USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 761 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 Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0.775 K(o=0.77,f=-0.48) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= -0.213 K(o=-0.21,f=-2.8) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot -93:sc= 0.163 USER MOD Single : A 31 LYS NZ :NH3+ -166:sc= -0.0218 (180deg=-0.246) USER MOD Single : A 34 GLN : amide:sc= -1.47! K(o=-1.5!,f=-0.011) USER MOD Single : A 40 SER OG : rot 180:sc= -0.0175 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot -21:sc= 0.703! USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ -138:sc= -2.67 (180deg=-4.25!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.243 K(o=-0.24,f=-2) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 50:sc= -1.02 USER MOD Single : A 63 TYR OH : rot 180:sc=-0.000171 USER MOD Single : A 64 ASN : amide:sc= -0.0181 K(o=-0.018,f=-1.3) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.032 K(o=-0.032,f=-1.6!) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.523 K(o=-0.52,f=-1.7!) USER MOD Single : A 76 LYS NZ :NH3+ 160:sc= -0.0621 (180deg=-0.506) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 79 N PRO A 6 16.445 -8.627 3.052 1.00 1.00 N ATOM 80 CA PRO A 6 15.337 -9.541 3.464 1.00 1.00 C ATOM 81 C PRO A 6 14.453 -9.943 2.280 1.00 1.00 C ATOM 82 O PRO A 6 13.228 -9.970 2.381 1.00 1.00 O ATOM 83 CB PRO A 6 14.545 -8.729 4.518 1.00 1.00 C ATOM 84 CG PRO A 6 15.453 -7.606 4.907 1.00 1.00 C ATOM 85 CD PRO A 6 16.289 -7.301 3.673 1.00 1.00 C ATOM 0 HA PRO A 6 15.712 -10.484 3.862 1.00 1.00 H new ATOM 0 HB2 PRO A 6 13.609 -8.354 4.105 1.00 1.00 H new ATOM 0 HB3 PRO A 6 14.289 -9.345 5.380 1.00 1.00 H new ATOM 0 HG2 PRO A 6 14.882 -6.731 5.218 1.00 1.00 H new ATOM 0 HG3 PRO A 6 16.086 -7.889 5.748 1.00 1.00 H new ATOM 0 HD2 PRO A 6 15.787 -6.599 3.007 1.00 1.00 H new ATOM 0 HD3 PRO A 6 17.251 -6.861 3.934 1.00 1.00 H new ATOM 93 N GLU A 7 15.058 -10.271 1.143 1.00 1.00 N ATOM 94 CA GLU A 7 14.317 -10.672 -0.040 1.00 1.00 C ATOM 95 C GLU A 7 13.590 -11.982 0.211 1.00 1.00 C ATOM 96 O GLU A 7 12.625 -12.290 -0.487 1.00 1.00 O ATOM 97 CB GLU A 7 15.274 -10.819 -1.228 1.00 1.00 C ATOM 98 CG GLU A 7 14.474 -11.119 -2.501 1.00 1.00 C ATOM 99 CD GLU A 7 15.392 -11.099 -3.721 1.00 1.00 C ATOM 100 OE1 GLU A 7 16.492 -10.584 -3.603 1.00 1.00 O ATOM 101 OE2 GLU A 7 14.978 -11.594 -4.757 1.00 1.00 O ATOM 0 H GLU A 7 16.070 -10.265 1.019 1.00 1.00 H new ATOM 0 HA GLU A 7 13.578 -9.904 -0.270 1.00 1.00 H new ATOM 0 HB2 GLU A 7 15.852 -9.904 -1.357 1.00 1.00 H new ATOM 0 HB3 GLU A 7 15.986 -11.622 -1.037 1.00 1.00 H new ATOM 0 HG2 GLU A 7 13.993 -12.093 -2.415 1.00 1.00 H new ATOM 0 HG3 GLU A 7 13.681 -10.382 -2.622 1.00 1.00 H new ATOM 108 N GLU A 8 14.047 -12.741 1.202 1.00 1.00 N ATOM 109 CA GLU A 8 13.417 -14.016 1.540 1.00 1.00 C ATOM 110 C GLU A 8 12.061 -13.790 2.206 1.00 1.00 C ATOM 111 O GLU A 8 11.127 -14.569 2.018 1.00 1.00 O ATOM 112 CB GLU A 8 14.318 -14.810 2.480 1.00 1.00 C ATOM 113 CG GLU A 8 15.584 -15.246 1.738 1.00 1.00 C ATOM 114 CD GLU A 8 16.550 -15.916 2.709 1.00 1.00 C ATOM 115 OE1 GLU A 8 16.209 -16.025 3.876 1.00 1.00 O ATOM 116 OE2 GLU A 8 17.620 -16.309 2.274 1.00 1.00 O ATOM 0 H GLU A 8 14.848 -12.498 1.784 1.00 1.00 H new ATOM 0 HA GLU A 8 13.266 -14.577 0.618 1.00 1.00 H new ATOM 0 HB2 GLU A 8 14.583 -14.202 3.345 1.00 1.00 H new ATOM 0 HB3 GLU A 8 13.786 -15.684 2.856 1.00 1.00 H new ATOM 0 HG2 GLU A 8 15.326 -15.936 0.934 1.00 1.00 H new ATOM 0 HG3 GLU A 8 16.061 -14.382 1.275 1.00 1.00 H new ATOM 123 N TYR A 9 11.949 -12.721 2.988 1.00 1.00 N ATOM 124 CA TYR A 9 10.711 -12.391 3.673 1.00 1.00 C ATOM 125 C TYR A 9 9.574 -12.230 2.668 1.00 1.00 C ATOM 126 O TYR A 9 8.401 -12.223 3.043 1.00 1.00 O ATOM 127 CB TYR A 9 10.889 -11.097 4.480 1.00 1.00 C ATOM 128 CG TYR A 9 11.683 -11.382 5.749 1.00 1.00 C ATOM 129 CD1 TYR A 9 13.065 -11.607 5.682 1.00 1.00 C ATOM 130 CD2 TYR A 9 11.031 -11.419 6.990 1.00 1.00 C ATOM 131 CE1 TYR A 9 13.790 -11.866 6.853 1.00 1.00 C ATOM 132 CE2 TYR A 9 11.759 -11.679 8.157 1.00 1.00 C ATOM 133 CZ TYR A 9 13.138 -11.901 8.088 1.00 1.00 C ATOM 134 OH TYR A 9 13.851 -12.156 9.241 1.00 1.00 O ATOM 0 H TYR A 9 12.710 -12.065 3.162 1.00 1.00 H new ATOM 0 HA TYR A 9 10.460 -13.204 4.354 1.00 1.00 H new ATOM 0 HB2 TYR A 9 11.406 -10.350 3.877 1.00 1.00 H new ATOM 0 HB3 TYR A 9 9.915 -10.681 4.736 1.00 1.00 H new ATOM 0 HD1 TYR A 9 13.571 -11.581 4.728 1.00 1.00 H new ATOM 0 HD2 TYR A 9 9.966 -11.247 7.045 1.00 1.00 H new ATOM 0 HE1 TYR A 9 14.855 -12.039 6.801 1.00 1.00 H new ATOM 0 HE2 TYR A 9 11.255 -11.708 9.112 1.00 1.00 H new ATOM 0 HH TYR A 9 13.244 -12.143 10.010 1.00 1.00 H new ATOM 144 N TYR A 10 9.898 -12.101 1.386 1.00 1.00 N ATOM 145 CA TYR A 10 8.899 -11.937 0.339 1.00 1.00 C ATOM 146 C TYR A 10 7.882 -13.069 0.399 1.00 1.00 C ATOM 147 O TYR A 10 6.795 -12.990 -0.172 1.00 1.00 O ATOM 148 CB TYR A 10 9.589 -11.911 -1.038 1.00 1.00 C ATOM 149 CG TYR A 10 9.639 -13.318 -1.625 1.00 1.00 C ATOM 150 CD1 TYR A 10 