 12.979 8.717 -13.891 1.00 0.00 C ATOM 2064 O LYS A 128 13.249 9.754 -14.495 1.00 0.00 O ATOM 2065 CB LYS A 128 13.989 6.466 -14.306 1.00 0.00 C ATOM 2066 CG LYS A 128 13.519 6.700 -15.732 1.00 0.00 C ATOM 2067 CD LYS A 128 13.520 5.412 -16.537 1.00 0.00 C ATOM 2068 CE LYS A 128 12.718 5.557 -17.821 1.00 0.00 C ATOM 2069 NZ LYS A 128 13.411 6.423 -18.814 1.00 0.00 N ATOM 0 H LYS A 128 13.461 6.584 -11.843 1.00 0.00 H new ATOM 0 HA LYS A 128 15.045 8.222 -13.651 1.00 0.00 H new ATOM 0 HB2 LYS A 128 14.968 5.987 -14.329 1.00 0.00 H new ATOM 0 HB3 LYS A 128 13.306 5.772 -13.816 1.00 0.00 H new ATOM 0 HG2 LYS A 128 12.514 7.122 -15.720 1.00 0.00 H new ATOM 0 HG3 LYS A 128 14.167 7.432 -16.214 1.00 0.00 H new ATOM 0 HD2 LYS A 128 14.546 5.132 -16.777 1.00 0.00 H new ATOM 0 HD3 LYS A 128 13.102 4.605 -15.935 1.00 0.00 H new ATOM 0 HE2 LYS A 128 12.547 4.572 -18.255 1.00 0.00 H new ATOM 0 HE3 LYS A 128 11.739 5.979 -17.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 12.832 6.496 -19.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 13.552 7.371 -18.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 14.334 6.008 -19.052 1.00 0.00 H new ATOM 2083 N ASN A 129 11.738 8.372 -13.563 1.00 0.00 N ATOM 2084 CA ASN A 129 10.596 9.214 -13.904 1.00 0.00 C ATOM 2085 C ASN A 129 10.599 10.495 -13.076 1.00 0.00 C ATOM 2086 O ASN A 129 9.777 11.385 -13.290 1.00 0.00 O ATOM 2087 CB ASN A 129 9.289 8.451 -13.680 1.00 0.00 C ATOM 2088 CG ASN A 129 8.949 7.533 -14.838 1.00 0.00 C ATOM 2089 OD1 ASN A 129 7.917 7.693 -15.489 1.00 0.00 O ATOM 2090 ND2 ASN A 129 9.819 6.565 -15.101 1.00 0.00 N ATOM 0 H ASN A 129 11.497 7.517 -13.062 1.00 0.00 H new ATOM 0 HA ASN A 129 10.676 9.483 -14.957 1.00 0.00 H new ATOM 0 HB2 ASN A 129 9.367 7.864 -12.765 1.00 0.00 H new ATOM 0 HB3 ASN A 129 8.477 9.163 -13.534 1.00 0.00 H new ATOM 0 HD21 ASN A 129 9.644 5.917 -15.869 1.00 0.00 H new ATOM 0 HD22 ASN A 129 10.662 6.469 -14.535 1.00 0.00 H new ATOM 2097 N ASN A 130 11.529 10.580 -12.131 1.00 0.00 N ATOM 2098 CA ASN A 130 11.638 11.753 -11.270 1.00 0.00 C ATOM 2099 C ASN A 130 10.490 11.801 -10.267 1.00 0.00 C ATOM 2100 O ASN A 130 10.119 12.870 -9.782 1.00 0.00 O ATOM 2101 CB ASN A 130 11.649 13.030 -12.112 1.00 0.00 C ATOM 2102 CG ASN A 130 12.532 12.907 -13.339 1.00 0.00 C ATOM 2103 OD1 ASN A 130 12.071 13.072 -14.468 1.00 0.00 O ATOM 2104 ND2 ASN A 130 13.809 12.615 -13.121 1.00 0.00 N ATOM 0 H ASN A 130 12.218 9.852 -11.942 1.00 0.00 H new ATOM 0 HA ASN A 130 12.575 11.682 -10.718 1.00 0.00 H new ATOM 0 HB2 ASN A 130 10.631 13.266 -12.423 1.00 0.00 H new ATOM 0 HB3 ASN A 130 11.996 13.862 -11.500 1.00 0.00 H new ATOM 0 HD21 ASN A 