10.490 -14.279 -1.071 1.00 1.00 C ATOM 151 CD2 TYR A 10 8.816 -13.654 -2.705 1.00 1.00 C ATOM 152 CE1 TYR A 10 10.522 -15.575 -1.599 1.00 1.00 C ATOM 153 CE2 TYR A 10 8.847 -14.948 -3.231 1.00 1.00 C ATOM 154 CZ TYR A 10 9.703 -15.908 -2.680 1.00 1.00 C ATOM 155 OH TYR A 10 9.736 -17.183 -3.206 1.00 1.00 O ATOM 0 H TYR A 10 10.859 -12.107 1.045 1.00 1.00 H new ATOM 0 HA TYR A 10 8.375 -10.994 0.492 1.00 1.00 H new ATOM 0 HB2 TYR A 10 9.049 -11.246 -1.712 1.00 1.00 H new ATOM 0 HB3 TYR A 10 10.599 -11.513 -0.940 1.00 1.00 H new ATOM 0 HD1 TYR A 10 11.123 -14.021 -0.235 1.00 1.00 H new ATOM 0 HD2 TYR A 10 8.157 -12.913 -3.132 1.00 1.00 H new ATOM 0 HE1 TYR A 10 11.180 -16.317 -1.171 1.00 1.00 H new ATOM 0 HE2 TYR A 10 8.210 -15.207 -4.063 1.00 1.00 H new ATOM 0 HH TYR A 10 9.104 -17.245 -3.952 1.00 1.00 H new ATOM 165 N LEU A 11 8.220 -14.149 1.096 1.00 1.00 N ATOM 166 CA LEU A 11 7.330 -15.312 1.215 1.00 1.00 C ATOM 167 C LEU A 11 5.877 -14.877 1.389 1.00 1.00 C ATOM 168 O LEU A 11 4.952 -15.630 1.090 1.00 1.00 O ATOM 169 CB LEU A 11 7.757 -16.171 2.413 1.00 1.00 C ATOM 170 CG LEU A 11 7.543 -15.414 3.759 1.00 1.00 C ATOM 171 CD1 LEU A 11 6.254 -15.883 4.448 1.00 1.00 C ATOM 172 CD2 LEU A 11 8.724 -15.682 4.703 1.00 1.00 C ATOM 0 H LEU A 11 9.106 -14.249 1.591 1.00 1.00 H new ATOM 0 HA LEU A 11 7.406 -15.895 0.297 1.00 1.00 H new ATOM 0 HB2 LEU A 11 7.185 -17.099 2.420 1.00 1.00 H new ATOM 0 HB3 LEU A 11 8.807 -16.445 2.311 1.00 1.00 H new ATOM 0 HG LEU A 11 7.469 -14.349 3.538 1.00 1.00 H new ATOM 0 HD11 LEU A 11 6.125 -15.342 5.385 1.00 1.00 H new ATOM 0 HD12 LEU A 11 5.402 -15.689 3.796 1.00 1.00 H new ATOM 0 HD13 LEU A 11 6.319 -16.952 4.652 1.00 1.00 H new ATOM 0 HD21 LEU A 11 8.568 -15.150 5.641 1.00 1.00 H new ATOM 0 HD22 LEU A 11 8.797 -16.752 4.900 1.00 1.00 H new ATOM 0 HD23 LEU A 11 9.647 -15.335 4.239 1.00 1.00 H new ATOM 184 N GLU A 12 5.730 -13.647 1.869 1.00 1.00 N ATOM 185 CA GLU A 12 4.398 -13.104 2.077 1.00 1.00 C ATOM 186 C GLU A 12 3.571 -13.200 0.801 1.00 1.00 C ATOM 187 O GLU A 12 2.446 -13.700 0.840 1.00 1.00 O ATOM 188 CB GLU A 12 4.522 -11.644 2.532 1.00 1.00 C ATOM 189 CG GLU A 12 3.157 -10.923 2.471 1.00 1.00 C ATOM 190 CD GLU A 12 2.106 -11.685 3.271 1.00 1.00 C ATOM 191 OE1 GLU A 12 2.472 -12.342 4.229 1.00 1.00 O ATOM 192 OE2 GLU A 12 0.948 -11.599 2.905 1.00 1.00 O ATOM 0 H GLU A 12 6.498 -13.022 2.115 1.00 1.00 H new ATOM 0 HA GLU A 12 3.887 -13.683 2.846 1.00 1.00 H new ATOM 0 HB2 GLU A 12 4.910 -11.609 3.550 1.00 1.00 H new ATOM 0 HB3 GLU A 12 5.240 -11.123 1.899 1.00 1.00 H new ATOM 0 HG2 GLU A 12 3.257 -9.911 2.864 1.00 1.00 H new ATOM 0 HG3 GLU A 12 2.835 -10.831 1.434 1.00 1.00 H new ATOM 199 N GLY A 13 4.147 -12.718 -0.295 1.00 1.00 N ATOM 200 CA GLY A 13 3.457 -12.747 -1.591 1.00 1.00 C ATOM 201 C GLY A 13 2.608 -14.009 -1.731 1.00 1.00 C ATOM 202 O GLY A 13 1.478 -13.968 -2.219 1.00 1.00 O ATOM 0 H GLY A 13 5.080 -12.306 -0.319 1.00 1.00 H new ATOM 0 HA2 GLY A 13 2.824 -11.865 -1.690 1.00 1.00 H new ATOM 0 HA3 GLY A 13 4.189 -12.705 -2.398 1.00 1.00 H new ATOM 206 N VAL A 14 3.158 -15.137 -1.295 1.00 1.00 N ATOM 207 CA VAL A 14 2.437 -16.400 -1.364 1.00 1.00 C ATOM 208 C VAL A 14 1.299 -16.419 -0.359 1.00 1.00 C ATOM 209 O VAL A 14 0.148 -16.643 -0.733 1.00 1.00 O ATOM 210 CB VAL A 14 3.389 -17.557 -1.054 1.00 1.00 C ATOM 211 CG1 VAL A 14 2.641 -18.893 -1.135 1.00 1.00 C ATOM 212 CG2 VAL A 14 4.540 -17.551 -2.059 1.00 1.00 C ATOM 0 H VAL A 14 4.093 -15.202 -0.893 1.00 1.00 H new ATOM 0 HA VAL A 14 2.031 -16.509 -2.370 1.00 1.00 H new ATOM 0 HB VAL A 14 3.783 -17.434 -0.045 1.00 1.00 H new ATOM 0 HG11 VAL A 14 3.329 -19.709 -0.913 1.00 1.00 H new ATOM 0 HG12 VAL A 14 1.826 -18.898 -0.412 1.00 1.00 H new ATOM 0 HG13 VAL A 14 2.236 -19.023 -2.139 1.00 1.00 H new ATOM 0 HG21 VAL A 14 5.219 -18.375 -1.839 1.00 1.00 H new ATOM 0 HG22 VAL A 14 4.143 -17.667 -3.068 1.00 1.00 H new ATOM 0 HG23 VAL A 14 5.080 -16.607 -1.988 1.00 1.00 H new ATOM 222 N LEU A 15 1.602 -16.191 0.916 1.00 1.00 N ATOM 223 CA LEU A 15 0.583 -16.200 1.960 1.00 1.00 C ATOM 224 C LEU A 15 -0.664 -15.468 1.487 1.00 1.00 C ATOM 225 O LEU A 15 -1.699 -16.098 1.274 1.00 1.00 O ATOM 226 CB LEU A 15 1.111 -15.507 3.227 1.00 1.00 C ATOM 227 CG LEU A 15 2.408 -16.169 3.709 1.00 1.00 C ATOM 228 CD1 LEU A 15 2.821 -15.545 5.045 1.00 1.00 C ATOM 229 CD2 LEU A 15 2.204 -17.688 3.880 1.00 1.00 C ATOM 0 H LEU A 15 2.546 -15.998 1.251 1.00 1.00 H new ATOM 0 HA LEU A 15 0.337 -17.238 2.184 1.00 1.00 H new ATOM 0 HB2 LEU A 15 1.290 -14.452 3.022 1.00 1.00 H new ATOM 0 HB3 LEU A 15 0.358 -15.555 4.014 1.00 1.00 H new ATOM 0 HG LEU A 15 3.192 -16.008 2.969 1.00 1.00 H new ATOM 0 HD11 LEU A 15 3.743 -16.010 5.395 1.00 1.00 H new ATOM 0 HD12 LEU A 15 2.982 -14.475 4.912 1.00 1.00 H new ATOM 0 HD13 LEU A 15 2.032 -15.705 5.780 1.00 1.00 H new ATOM 0 HD21 LEU A 15 3.133 -18.144 4.222 1.00 1.00 H new ATOM 0 HD22 LEU A 15 1.419 -17.869 4.614 1.00 1.00 H new ATOM 0 HD23 LEU A 15 1.916 -18.126 2.925 1.00 1.00 H new ATOM 241 N GLN A 16 -0.575 -14.153 1.311 1.00 1.00 N ATOM 242 CA GLN A 16 -1.731 -13.378 0.857 1.00 1.00 C ATOM 243 C GLN A 16 -2.440 -14.107 -0.290 1.00 1.00 C ATOM 244 O GLN A 16 -3.641 -14.360 -0.218 1.00 1.00 O ATOM 245 CB GLN A 16 -1.257 -11.999 0.362 1.00 1.00 C ATOM 246 CG GLN A 16 -2.467 -11.123 0.020 1.00 1.00 C ATOM 247 CD GLN A 16 -2.012 -9.767 -0.514 1.00 1.00 C ATOM 248 OE1 GLN A 16 -1.074 -9.694 -1.306 1.00 1.00 O ATOM 249 NE2 GLN A 16 -2.632 -8.682 -0.133 1.00 1.00 N ATOM 0 H GLN A 16 0.271 -13.606 1.472 1.00 1.00 H new ATOM 0 HA GLN A 16 -2.426 -13.258 1.688 1.00 1.00 H new ATOM 0 HB2 GLN A 16 -0.653 -11.516 1.129 1.00 1.00 H new ATOM 0 HB3 GLN A 16 -0.622 -12.117 -0.516 1.00 1.00 H new ATOM 0 HG2 GLN A 16 -3.087 -11.624 -0.723 1.00 1.00 H new ATOM 0 HG3 GLN A 16 -3.084 -10.982 0.907 1.00 1.00 H new ATOM 0 HE21 GLN A 16 -3.410 -8.743 0.524 1.00 1.00 H new ATOM 0 HE22 GLN A 16 -2.338 -7.774 -0.492 1.00 1.00 H new ATOM 258 N TYR A 17 -1.714 -14.462 -1.345 1.00 1.00 N ATOM 259 CA TYR A 17 -2.318 -15.168 -2.467 1.00 1.00 C ATOM 260 C TYR A 17 -3.111 -16.385 -1.993 1.00 1.00 C ATOM 261 O TYR A 17 -4.331 -16.431 -2.151 1.00 1.00 O ATOM 262 CB TYR A 17 -1.214 -15.628 -3.422 1.00 1.00 C ATOM 263 CG TYR A 17 -1.830 -16.226 -4.667 1.00 1.00 C ATOM 264 CD1 TYR A 17 -2.327 -15.390 -5.678 1.00 1.00 C ATOM 265 CD2 TYR A 17 -1.897 -17.617 -4.815 1.00 1.00 C ATOM 266 CE1 TYR A 17 -2.892 -15.949 -6.831 1.00 1.00 C ATOM 267 CE2 TYR A 17 -2.460 -18.173 -5.967 1.00 1.00 C ATOM 268 CZ TYR A 17 -2.958 -17.340 -6.975 1.00 1.00 C ATOM 269 OH TYR A 17 -3.513 -17.890 -8.111 1.00 1.00 O ATOM 0 H TYR A 17 -0.716 -14.274 -1.446 1.00 1.00 H new ATOM 0 HA TYR A 17 -3.003 -14.488 -2.974 1.00 1.00 H new ATOM 0 HB2 TYR A 17 -0.577 -14.785 -3.689 1.00 1.00 H new ATOM 0 HB3 TYR A 17 -0.578 -16.364 -2.930 1.00 1.00 H new ATOM 0 HD1 TYR A 17 -2.274 -14.317 -5.567 1.00 1.00 H new ATOM 0 HD2 TYR A 17 -1.513 -18.261 -4.038 1.00 1.00 H new ATOM 0 HE1 TYR A 17 -3.277 -15.307 -7.609 1.00 1.00 H new ATOM 0 HE2 TYR A 17 -2.511 -19.246 -6.079 1.00 1.00 H new ATOM 0 HH TYR A 17 -3.479 -18.868 -8.051 1.00 1.00 H new ATOM 279 N ASP A 18 -2.413 -17.358 -1.413 1.00 1.00 N ATOM 280 CA ASP A 18 -3.076 -18.563 -0.913 1.00 1.00 C ATOM 281 C ASP A 18 -3.766 -18.284 0.419 1.00 1.00 C ATOM 282 O ASP A 18 -4.991 -18.187 0.490 1.00 1.00 O ATOM 283 CB ASP A 18 -2.056 -19.686 -0.738 1.00 1.00 C ATOM 284 CG ASP A 18 -1.488 -20.100 -2.093 1.00 1.00 C ATOM 285 OD1 ASP A 18 -2.274 -20.350 -2.992 1.00 1.00 O ATOM 286 OD2 ASP A 18 -0.275 -20.169 -2.209 1.00 1.00 O ATOM 0 H ASP A 18 -1.402 -17.339 -1.278 1.00 1.00 H new ATOM 0 HA ASP A 18 -3.829 -18.868 -1.640 1.00 1.00 H new ATOM 0 HB2 ASP A 18 -1.250 -19.356 -0.083 1.00 1.00 H new ATOM 0 HB3 ASP A 18 -2.527 -20.543 -0.256 1.00 1.00 H new ATOM 291 N ALA A 19 -2.967 -18.156 1.473 1.00 1.00 N ATOM 292 CA ALA A 19 -3.491 -17.888 2.812 1.00 1.00 C ATOM 293 C ALA A 19 -3.951 -16.435 2.926 1.00 1.00 C ATOM 294 O ALA A 19 -3.142 -15.519 3.062 1.00 1.00 O ATOM 295 CB ALA A 19 -2.417 -18.178 3.867 1.00 1.00 C ATOM 0 H ALA A 19 -1.951 -18.233 1.428 1.00 1.00 H new ATOM 0 HA ALA A 19 -4.347 -18.541 2.984 1.00 1.00 H new ATOM 0 HB1 ALA A 19 -2.818 -17.975 4.860 1.00 1.00 H new ATOM 0 HB2 ALA A 19 -2.118 -19.224 3.803 1.00 1.00 H new ATOM 0 HB3 ALA A 19 -1.550 -17.541 3.689 1.00 1.00 H new ATOM 301 N GLY A 20 -5.260 -16.212 2.871 1.00 1.00 N ATOM 302 CA GLY A 20 -5.833 -14.874 2.966 1.00 1.00 C ATOM 303 C GLY A 20 -5.682 -14.311 4.366 1.00 1.00 C ATOM 304 O GLY A 20 -6.667 -13.966 5.021 1.00 1.00 O ATOM 0 H GLY A 20 -5.953 -16.952 2.759 1.00 1.00 H new ATOM 0 HA2 GLY A 20 -5.342 -14.214 2.251 1.00 1.00 H new ATOM 0 HA3 GLY A 20 -6.889 -14.908 2.697 1.00 1.00 H new ATOM 308 N ASN A 21 -4.442 -14.214 4.832 1.00 1.00 N ATOM 309 CA ASN A 21 -4.166 -13.686 6.172 1.00 1.00 C ATOM 310 C ASN A 21 -3.430 -12.361 6.077 1.00 1.00 C ATOM 311 O ASN A 21 -2.306 -12.233 6.563 1.00 1.00 O ATOM 312 CB ASN A 21 -3.323 -14.687 6.964 1.00 1.00 C ATOM 313 CG ASN A 21 -4.103 -15.979 7.170 1.00 1.00 C ATOM 314 OD1 ASN A 21 -4.408 -16.683 6.207 1.00 1.00 O ATOM 315 ND2 ASN A 21 -4.441 -16.338 8.379 1.00 1.00 N ATOM 0 H ASN A 21 -3.612 -14.492 4.308 1.00 1.00 H new ATOM 0 HA ASN A 21 -5.114 -13.527 6.685 1.00 1.00 H new ATOM 0 HB2 ASN A 21 -2.395 -14.894 6.432 1.00 1.00 H new ATOM 0 HB3 ASN A 21 -3.049 -14.261 7.929 1.00 1.00 H new ATOM 0 HD21 ASN A 21 -4.959 -17.204 8.528 1.00 1.00 H new ATOM 0 HD22 ASN A 21 -4.187 -15.753 9.175 1.00 1.00 H new ATOM 322 N TYR A 22 -4.077 -11.386 5.450 1.00 1.00 N ATOM 323 CA TYR A 22 -3.469 -10.067 5.296 1.00 1.00 C ATOM 324 C TYR A 22 -2.857 -9.616 6.622 1.00 1.00 C ATOM 325 O TYR A 22 -1.768 -9.042 6.641 1.00 1.00 O ATOM 326 CB TYR A 22 -4.525 -9.051 4.864 1.00 1.00 C ATOM 327 CG TYR A 22 -5.237 -9.550 3.628 1.00 1.00 C ATOM 328 CD1 TYR A 22 -4.738 -9.241 2.357 1.00 1.00 C ATOM 329 CD2 TYR A 22 -6.399 -10.322 3.755 1.00 1.00 C ATOM 330 CE1 TYR A 22 -5.402 -9.704 1.213 1.00 1.00 C ATOM 331 CE2 TYR A 22 -7.061 -10.784 2.612 1.00 1.00 C ATOM 332 CZ TYR A 22 -6.563 -10.477 1.341 1.00 1.00 C ATOM 333 OH TYR A 22 -7.216 -10.931 