130 14.452 12.519 -13.907 1.00 0.00 H new ATOM 0 HD22 ASN A 130 14.147 12.487 -12.167 1.00 0.00 H new ATOM 2111 N VAL A 131 9.930 10.635 -9.960 1.00 0.00 N ATOM 2112 CA VAL A 131 8.825 10.543 -9.013 1.00 0.00 C ATOM 2113 C VAL A 131 9.286 10.867 -7.597 1.00 0.00 C ATOM 2114 O VAL A 131 8.594 11.560 -6.850 1.00 0.00 O ATOM 2115 CB VAL A 131 8.191 9.139 -9.026 1.00 0.00 C ATOM 2116 CG1 VAL A 131 6.925 9.118 -8.182 1.00 0.00 C ATOM 2117 CG2 VAL A 131 7.898 8.701 -10.453 1.00 0.00 C ATOM 0 H VAL A 131 10.224 9.741 -10.353 1.00 0.00 H new ATOM 0 HA VAL A 131 8.079 11.274 -9.325 1.00 0.00 H new ATOM 0 HB VAL A 131 8.900 8.434 -8.592 1.00 0.00 H new ATOM 0 HG11 VAL A 131 6.491 8.119 -8.203 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.168 9.387 -7.154 1.00 0.00 H new ATOM 0 HG13 VAL A 131 6.208 9.834 -8.584 1.00 0.00 H new ATOM 0 HG21 VAL A 131 7.450 7.707 -10.444 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.207 9.406 -10.915 1.00 0.00 H new ATOM 0 HG23 VAL A 131 8.826 8.676 -11.024 1.00 0.00 H new ATOM 2127 N PHE A 132 10.460 10.363 -7.232 1.00 0.00 N ATOM 2128 CA PHE A 132 11.015 10.598 -5.904 1.00 0.00 C ATOM 2129 C PHE A 132 12.476 11.031 -5.994 1.00 0.00 C ATOM 2130 O PHE A 132 13.214 10.588 -6.874 1.00 0.00 O ATOM 2131 CB PHE A 132 10.896 9.336 -5.048 1.00 0.00 C ATOM 2132 CG PHE A 132 9.477 8.946 -4.748 1.00 0.00 C ATOM 2133 CD1 PHE A 132 8.744 8.200 -5.656 1.00 0.00 C ATOM 2134 CD2 PHE A 132 8.877 9.325 -3.558 1.00 0.00 C ATOM 2135 CE1 PHE A 132 7.437 7.840 -5.383 1.00 0.00 C ATOM 2136 CE2 PHE A 132 7.571 8.968 -3.280 1.00 0.00 C ATOM 2137 CZ PHE A 132 6.851 8.224 -4.193 1.00 0.00 C ATOM 0 H PHE A 132 11.046 9.789 -7.838 1.00 0.00 H new ATOM 0 HA PHE A 132 10.445 11.401 -5.436 1.00 0.00 H new ATOM 0 HB2 PHE A 132 11.390 8.511 -5.561 1.00 0.00 H new ATOM 0 HB3 PHE A 132 11.428 9.492 -4.109 1.00 0.00 H new ATOM 0 HD1 PHE A 132 9.198 7.896 -6.588 1.00 0.00 H new ATOM 0 HD2 PHE A 132 9.436 9.906 -2.840 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.875 7.259 -6.100 1.00 0.00 H new ATOM 0 HE2 PHE A 132 7.114 9.271 -2.349 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.831 7.943 -3.977 1.00 0.00 H new ATOM 2147 N LYS A 133 12.886 11.900 -5.076 1.00 0.00 N ATOM 2148 CA LYS A 133 14.258 12.393 -5.049 1.00 0.00 C ATOM 2149 C LYS A 133 15.228 11.282 -4.660 1.00 0.00 C ATOM 2150 O LYS A 133 14.883 10.384 -3.892 1.00 0.00 O ATOM 2151 CB LYS A 133 14.382 13.560 -4.066 1.00 0.00 C ATOM 2152 CG LYS A 133 14.564 13.123 -2.623 1.00 0.00 C ATOM 2153 CD LYS A 133 14.627 14.315 -1.683 1.00 0.00 C ATOM 2154 CE LYS A 133 15.471 15.439 -2.264 1.00 0.00 C ATOM 2155 NZ LYS A 133 15.887 16.417 -1.221 