0.215 1.00 1.00 O ATOM 0 H TYR A 22 -5.008 -11.479 5.045 1.00 1.00 H new ATOM 0 HA TYR A 22 -2.690 -10.130 4.536 1.00 1.00 H new ATOM 0 HB2 TYR A 22 -5.242 -8.893 5.669 1.00 1.00 H new ATOM 0 HB3 TYR A 22 -4.056 -8.088 4.661 1.00 1.00 H new ATOM 0 HD1 TYR A 22 -3.842 -8.646 2.258 1.00 1.00 H new ATOM 0 HD2 TYR A 22 -6.784 -10.561 4.735 1.00 1.00 H new ATOM 0 HE1 TYR A 22 -5.018 -9.465 0.232 1.00 1.00 H new ATOM 0 HE2 TYR A 22 -7.957 -11.378 2.711 1.00 1.00 H new ATOM 0 HH TYR A 22 -8.002 -11.453 0.481 1.00 1.00 H new ATOM 343 N THR A 23 -3.564 -9.886 7.714 1.00 1.00 N ATOM 344 CA THR A 23 -3.072 -9.502 9.036 1.00 1.00 C ATOM 345 C THR A 23 -1.692 -10.108 9.282 1.00 1.00 C ATOM 346 O THR A 23 -0.767 -9.405 9.687 1.00 1.00 O ATOM 347 CB THR A 23 -4.039 -9.993 10.126 1.00 1.00 C ATOM 348 OG1 THR A 23 -5.364 -9.628 9.774 1.00 1.00 O ATOM 349 CG2 THR A 23 -3.683 -9.359 11.473 1.00 1.00 C ATOM 0 H THR A 23 -4.466 -10.362 7.714 1.00 1.00 H new ATOM 0 HA THR A 23 -3.003 -8.415 9.074 1.00 1.00 H new ATOM 0 HB THR A 23 -3.960 -11.077 10.210 1.00 1.00 H new ATOM 0 HG1 THR A 23 -5.984 -9.941 10.465 1.00 1.00 H new ATOM 0 HG21 THR A 23 -4.375 -9.714 12.237 1.00 1.00 H new ATOM 0 HG22 THR A 23 -2.665 -9.636 11.748 1.00 1.00 H new ATOM 0 HG23 THR A 23 -3.755 -8.274 11.395 1.00 1.00 H new ATOM 357 N GLU A 24 -1.539 -11.404 9.031 1.00 1.00 N ATOM 358 CA GLU A 24 -0.250 -12.055 9.234 1.00 1.00 C ATOM 359 C GLU A 24 0.855 -11.326 8.472 1.00 1.00 C ATOM 360 O GLU A 24 1.961 -11.165 8.986 1.00 1.00 O ATOM 361 CB GLU A 24 -0.326 -13.506 8.760 1.00 1.00 C ATOM 362 CG GLU A 24 1.000 -14.226 9.034 1.00 1.00 C ATOM 363 CD GLU A 24 0.878 -15.700 8.661 1.00 1.00 C ATOM 364 OE1 GLU A 24 -0.109 -16.057 8.039 1.00 1.00 O ATOM 365 OE2 GLU A 24 1.775 -16.453 9.004 1.00 1.00 O ATOM 0 H GLU A 24 -2.280 -12.017 8.691 1.00 1.00 H new ATOM 0 HA GLU A 24 -0.014 -12.026 10.298 1.00 1.00 H new ATOM 0 HB2 GLU A 24 -1.139 -14.021 9.272 1.00 1.00 H new ATOM 0 HB3 GLU A 24 -0.550 -13.536 7.694 1.00 1.00 H new ATOM 0 HG2 GLU A 24 1.801 -13.762 8.459 1.00 1.00 H new ATOM 0 HG3 GLU A 24 1.265 -14.129 10.087 1.00 1.00 H new ATOM 372 N SER A 25 0.551 -10.895 7.251 1.00 1.00 N ATOM 373 CA SER A 25 1.549 -10.202 6.439 1.00 1.00 C ATOM 374 C SER A 25 2.210 -9.074 7.240 1.00 1.00 C ATOM 375 O SER A 25 3.393 -8.782 7.059 1.00 1.00 O ATOM 376 CB SER A 25 0.885 -9.610 5.194 1.00 1.00 C ATOM 377 OG SER A 25 0.212 -8.412 5.538 1.00 1.00 O ATOM 0 H SER A 25 -0.360 -11.010 6.808 1.00 1.00 H new ATOM 0 HA SER A 25 2.312 -10.923 6.145 1.00 1.00 H new ATOM 0 HB2 SER A 25 1.636 -9.410 4.429 1.00 1.00 H new ATOM 0 HB3 SER A 25 0.181 -10.326 4.770 1.00 1.00 H new ATOM 0 HG SER A 25 -0.724 -8.611 5.748 1.00 1.00 H new ATOM 383 N ILE A 26 1.457 -8.439 8.129 1.00 1.00 N ATOM 384 CA ILE A 26 1.994 -7.349 8.945 1.00 1.00 C ATOM 385 C ILE A 26 3.191 -7.848 9.753 1.00 1.00 C ATOM 386 O ILE A 26 4.191 -7.145 9.896 1.00 1.00 O ATOM 387 CB ILE A 26 0.917 -6.810 9.909 1.00 1.00 C ATOM 388 CG1 ILE A 26 -0.024 -5.857 9.156 1.00 1.00 C ATOM 389 CG2 ILE A 26 1.561 -6.063 11.097 1.00 1.00 C ATOM 390 CD1 ILE A 26 -0.647 -6.563 7.942 1.00 1.00 C ATOM 0 H ILE A 26 0.476 -8.656 8.306 1.00 1.00 H new ATOM 0 HA ILE A 26 2.308 -6.544 8.280 1.00 1.00 H new ATOM 0 HB ILE A 26 0.352 -7.658 10.297 1.00 1.00 H new ATOM 0 HG12 ILE A 26 -0.811 -5.510 9.825 1.00 1.00 H new ATOM 0 HG13 ILE A 26 0.528 -4.976 8.828 1.00 1.00 H new ATOM 0 HG21 ILE A 26 0.780 -5.693 11.761 1.00 1.00 H new ATOM 0 HG22 ILE A 26 2.211 -6.744 11.646 1.00 1.00 H new ATOM 0 HG23 ILE A 26 2.147 -5.223 10.724 1.00 1.00 H new ATOM 0 HD11 ILE A 26 -1.311 -5.873 7.421 1.00 1.00 H new ATOM 0 HD12 ILE A 26 0.143 -6.888 7.265 1.00 1.00 H new ATOM 0 HD13 ILE A 26 -1.216 -7.430 8.278 1.00 1.00 H new ATOM 402 N ASP A 27 3.081 -9.061 10.285 1.00 1.00 N ATOM 403 CA ASP A 27 4.161 -9.601 11.090 1.00 1.00 C ATOM 404 C ASP A 27 5.436 -9.714 10.259 1.00 1.00 C ATOM 405 O ASP A 27 6.502 -9.277 10.687 1.00 1.00 O ATOM 406 CB ASP A 27 3.763 -10.982 11.621 1.00 1.00 C ATOM 407 CG ASP A 27 2.674 -10.853 12.688 1.00 1.00 C ATOM 408 OD1 ASP A 27 2.546 -9.780 13.252 1.00 1.00 O ATOM 409 OD2 ASP A 27 1.985 -11.832 12.919 1.00 1.00 O ATOM 0 H ASP A 27 2.273 -9.674 10.175 1.00 1.00 H new ATOM 0 HA ASP A 27 4.349 -8.929 11.928 1.00 1.00 H new ATOM 0 HB2 ASP A 27 3.405 -11.604 10.801 1.00 1.00 H new ATOM 0 HB3 ASP A 27 4.636 -11.481 12.042 1.00 1.00 H new ATOM 414 N LEU A 28 5.294 -10.308 9.077 1.00 1.00 N ATOM 415 CA LEU A 28 6.450 -10.479 8.206 1.00 1.00 C ATOM 416 C LEU A 28 6.992 -9.122 7.755 1.00 1.00 C ATOM 417 O LEU A 28 8.199 -8.885 7.795 1.00 1.00 O ATOM 418 CB LEU A 28 6.064 -11.332 6.986 1.00 1.00 C ATOM 419 CG LEU A 28 5.977 -12.832 7.345 1.00 1.00 C ATOM 420 CD1 LEU A 28 7.360 -13.410 7.688 1.00 1.00 C ATOM 421 CD2 LEU A 28 5.025 -13.041 8.529 1.00 1.00 C ATOM 0 H LEU A 28 4.414 -10.670 8.709 1.00 1.00 H new ATOM 0 HA LEU A 28 7.234 -10.991 8.764 1.00 1.00 H new ATOM 0 HB2 LEU A 28 5.104 -10.995 6.595 1.00 1.00 H new ATOM 0 HB3 LEU A 28 6.799 -11.189 6.194 1.00 1.00 H new ATOM 0 HG LEU A 28 