1.00 0.00 N ATOM 0 H LYS A 133 12.288 12.277 -4.341 1.00 0.00 H new ATOM 0 HA LYS A 133 14.513 12.740 -6.050 1.00 0.00 H new ATOM 0 HB2 LYS A 133 15.228 14.182 -4.358 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.490 14.182 -4.139 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.739 12.472 -2.332 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.479 12.538 -2.532 1.00 0.00 H new ATOM 0 HD2 LYS A 133 13.618 14.679 -1.488 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.044 14.003 -0.725 1.00 0.00 H new ATOM 0 HE2 LYS A 133 16.356 15.019 -2.741 1.00 0.00 H new ATOM 0 HE3 LYS A 133 14.905 15.954 -3.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 16.007 17.355 -1.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.158 16.467 -0.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 16.788 16.113 -0.799 1.00 0.00 H new ATOM 2169 N SER A 134 16.443 11.350 -5.195 1.00 0.00 N ATOM 2170 CA SER A 134 17.463 10.348 -4.906 1.00 0.00 C ATOM 2171 C SER A 134 17.729 10.262 -3.406 1.00 0.00 C ATOM 2172 O SER A 134 18.109 9.210 -2.893 1.00 0.00 O ATOM 2173 CB SER A 134 18.759 10.680 -5.648 1.00 0.00 C ATOM 2174 OG SER A 134 19.269 11.939 -5.245 1.00 0.00 O ATOM 0 H SER A 134 16.745 12.088 -5.831 1.00 0.00 H new ATOM 0 HA SER A 134 17.095 9.381 -5.248 1.00 0.00 H new ATOM 0 HB2 SER A 134 19.501 9.905 -5.455 1.00 0.00 H new ATOM 0 HB3 SER A 134 18.575 10.685 -6.722 1.00 0.00 H new ATOM 0 HG SER A 134 20.098 12.127 -5.732 1.00 0.00 H new ATOM 2180 N GLU A 135 17.527 11.376 -2.710 1.00 0.00 N ATOM 2181 CA GLU A 135 17.746 11.427 -1.269 1.00 0.00 C ATOM 2182 C GLU A 135 16.699 10.598 -0.530 1.00 0.00 C ATOM 2183 O GLU A 135 16.867 10.274 0.646 1.00 0.00 O ATOM 2184 CB GLU A 135 17.709 12.874 -0.776 1.00 0.00 C ATOM 2185 CG GLU A 135 17.267 13.013 0.671 1.00 0.00 C ATOM 2186 CD GLU A 135 17.428 14.426 1.198 1.00 0.00 C ATOM 2187 OE1 GLU A 135 18.365 15.121 0.753 1.00 0.00 O ATOM 2188 OE2 GLU A 135 16.617 14.836 2.054 1.00 0.00 O ATOM 0 H GLU A 135 17.212 12.255 -3.120 1.00 0.00 H new ATOM 0 HA GLU A 135 18.730 11.006 -1.062 1.00 0.00 H new ATOM 0 HB2 GLU A 135 18.701 13.313 -0.888 1.00 0.00 H new ATOM 0 HB3 GLU A 135 17.033 13.448 -1.410 1.00 0.00 H new ATOM 0 HG2 GLU A 135 16.223 12.714 0.758 1.00 0.00 H new ATOM 0 HG3 GLU A 135 17.847 12.330 1.291 1.00 0.00 H new ATOM 2195 N ILE A 136 15.620 10.261 -1.228 1.00 0.00 N ATOM 2196 CA ILE A 136 14.547 9.470 -0.639 1.00 0.00 C ATOM 2197 C ILE A 136 14.611 8.020 -1.106 1.00 0.00 C ATOM 2198 O ILE A 136 14.363 7.096 -0.331 1.00 0.00 O ATOM 2199 CB ILE A 136 13.163 10.050 -0.990 1.00 0.00 C ATOM 2200 CG1 ILE A 136 12.899 11.321 -0.181 1.00 0.00 C ATOM 2201 