5.593 -13.358 6.471 1.00 1.00 H new ATOM 0 HD11 LEU A 28 7.261 -14.467 7.936 1.00 1.00 H new ATOM 0 HD12 LEU A 28 8.024 -13.299 6.831 1.00 1.00 H new ATOM 0 HD13 LEU A 28 7.777 -12.875 8.541 1.00 1.00 H new ATOM 0 HD21 LEU A 28 4.973 -14.102 8.771 1.00 1.00 H new ATOM 0 HD22 LEU A 28 5.393 -12.489 9.394 1.00 1.00 H new ATOM 0 HD23 LEU A 28 4.031 -12.680 8.265 1.00 1.00 H new ATOM 433 N PHE A 29 6.091 -8.241 7.332 1.00 1.00 N ATOM 434 CA PHE A 29 6.514 -6.923 6.886 1.00 1.00 C ATOM 435 C PHE A 29 7.253 -6.195 8.009 1.00 1.00 C ATOM 436 O PHE A 29 8.306 -5.605 7.777 1.00 1.00 O ATOM 437 CB PHE A 29 5.290 -6.096 6.440 1.00 1.00 C ATOM 438 CG PHE A 29 4.930 -6.402 4.992 1.00 1.00 C ATOM 439 CD1 PHE A 29 5.856 -6.129 3.972 1.00 1.00 C ATOM 440 CD2 PHE A 29 3.681 -6.951 4.667 1.00 1.00 C ATOM 441 CE1 PHE A 29 5.536 -6.405 2.643 1.00 1.00 C ATOM 442 CE2 PHE A 29 3.365 -7.224 3.332 1.00 1.00 C ATOM 443 CZ PHE A 29 4.290 -6.952 2.322 1.00 1.00 C ATOM 0 H PHE A 29 5.086 -8.411 7.289 1.00 1.00 H new ATOM 0 HA PHE A 29 7.190 -7.042 6.039 1.00 1.00 H new ATOM 0 HB2 PHE A 29 4.440 -6.318 7.086 1.00 1.00 H new ATOM 0 HB3 PHE A 29 5.504 -5.033 6.550 1.00 1.00 H new ATOM 0 HD1 PHE A 29 6.818 -5.704 4.217 1.00 1.00 H new ATOM 0 HD2 PHE A 29 2.964 -7.163 5.447 1.00 1.00 H new ATOM 0 HE1 PHE A 29 6.251 -6.196 1.861 1.00 1.00 H new ATOM 0 HE2 PHE A 29 2.403 -7.646 3.082 1.00 1.00 H new ATOM 0 HZ PHE A 29 4.043 -7.164 1.292 1.00 1.00 H new ATOM 453 N GLU A 30 6.695 -6.241 9.215 1.00 1.00 N ATOM 454 CA GLU A 30 7.321 -5.560 10.342 1.00 1.00 C ATOM 455 C GLU A 30 8.788 -5.960 10.463 1.00 1.00 C ATOM 456 O GLU A 30 9.643 -5.122 10.751 1.00 1.00 O ATOM 457 CB GLU A 30 6.575 -5.913 11.632 1.00 1.00 C ATOM 458 CG GLU A 30 7.150 -5.125 12.814 1.00 1.00 C ATOM 459 CD GLU A 30 6.353 -5.428 14.079 1.00 1.00 C ATOM 460 OE1 GLU A 30 5.269 -5.977 13.958 1.00 1.00 O ATOM 461 OE2 GLU A 30 6.837 -5.105 15.150 1.00 1.00 O ATOM 0 H GLU A 30 5.828 -6.732 9.434 1.00 1.00 H new ATOM 0 HA GLU A 30 7.270 -4.484 10.175 1.00 1.00 H new ATOM 0 HB2 GLU A 30 5.514 -5.689 11.519 1.00 1.00 H new ATOM 0 HB3 GLU A 30 6.656 -6.983 11.826 1.00 1.00 H new ATOM 0 HG2 GLU A 30 8.197 -5.388 12.962 1.00 1.00 H new ATOM 0 HG3 GLU A 30 7.117 -4.057 12.600 1.00 1.00 H new ATOM 468 N LYS A 31 9.067 -7.241 10.239 1.00 1.00 N ATOM 469 CA LYS A 31 10.440 -7.729 10.328 1.00 1.00 C ATOM 470 C LYS A 31 11.298 -7.153 9.203 1.00 1.00 C ATOM 471 O LYS A 31 12.432 -6.732 9.430 1.00 1.00 O ATOM 472 CB LYS A 31 10.462 -9.263 10.265 1.00 1.00 C ATOM 473 CG LYS A 31 9.808 -9.846 11.529 1.00 1.00 C ATOM 474 CD LYS A 31 9.831 -11.387 11.486 1.00 1.00 C ATOM 475 CE LYS A 31 9.119 -11.969 12.715 1.00 1.00 C ATOM 476 NZ LYS A 31 9.871 -11.614 13.951 1.00 1.00 N ATOM 0 H LYS A 31 8.374 -7.950 9.998 1.00 1.00 H new ATOM 0 HA LYS A 31 10.855 -7.402 11.282 1.00 1.00 H new ATOM 0 HB2 LYS A 31 9.931 -9.607 9.378 1.00 1.00 H new ATOM 0 HB3 LYS A 31 11.489 -9.618 10.179 1.00 1.00 H new ATOM 0 HG2 LYS A 31 10.336 -9.493 12.415 1.00 1.00 H new ATOM 0 HG3 LYS A 31 8.780 -9.494 11.609 1.00 1.00 H new ATOM 0 HD2 LYS A 31 9.345 -11.739 10.576 1.00 1.00 H new ATOM 0 HD3 LYS A 31 10.862 -11.741 11.454 1.00 1.00 H new ATOM 0 HE2 LYS A 31 8.102 -11.582 12.774 1.00 1.00 H new ATOM 0 HE3 LYS A 31 9.043 -13.052 12.623 1.00 1.00 H new ATOM 0 HZ1 LYS A 31 9.531 -12.196 14.743 1.00 1.00 H new ATOM 0 HZ2 LYS A 31 10.885 -11.790 13.803 1.00 1.00 H new ATOM 0 HZ3 LYS A 31 9.722 -10.608 14.171 1.00 1.00 H new ATOM 490 N ALA A 32 10.744 -7.144 7.995 1.00 1.00 N ATOM 491 CA ALA A 32 11.482 -6.624 6.844 1.00 1.00 C ATOM 492 C ALA A 32 11.604 -5.104 6.916 1.00 1.00 C ATOM 493 O ALA A 32 12.706 -4.557 6.860 1.00 1.00 O ATOM 494 CB ALA A 32 10.769 -7.031 5.556 1.00 1.00 C ATOM 0 H ALA A 32 9.805 -7.483 7.787 1.00 1.00 H new ATOM 0 HA ALA A 32 12.487 -7.045 6.854 1.00 1.00 H new ATOM 0 HB1 ALA A 32 11.318 -6.644 4.698 1.00 1.00 H new ATOM 0 HB2 ALA A 32 10.720 -8.118 5.495 1.00 1.00 H new ATOM 0 HB3 ALA A 32 9.759 -6.622 5.555 1.00 1.00 H new ATOM 500 N ILE A 33 10.460 -4.442 7.045 1.00 1.00 N ATOM 501 CA ILE A 33 10.442 -2.986 7.134 1.00 1.00 C ATOM 502 C ILE A 33 11.354 -2.519 8.267 1.00 1.00 C ATOM 503 O ILE A 33 12.007 -1.480 8.167 1.00 1.00 O ATOM 504 CB ILE A 33 9.010 -2.492 7.379 1.00 1.00 C ATOM 505 CG1 ILE A 33 8.102 -2.986 6.243 1.00 1.00 C ATOM 506 CG2 ILE A 33 8.975 -0.955 7.435 1.00 1.00 C ATOM 507 CD1 ILE A 33 6.680 -2.448 6.433 1.00 1.00 C ATOM 0 H ILE A 33 9.542 -4.884 7.090 1.00 1.00 H new ATOM 0 HA ILE A 33 10.804 -2.571 6.193 1.00 1.00 H new ATOM 0 HB ILE A 33 8.657 -2.885 8.333 1.00 1.00 H new ATOM 0 HG12 ILE A 33 8.498 -2.658 5.282 1.00 1.00 H new ATOM 0 HG13 ILE A 33 8.088 -4.076 6.226 1.00 1.00 H new ATOM 0 HG21 ILE A 33 7.952 -0.620 7.609 1.00 1.00 H new ATOM 0 HG22 ILE A 33 9.614 -0.606 8.246 1.00 1.00 H new ATOM 0 HG23 ILE A 33 9.334 -0.548 6.489 1.00 1.00 H new ATOM 0 HD11 ILE A 33 6.045 -2.804 5.622 1.00 1.00 H new ATOM 0 HD12 ILE A 33 6.283 -2.798 7.386 1.00 1.00 H new ATOM 0 HD13 ILE A 33 6.699 -1.358 6.427 1.00 1.00 H new ATOM 519 N GLN A 34 11.404 -3.281 9.354 1.00 1.00 N ATOM 520 CA GLN A 34 12.241 -2.918 10.497 1.00 1.00 C ATOM 521 C GLN A 34 13.704 -3.218 10.199 1.00 1.00 C ATOM 522 O GLN A 34 14.595 -2.504 10.661 1.00 1.00 O ATOM 523 CB GLN A 34 11.786 -3.688 11.739 1.00 1.00 C ATOM 524 CG GLN A 34 12.663 -3.340 12.946 1.00 1.00 C ATOM 525 CD GLN A 34 12.074 -3.974 14.202 1.00 1.00 C ATOM 526 OE1 GLN A 34 12.661 -3.881 15.279 1.00 1.00 O ATOM 527 NE2 GLN A 34 10.937 -4.617 14.131 1.00 1.00 N ATOM 0 H GLN A 34 10.880 -4.148 9.470 1.00 1.00 H new ATOM 0 HA GLN A 34 12.138 -1.849 10.684 1.00 1.00 H new ATOM 0 HB2 GLN A 34 10.745 -3.450 11.959 1.00 1.00 H new ATOM 0 HB3 GLN A 34 11.834 -4.760 11.546 1.00 1.00 H new ATOM 0 HG2 GLN A 34 13.679 -3.700 12.786 1.00 1.00 H new ATOM 0 HG3 GLN A 34 12.723 -2.258 13.066 1.00 1.00 H new ATOM 0 HE21 GLN A 34 10.450 -4.694 13.238 1.00 1.00 H new ATOM 0 HE22 GLN A 34 10.538 -5.041 14.968 1.00 1.00 H new ATOM 536 N LEU A 35 13.930 -4.275 9.427 1.00 1.00 N ATOM 537 CA LEU A 35 15.293 -4.653 9.076 1.00 1.00 C ATOM 538 C LEU A 35 15.946 -3.576 8.216 1.00 1.00 C ATOM 539 O LEU A 35 17.106 -3.219 8.424 1.00 1.00 O ATOM 540 CB LEU A 35 15.295 -6.013 8.335 1.00 1.00 C ATOM 541 CG LEU A 35 15.302 -7.191 9.336 1.00 1.00 C ATOM 542 CD1 LEU A 35 14.797 -8.467 8.652 1.00 1.00 C ATOM 543 CD2 LEU A 35 16.730 -7.439 9.845 1.00 1.00 C ATOM 0 H LEU A 35 13.202 -4.875 9.039 1.00 1.00 H new ATOM 0 HA LEU A 35 15.872 -4.753 9.994 1.00 1.00 H new ATOM 0 HB2 LEU A 35 14.417 -6.082 7.693 1.00 1.00 H new ATOM 0 HB3 LEU A 35 16.169 -6.077 7.687 1.00 1.00 H new ATOM 0 HG LEU A 35 14.649 -6.937 10.171 1.00 1.00 H new ATOM 0 HD11 LEU A 35 14.806 -9.291 9.366 1.00 1.00 H new ATOM 0 HD12 LEU A 35 13.780 -8.309 8.293 1.00 1.00 H new ATOM 0 HD13 LEU A 35 15.445 -8.710 7.810 1.00 1.00 H new ATOM 0 HD21 LEU A 35 16.726 -8.271 10.550 1.00 1.00 H new ATOM 0 HD22 LEU A 35 17.380 -7.680 9.003 1.00 1.00 H new ATOM 0 HD23 LEU A 35 17.099 -6.543 10.344 1.00 1.00 H new ATOM 555 N ASP A 36 15.194 -3.059 7.250 1.00 1.00 N ATOM 556 CA ASP A 36 15.718 -2.030 6.366 1.00 1.00 C ATOM 557 C ASP A 36 14.598 -1.438 5.495 1.00 1.00 C ATOM 558 O ASP A 36 14.305 -1.985 4.432 1.00 1.00 O ATOM 559 CB ASP A 36 16.795 -2.643 5.467 1.00 1.00 C ATOM 560 CG ASP A 36 17.377 -1.572 4.555 1.00 1.00 C ATOM 561 OD1 ASP A 36 17.269 -0.405 4.899 1.00 1.00 O ATOM 562 OD2 ASP A 36 17.923 -1.932 3.527 1.00 1.00 O ATOM 0 H ASP A 36 14.230 -3.334 7.062 1.00 1.00 H new ATOM 0 HA ASP A 36 16.145 -1.230 6.970 1.00 1.00 H new ATOM 0 HB2 ASP A 36 17.584 -3.082 6.077 1.00 1.00 H new ATOM 0 HB3 ASP A 36 16.368 -3.449 4.870 1.00 1.00 H new ATOM 567 N PRO A 37 13.991 -0.362 5.918 1.00 1.00 N ATOM 568 CA PRO A 37 12.895 0.265 5.133 1.00 1.00 C ATOM 569 C PRO A 37 13.431 1.269 4.108 1.00 1.00 C ATOM 570 O PRO A 37 13.813 2.388 4.449 1.00 1.00 O ATOM 571 CB PRO A 37 12.041 0.936 6.213 1.00 1.00 C ATOM 572 CG PRO A 37 13.025 1.358 7.265 1.00 1.00 C ATOM 573 CD PRO A 37 14.239 0.389 7.166 1.00 1.00 C ATOM 0 HA PRO A 37 12.332 -0.450 4.533 1.00 1.00 H new ATOM 0 HB2 PRO A 37 11.497 1.792 5.813 1.00 1.00 H new ATOM 0 HB3 PRO A 37 11.300 0.247 6.617 1.00 1.00 H new ATOM 0 HG2 PRO A 37 13.341 2.389 7.107 1.00 1.00 H new ATOM 0 HG3 PRO A 37 12.574 1.311 8.256 1.00 1.00 H new ATOM 0 HD2 PRO A 37 15.183 0.933 7.124 1.00 1.00 H new ATOM 0 HD3 PRO A 37 14.292 -0.275 8.029 1.00 1.00 H new ATOM 581 N GLU A 38 13.461 0.867 2.841 1.00 1.00 N ATOM 582 CA GLU A 38 13.947 1.730 1.764 1.00 1.00 C ATOM 583 C GLU A 38 13.540 1.159 0.406 1.00 1.00 C ATOM 584 O GLU A 38 14.346 1.105 -0.523 1.00 1.00 O ATOM 585 CB GLU A 38 15.483 1.854 1.842 1.00 1.00 C ATOM 586 CG GLU A 38 15.970 3.062 1.028 1.00 1.00 C ATOM 587 CD GLU A 38 17.488 3.176 1.118 1.00 1.00 C ATOM 588 OE1 GLU A 38 18.061 2.529 1.978 1.00 1.00 O ATOM 589 OE2 GLU A 38 18.054 3.908 0.325 1.00 1.00 O ATOM 0 H GLU A 38 13.153 -0.055 2.532 1.00 1.00 H new ATOM 0 HA GLU A 38 13.502 2.719 1.878 1.00 1.00 H new ATOM 0 HB2 GLU A 38 15.792 1.961 2.882 1.00 1.00 H new ATOM 0 HB3 GLU A 38 15.946 0.943 1.464 1.00 1.00 H new ATOM 0 HG2 GLU A 38 15.667 2.955 -0.013 1.00 1.00 H new ATOM 0 HG3 GLU A 38 15.506 3.974 1.403 1.00 1.00 H new ATOM 596 N GLU A 39 12.288 0.730 0.281 1.00 1.00 N ATOM 597 CA GLU A 39 11.775 0.163 -0.963 1.00 1.00 C ATOM 598 C GLU A 39 10.251 0.274 -1.011 1.00 1.00 C ATOM 599 O GLU A 39 9.539 -0.535 -0.415 1.00 1.00 O ATOM 600 CB GLU A 39 12.212 -1.318 -1.074 1.00 1.00 C ATOM 601 CG GLU A 39 12.976 -1.551 -2.381 1.00 1.00 C ATOM 602 CD GLU A 39 14.300 -0.793 -2.364 1.00 1.00 C ATOM 603 OE1 GLU A 39 15.179 -1.190 -1.618 1.00 1.00 O ATOM 604 OE2 GLU A 39 14.414 0.181 -3.093 1.00 1.00 O ATOM 0 H GLU A 39 11.602 0.765 1.035 1.00 1.00 H new ATOM 0 HA GLU A 39 12.184 0.721 -1.806 1.00 1.00 H new ATOM 0 HB2 GLU A 39 12.842 -1.583 -0.225 1.00 1.00 H new ATOM 0 HB3 GLU A 39 11.337 -1.966 -1.036 1.00 1.00 H new ATOM 0 HG2 GLU A 39 13.161 -2.617 -2.517 1.00 1.00 H new ATOM 0 HG3 GLU A 39 12.372 -1.222 -3.227 1.00 1.00 H new ATOM 611 N SER A 40 9.746 1.277 -1.724 1.00 1.00 N ATOM 612 CA SER A 40 8.313 