CG2 ILE A 136 12.076 9.017 -0.734 1.00 0.00 C ATOM 2202 CD1 ILE A 136 11.894 12.250 -0.826 1.00 0.00 C ATOM 0 H ILE A 136 15.466 10.523 -2.202 1.00 0.00 H new ATOM 0 HA ILE A 136 14.685 9.507 0.442 1.00 0.00 H new ATOM 0 HB ILE A 136 13.151 10.307 -2.049 1.00 0.00 H new ATOM 0 HG12 ILE A 136 12.541 11.043 0.810 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.839 11.855 -0.042 1.00 0.00 H new ATOM 0 HG21 ILE A 136 11.104 9.441 -0.986 1.00 0.00 H new ATOM 0 HG22 ILE A 136 12.259 8.136 -1.350 1.00 0.00 H new ATOM 0 HG23 ILE A 136 12.085 8.732 0.318 1.00 0.00 H new ATOM 0 HD11 ILE A 136 11.756 13.130 -0.198 1.00 0.00 H new ATOM 0 HD12 ILE A 136 12.259 12.558 -1.806 1.00 0.00 H new ATOM 0 HD13 ILE A 136 10.941 11.733 -0.940 1.00 0.00 H new ATOM 2214 N ILE A 137 14.947 7.828 -2.377 1.00 0.00 N ATOM 2215 CA ILE A 137 15.048 6.490 -2.947 1.00 0.00 C ATOM 2216 C ILE A 137 16.387 5.846 -2.605 1.00 0.00 C ATOM 2217 O ILE A 137 16.461 4.645 -2.347 1.00 0.00 O ATOM 2218 CB ILE A 137 14.879 6.516 -4.477 1.00 0.00 C ATOM 2219 CG1 ILE A 137 13.560 7.194 -4.855 1.00 0.00 C ATOM 2220 CG2 ILE A 137 14.936 5.104 -5.040 1.00 0.00 C ATOM 2221 CD1 ILE A 137 13.091 6.863 -6.255 1.00 0.00 C ATOM 0 H ILE A 137 15.154 8.582 -3.032 1.00 0.00 H new ATOM 0 HA ILE A 137 14.242 5.900 -2.511 1.00 0.00 H new ATOM 0 HB ILE A 137 15.698 7.091 -4.909 1.00 0.00 H new ATOM 0 HG12 ILE A 137 12.790 6.896 -4.143 1.00 0.00 H new ATOM 0 HG13 ILE A 137 13.677 8.274 -4.765 1.00 0.00 H new ATOM 0 HG21 ILE A 137 14.815 5.139 -6.123 1.00 0.00 H new ATOM 0 HG22 ILE A 137 15.898 4.654 -4.797 1.00 0.00 H new ATOM 0 HG23 ILE A 137 14.135 4.506 -4.605 1.00 0.00 H new ATOM 0 HD11 ILE A 137 12.151 7.377 -6.455 1.00 0.00 H new ATOM 0 HD12 ILE A 137 13.842 7.186 -6.976 1.00 0.00 H new ATOM 0 HD13 ILE A 137 12.942 5.787 -6.344 1.00 0.00 H new ATOM 2233 N GLN A 138 17.443 6.654 -2.604 1.00 0.00 N ATOM 2234 CA GLN A 138 18.780 6.163 -2.292 1.00 0.00 C ATOM 2235 C GLN A 138 18.728 5.096 -1.204 1.00 0.00 C ATOM 2236 O GLN A 138 19.238 3.987 -1.363 1.00 0.00 O ATOM 2237 CB GLN A 138 19.680 7.317 -1.848 1.00 0.00 C ATOM 2238 CG GLN A 138 20.829 6.883 -0.953 1.00 0.00 C ATOM 2239 CD GLN A 138 21.878 6.081 -1.697 1.00 0.00 C ATOM 2240 OE1 GLN A 138 22.809 6.641 -2.276 1.00 0.00 O ATOM 2241 NE2 GLN A 138 21.732 4.761 -1.686 1.00 0.00 N ATOM 0 H GLN A 138 17.398 7.651 -2.816 1.00 0.00 H new ATOM 0 HA GLN A 138 19.195 5.715 -3.195 1.00 0.00 H new ATOM 0 HB2 GLN A 138 20.085 7.811 -2.731 1.00 0.00 H new ATOM 0 HB3 GLN A 138 19.077 8.054 -1.319 1.00 0.00 H new ATOM 0 HG2 GLN A 138 21.295 7.765 -0.514 1.00 0.00 H new ATOM 0 HG3 GLN A 138 20.437 6.286 -0.129 1.00 0.00 H