1.477 -1.842 1.00 1.00 C ATOM 613 C SER A 40 7.614 0.172 -2.206 1.00 1.00 C ATOM 614 O SER A 40 6.430 -0.004 -1.919 1.00 1.00 O ATOM 615 CB SER A 40 8.030 2.520 -2.914 1.00 1.00 C ATOM 616 OG SER A 40 6.654 2.465 -3.270 1.00 1.00 O ATOM 0 H SER A 40 10.311 1.961 -2.227 1.00 1.00 H new ATOM 0 HA SER A 40 7.931 1.821 -0.881 1.00 1.00 H new ATOM 0 HB2 SER A 40 8.283 3.514 -2.546 1.00 1.00 H new ATOM 0 HB3 SER A 40 8.652 2.336 -3.790 1.00 1.00 H new ATOM 0 HG SER A 40 6.467 3.136 -3.959 1.00 1.00 H new ATOM 622 N LYS A 41 8.341 -0.742 -2.839 1.00 1.00 N ATOM 623 CA LYS A 41 7.776 -2.028 -3.238 1.00 1.00 C ATOM 624 C LYS A 41 7.077 -2.691 -2.055 1.00 1.00 C ATOM 625 O LYS A 41 5.987 -3.246 -2.192 1.00 1.00 O ATOM 626 CB LYS A 41 8.901 -2.955 -3.761 1.00 1.00 C ATOM 627 CG LYS A 41 8.502 -3.631 -5.089 1.00 1.00 C ATOM 628 CD LYS A 41 8.651 -2.646 -6.261 1.00 1.00 C ATOM 629 CE LYS A 41 8.378 -3.376 -7.578 1.00 1.00 C ATOM 630 NZ LYS A 41 8.502 -2.425 -8.721 1.00 1.00 N ATOM 0 H LYS A 41 9.322 -0.617 -3.087 1.00 1.00 H new ATOM 0 HA LYS A 41 7.046 -1.858 -4.030 1.00 1.00 H new ATOM 0 HB2 LYS A 41 9.813 -2.376 -3.905 1.00 1.00 H new ATOM 0 HB3 LYS A 41 9.122 -3.718 -3.015 1.00 1.00 H new ATOM 0 HG2 LYS A 41 9.128 -4.507 -5.260 1.00 1.00 H new ATOM 0 HG3 LYS A 41 7.472 -3.982 -5.030 1.00 1.00 H new ATOM 0 HD2 LYS A 41 7.956 -1.815 -6.142 1.00 1.00 H new ATOM 0 HD3 LYS A 41 9.655 -2.223 -6.269 1.00 1.00 H new ATOM 0 HE2 LYS A 41 9.082 -4.199 -7.700 1.00 1.00 H new ATOM 0 HE3 LYS A 41 7.379 -3.811 -7.562 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 8.315 -2.927 -9.612 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 7.813 -1.654 -8.607 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 9.464 -2.030 -8.741 1.00 1.00 H new ATOM 644 N TYR A 42 7.685 -2.643 -0.872 1.00 1.00 N ATOM 645 CA TYR A 42 7.112 -3.246 0.320 1.00 1.00 C ATOM 646 C TYR A 42 6.078 -2.312 0.931 1.00 1.00 C ATOM 647 O TYR A 42 5.047 -2.748 1.444 1.00 1.00 O ATOM 648 CB TYR A 42 8.239 -3.570 1.333 1.00 1.00 C ATOM 649 CG TYR A 42 8.673 -2.320 2.090 1.00 1.00 C ATOM 650 CD1 TYR A 42 7.823 -1.753 3.050 1.00 1.00 C ATOM 651 CD2 TYR A 42 9.915 -1.734 1.834 1.00 1.00 C ATOM 652 CE1 TYR A 42 8.214 -0.610 3.745 1.00 1.00 C ATOM 653 CE2 TYR A 42 10.304 -0.590 2.533 1.00 1.00 C ATOM 654 CZ TYR A 42 9.455 -0.028 3.487 1.00 1.00 C ATOM 655 OH TYR A 42 9.857 1.094 4.183 1.00 1.00 O ATOM 0 H TYR A 42 8.584 -2.187 -0.717 1.00 1.00 H new ATOM 0 HA TYR A 42 6.611 -4.176 0.053 1.00 1.00 H new ATOM 0 HB2 TYR A 42 7.892 -4.324 2.039 1.00 1.00 H new ATOM 0 HB3 TYR A 42 9.094 -3.995 0.807 1.00 1.00 H new ATOM 0 HD1 TYR A 42 6.862 -2.203 3.252 1.00 1.00 H new ATOM 0 HD2 TYR A 42 10.574 -2.166 1.095 1.00 1.00 H new ATOM 0 HE1 TYR A 42 7.556 -0.175 4.483 1.00 1.00 H new ATOM 0 HE2 TYR A 42 11.265 -0.139 2.335 1.00 1.00 H new ATOM 0 HH TYR A 42 9.072 1.546 4.556 1.00 1.00 H new ATOM 665 N TRP A 43 6.368 -1.016 0.880 1.00 1.00 N ATOM 666 CA TRP A 43 5.474 -0.018 1.458 1.00 1.00 C ATOM 667 C TRP A 43 4.195 0.080 0.632 1.00 1.00 C ATOM 668 O TRP A 43 3.113 0.329 1.162 1.00 1.00 O ATOM 669 CB TRP A 43 6.194 1.352 1.527 1.00 1.00 C ATOM 670 CG TRP A 43 6.415 1.775 2.947 1.00 1.00 C ATOM 671 CD1 TRP A 43 7.578 2.236 3.456 1.00 1.00 C ATOM 672 CD2 TRP A 43 5.457 1.776 4.039 1.00 1.00 C ATOM 673 NE1 TRP A 43 7.394 2.509 4.801 1.00 1.00 N ATOM 674 CE2 TRP A 43 6.098 2.245 5.204 1.00 1.00 C ATOM 675 CE3 TRP A 43 4.102 1.417 4.126 1.00 1.00 C ATOM 676 CZ2 TRP A 43 5.416 2.355 6.419 1.00 1.00 C ATOM 677 CZ3 TRP A 43 3.412 1.523 5.338 1.00 1.00 C ATOM 678 CH2 TRP A 43 4.065 1.991 6.484 1.00 1.00 C ATOM 0 H TRP A 43 7.209 -0.634 0.448 1.00 1.00 H new ATOM 0 HA TRP A 43 5.203 -0.318 2.470 1.00 1.00 H new ATOM 0 HB2 TRP A 43 7.151 1.289 1.010 1.00 1.00 H new ATOM 0 HB3 TRP A 43 5.600 2.105 1.008 1.00 1.00 H new ATOM 0 HD1 TRP A 43 8.498 2.369 2.906 1.00 1.00 H new ATOM 0 HE1 TRP A 43 8.125 2.862 5.419 1.00 1.00 H new ATOM 0 HE3 TRP A 43 3.588 1.055 3.248 1.00 1.00 H new ATOM 0 HZ2 TRP A 43 5.926 2.717 7.299 1.00 1.00 H new ATOM 0 HZ3 TRP A 43 2.370 1.242 5.390 1.00 1.00 H new ATOM 0 HH2 TRP A 43 3.528 2.071 7.417 1.00 1.00 H new ATOM 689 N LEU A 44 4.346 -0.121 -0.673 1.00 1.00 N ATOM 690 CA LEU A 44 3.213 -0.048 -1.568 1.00 1.00 C ATOM 691 C LEU A 44 2.227 -1.170 -1.253 1.00 1.00 C ATOM 692 O LEU A 44 1.014 -0.975 -1.324 1.00 1.00 O ATOM 693 CB LEU A 44 3.693 -0.140 -3.026 1.00 1.00 C ATOM 694 CG LEU A 44 2.495 -0.191 -4.007 1.00 1.00 C ATOM 695 CD1 LEU A 44 2.105 1.224 -4.438 1.00 1.00 C ATOM 696 CD2 LEU A 44 2.869 -1.021 -5.241 1.00 1.00 C ATOM 0 H LEU A 44 5.236 -0.333 -1.124 1.00 1.00 H new ATOM 0 HA LEU A 44 2.705 0.906 -1.429 1.00 1.00 H new ATOM 0 HB2 LEU A 44 4.322 0.719 -3.260 1.00 1.00 H new ATOM 0 HB3 LEU A 44 4.309 -1.030 -3.153 1.00 1.00 H new ATOM 0 HG LEU A 44 1.647 -0.655 -3.503 1.00 1.00 H new ATOM 0 HD11 LEU A 44 1.262 1.175 -5.127 1.00 1.00 H new ATOM 0 HD12 LEU A 44 1.823 1.807 -3.561 1.00 1.00 H new ATOM 0 HD13 LEU A 44 2.951 1.700 -4.933 1.00 1.00 H new ATOM 0 HD21 LEU A 44 2.023 -1.054 -5.928 1.00 