new ATOM 0 HE21 GLN A 138 20.945 4.339 -1.193 1.00 0.00 H new ATOM 0 HE22 GLN A 138 22.407 4.169 -2.170 1.00 0.00 H new ATOM 2250 N PRO A 139 18.096 5.436 -0.070 1.00 0.00 N ATOM 2251 CA PRO A 139 17.963 4.521 1.067 1.00 0.00 C ATOM 2252 C PRO A 139 17.015 3.364 0.771 1.00 0.00 C ATOM 2253 O PRO A 139 17.284 2.218 1.136 1.00 0.00 O ATOM 2254 CB PRO A 139 17.391 5.411 2.173 1.00 0.00 C ATOM 2255 CG PRO A 139 16.683 6.505 1.451 1.00 0.00 C ATOM 2256 CD PRO A 139 17.464 6.741 0.188 1.00 0.00 C ATOM 0 HA PRO A 139 18.912 4.052 1.326 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.709 4.855 2.816 1.00 0.00 H new ATOM 0 HB3 PRO A 139 18.181 5.805 2.812 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.654 6.223 1.227 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.640 7.409 2.058 1.00 0.00 H new ATOM 0 HD2 PRO A 139 16.816 7.044 -0.635 1.00 0.00 H new ATOM 0 HD3 PRO A 139 18.206 7.529 0.316 1.00 0.00 H new ATOM 2264 N LEU A 140 15.905 3.669 0.108 1.00 0.00 N ATOM 2265 CA LEU A 140 14.916 2.653 -0.238 1.00 0.00 C ATOM 2266 C LEU A 140 15.547 1.539 -1.068 1.00 0.00 C ATOM 2267 O LEU A 140 15.087 0.397 -1.045 1.00 0.00 O ATOM 2268 CB LEU A 140 13.756 3.285 -1.009 1.00 0.00 C ATOM 2269 CG LEU A 140 12.924 4.315 -0.245 1.00 0.00 C ATOM 2270 CD1 LEU A 140 11.878 4.939 -1.157 1.00 0.00 C ATOM 2271 CD2 LEU A 140 12.263 3.674 0.967 1.00 0.00 C ATOM 0 H LEU A 140 15.667 4.611 -0.201 1.00 0.00 H new ATOM 0 HA LEU A 140 14.536 2.220 0.688 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.158 3.763 -1.903 1.00 0.00 H new ATOM 0 HB3 LEU A 140 13.092 2.488 -1.345 1.00 0.00 H new ATOM 0 HG LEU A 140 13.590 5.104 0.104 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.295 5.670 -0.596 1.00 0.00 H new ATOM 0 HD12 LEU A 140 12.373 5.434 -1.993 1.00 0.00 H new ATOM 0 HD13 LEU A 140 11.216 4.161 -1.537 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.675 4.422 1.499 1.00 0.00 H new ATOM 0 HD22 LEU A 140 11.610 2.865 0.640 1.00 0.00 H new ATOM 0 HD23 LEU A 140 13.030 3.276 1.631 1.00 0.00 H new ATOM 2283 N LEU A 141 16.604 1.879 -1.797 1.00 0.00 N ATOM 2284 CA LEU A 141 17.300 0.907 -2.633 1.00 0.00 C ATOM 2285 C LEU A 141 18.141 -0.040 -1.782 1.00 0.00 C ATOM 2286 O LEU A 141 18.337 -1.202 -2.138 1.00 0.00 O ATOM 2287 CB LEU A 141 18.191 1.624 -3.649 1.00 0.00 C ATOM 2288 CG LEU A 141 17.484 2.187 -4.882 1.00 0.00 C ATOM 2289 CD1 LEU A 141 18.364 3.212 -5.581 1.00 0.00 C ATOM 2290 CD2 LEU A 141 17.105 1.066 -5.839 1.00 0.00 C ATOM 0 H LEU A 141 16.998 2.819 -1.826 1.00 0.00 H new ATOM 0 HA LEU A 141 16.551 0.320 -3.165 1.00 0.00 H new ATOM 0 HB2 LEU A 141 18.700 2.443 -3.141 1.00 0.00 H new ATOM 0 HB3 LEU A 141 18.961 0.928 -3.982 1.00 0.00 H new ATOM 0 HG LEU A 141 16.570 2.684 -4.557 1.00 0.00 H new ATOM 0 HD11 LEU A 141 17.844 3.602 -6.456 1.00 0.00 H new ATOM 0 HD12 LEU A 141 18.584 4.030 -4.896 1.00 0.00 H new ATOM 0 HD13 LEU A 141 19.295 2.740 -5.893 1.00 0.00 H new ATOM 0 HD21 LEU A 141 16.603 1.486 -6.711 1.00 0.00 H new ATOM 0 HD22 LEU A 141 18.005 0.540 -6.157 1.00 0.00 H new ATOM 0 HD23 LEU A 141 16.436 0.369 -5.336 1.00 0.00 H new ATOM 2302 N ASP A 142 18.632 0.464 -0.656 1.00 0.00 N ATOM 2303 CA ASP A 142 19.449 -0.338 0.249 1.00 0.00 C ATOM 2304 C ASP A 142 18.572 -1.179 1.171 1.00 0.00 C ATOM 2305 O ASP A 142 18.911 -2.316 1.499 1.00 0.00 O ATOM 2306 CB ASP A 142 20.364 0.564 1.078 1.00 0.00 C ATOM 2307 CG ASP A 142 21.671 -0.115 1.441 1.00 0.00 C ATOM 2308 OD1 ASP A 142 22.591 -0.119 0.597 1.00 0.00 O ATOM 2309 OD2 ASP A 142 21.773 -0.642 2.568 1.00 0.00 O ATOM 0 H ASP A 142 18.479 1.424 -0.347 1.00 0.00 H new ATOM 0 HA ASP A 142 20.062 -1.010 -0.352 1.00 0.00 H new ATOM 0 HB2 ASP A 142 20.574 1.476 0.519 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.847 0.862 1.990 1.00 0.00 H new ATOM 2314 N MET A 143 17.444 -0.612 1.586 1.00 0.00 N ATOM 2315 CA MET A 143 16.518 -1.311 2.470 1.00 0.00 C ATOM 2316 C MET A 143 16.195 -2.700 1.931 1.00 0.00 C ATOM 2317 O MET A 143 16.026 -3.650 2.695 1.00 0.00 O ATOM 2318 CB MET A 143 15.230 -0.503 2.637 1.00 0.00 C ATOM 2319 CG MET A 143 15.453 0.885 3.215 1.00 0.00 C ATOM 2320 SD MET A 143 14.054 1.462 4.195 1.00 0.00 S ATOM 2321 CE MET A 143 12.682 0.880 3.202 1.00 0.00 C ATOM 0 H MET A 143 17.149 0.329 1.325 1.00 0.00 H new ATOM 0 HA MET A 143 16.997 -1.421 3.443 1.00 0.00 H new ATOM 0 HB2 MET A 143 14.741 -0.409 1.667 1.00 0.00 H new ATOM 0 HB3 MET A 143 14.548 -1.052 3.286 1.00 0.00 H new ATOM 0 HG2 MET A 143 16.348 0.876 3.837 1.00 0.00 H new ATOM 0 HG3 MET A 143 15.637 1.588 2.402 1.00 0.00 H new ATOM 0 HE1 MET A 143 11.779 1.428 3.472 1.00 0.00 H new ATOM 0 HE2 MET A 143 12.902 1.042 2.147 1.00 0.00 H new ATOM 0 HE3 MET A 143 12.528 -0.184 3.382 1.00 0.00 H new ATOM 2331 N ALA A 144 16.109 -2.812 0.609 1.00 0.00 N ATOM 2332 CA ALA A 144 15.807 -4.086 -0.032 1.00 0.00 C ATOM 2333 C ALA A 144 16.983 -5.050 0.082 1.00 0.00 C ATOM 2334 O ALA A 144 16.812 -6.265 -0.008 1.00 0.00 O ATOM 2335 CB ALA A 144 15.442 -3.868 -1.493 1.00 0.00 C ATOM 0 H ALA A 144 16.244 -2.036 -0.039 1.00 0.00 H new ATOM 0 HA ALA A 144 14.955 -4.530 0.482 1.00 0.00 H new ATOM 0 HB1 ALA A 144 15.219 -4.828 -1.959 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.567 -3.221 -1.557 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.278 -3.399 -2.011 1.00 0.00 H new