1.00 H new ATOM 0 HD22 LEU A 44 3.724 -0.566 -5.740 1.00 1.00 H new ATOM 0 HD23 LEU A 44 3.126 -2.035 -4.933 1.00 1.00 H new ATOM 708 N MET A 45 2.764 -2.339 -0.919 1.00 1.00 N ATOM 709 CA MET A 45 1.900 -3.476 -0.638 1.00 1.00 C ATOM 710 C MET A 45 0.996 -3.179 0.557 1.00 1.00 C ATOM 711 O MET A 45 -0.196 -3.484 0.522 1.00 1.00 O ATOM 712 CB MET A 45 2.772 -4.707 -0.353 1.00 1.00 C ATOM 713 CG MET A 45 3.357 -5.242 -1.669 1.00 1.00 C ATOM 714 SD MET A 45 4.492 -6.615 -1.334 1.00 1.00 S ATOM 715 CE MET A 45 3.275 -7.958 -1.343 1.00 1.00 C ATOM 0 H MET A 45 3.764 -2.521 -0.838 1.00 1.00 H new ATOM 0 HA MET A 45 1.265 -3.670 -1.502 1.00 1.00 H new ATOM 0 HB2 MET A 45 3.577 -4.444 0.334 1.00 1.00 H new ATOM 0 HB3 MET A 45 2.178 -5.481 0.134 1.00 1.00 H new ATOM 0 HG2 MET A 45 2.553 -5.577 -2.324 1.00 1.00 H new ATOM 0 HG3 MET A 45 3.884 -4.444 -2.193 1.00 1.00 H new ATOM 0 HE1 MET A 45 3.778 -8.906 -1.152 1.00 1.00 H new ATOM 0 HE2 MET A 45 2.531 -7.780 -0.567 1.00 1.00 H new ATOM 0 HE3 MET A 45 2.784 -7.997 -2.315 1.00 1.00 H new ATOM 725 N LYS A 46 1.600 -2.589 1.581 1.00 1.00 N ATOM 726 CA LYS A 46 0.828 -2.262 2.778 1.00 1.00 C ATOM 727 C LYS A 46 -0.442 -1.500 2.419 1.00 1.00 C ATOM 728 O LYS A 46 -1.529 -1.847 2.879 1.00 1.00 O ATOM 729 CB LYS A 46 1.663 -1.403 3.732 1.00 1.00 C ATOM 730 CG LYS A 46 2.900 -2.189 4.224 1.00 1.00 C ATOM 731 CD LYS A 46 2.723 -2.629 5.697 1.00 1.00 C ATOM 732 CE LYS A 46 1.619 -3.689 5.818 1.00 1.00 C ATOM 733 NZ LYS A 46 0.285 -3.020 5.838 1.00 1.00 N ATOM 0 H LYS A 46 2.587 -2.333 1.612 1.00 1.00 H new ATOM 0 HA LYS A 46 0.559 -3.201 3.262 1.00 1.00 H new ATOM 0 HB2 LYS A 46 1.981 -0.491 3.226 1.00 1.00 H new ATOM 0 HB3 LYS A 46 1.055 -1.099 4.584 1.00 1.00 H new ATOM 0 HG2 LYS A 46 3.053 -3.065 3.594 1.00 1.00 H new ATOM 0 HG3 LYS A 46 3.791 -1.569 4.130 1.00 1.00 H new ATOM 0 HD2 LYS A 46 3.662 -3.030 6.077 1.00 1.00 H new ATOM 0 HD3 LYS A 46 2.473 -1.765 6.312 1.00 1.00 H new ATOM 0 HE2 LYS A 46 1.676 -4.385 4.981 1.00 1.00 H new ATOM 0 HE3 LYS A 46 1.759 -4.272 6.728 1.00 1.00 H new ATOM 0 HZ1 LYS A 46 -0.319 -3.472 6.554 1.00 1.00 H new ATOM 0 HZ2 LYS A 46 0.405 -2.014 6.071 1.00 1.00 H new ATOM 0 HZ3 LYS A 46 -0.162 -3.108 4.903 1.00 1.00 H new ATOM 747 N GLY A 47 -0.305 -0.463 1.599 1.00 1.00 N ATOM 748 CA GLY A 47 -1.458 0.335 1.204 1.00 1.00 C ATOM 749 C GLY A 47 -2.580 -0.554 0.670 1.00 1.00 C ATOM 750 O GLY A 47 -3.732 -0.416 1.081 1.00 1.00 O ATOM 0 H GLY A 47 0.583 -0.159 1.199 1.00 1.00 H new ATOM 0 HA2 GLY A 47 -1.818 0.908 2.058 1.00 1.00 H new ATOM 0 HA3 GLY A 47 -1.163 1.054 0.439 1.00 1.00 H new ATOM 754 N LYS A 48 -2.232 -1.458 -0.240 1.00 1.00 N ATOM 755 CA LYS A 48 -3.229 -2.354 -0.820 1.00 1.00 C ATOM 756 C LYS A 48 -3.922 -3.157 0.283 1.00 1.00 C ATOM 757 O LYS A 48 -5.132 -3.381 0.225 1.00 1.00 O ATOM 758 CB LYS A 48 -2.562 -3.323 -1.806 1.00 1.00 C ATOM 759 CG LYS A 48 -1.815 -2.537 -2.894 1.00 1.00 C ATOM 760 CD LYS A 48 -1.186 -3.504 -3.923 1.00 1.00 C ATOM 761 CE LYS A 48 -0.120 -2.772 -4.755 1.00 1.00 C ATOM 762 NZ LYS A 48 0.121 -3.518 -6.025 1.00 1.00 N ATOM 0 H LYS A 48 -1.282 -1.590 -0.588 1.00 1.00 H new ATOM 0 HA LYS A 48 -3.967 -1.751 -1.349 1.00 1.00 H new ATOM 0 HB2 LYS A 48 -1.867 -3.974 -1.275 1.00 1.00 H new ATOM 0 HB3 LYS A 48 -3.315 -3.965 -2.263 1.00 1.00 H new ATOM 0 HG2 LYS A 48 -2.503 -1.858 -3.397 1.00 1.00 H new ATOM 0 HG3 LYS A 48 -1.037 -1.924 -2.439 1.00 1.00 H new ATOM 0 HD2 LYS A 48 -0.736 -4.353 -3.408 1.00 1.00 H new ATOM 0 HD3 LYS A 48 -1.960 -3.903 -4.579 1.00 1.00 H new ATOM 0 HE2 LYS A 48 -0.449 -1.756 -4.975 1.00 1.00 H new ATOM 0 HE3 LYS A 48 0.807 -2.691 -4.187 1.00 1.00 H new ATOM 0 HZ1 LYS A 48 0.842 -3.022 -6.587 1.00 1.00 H new ATOM 0 HZ2 LYS A 48 0.453 -4.479 -5.806 1.00 1.00 H new ATOM 0 HZ3 LYS A 48 -0.764 -3.573 -6.568 1.00 1.00 H new ATOM 776 N ALA A 49 -3.159 -3.587 1.282 1.00 1.00 N ATOM 777 CA ALA A 49 -3.733 -4.363 2.381 1.00 1.00 C ATOM 778 C ALA A 49 -4.764 -3.540 3.148 1.00 1.00 C ATOM 779 O ALA A 49 -5.889 -3.988 3.374 1.00 1.00 O ATOM 780 CB ALA A 49 -2.622 -4.815 3.330 1.00 1.00 C ATOM 0 H ALA A 49 -2.156 -3.416 1.356 1.00 1.00 H new ATOM 0 HA ALA A 49 -4.233 -5.236 1.962 1.00 1.00 H new ATOM 0 HB1 ALA A 49 -3.054 -5.393 4.147 1.00 1.00 H new ATOM 0 HB2 ALA A 49 -1.908 -5.434 2.786 1.00 1.00 H new ATOM 0 HB3 ALA A 49 -2.111 -3.941 3.734 1.00 1.00 H new ATOM 786 N LEU A 50 -4.351 -2.339 3.540 1.00 1.00 N ATOM 787 CA LEU A 50 -5.250 -1.459 4.283 1.00 1.00 C ATOM 788 C LEU A 50 -6.486 -1.123 3.450 1.00 1.00 C ATOM 789 O LEU A 50 -7.603 -1.133 3.967 1.00 1.00 O ATOM 790 CB LEU A 50 -4.495 -0.172 4.652 1.00 1.00 C ATOM 791 CG LEU A 50 -3.775 -0.342 6.004 1.00 1.00 C ATOM 792 CD1 LEU A 50 -2.840 -1.548 5.939 1.00 1.00 C ATOM 793 CD2 LEU A 50 -2.960 0.921 6.346 1.00 1.00 C ATOM 0 H LEU A 50 -3.422 -1.958 3.362 1.00 1.00 H new ATOM 0 HA LEU A 50 -5.581 -1.966 5.189 1.00 1.00 H new ATOM 0 HB2 LEU A 50 -3.770 0.068 3.874 1.00 1.00 H new ATOM 0 HB3 LEU A 50 -5.193 0.664 4.707 1.00 1.00 H new ATOM 0 HG LEU A 50 -4.524 -0.498 6.780 1.00 1.00 H new ATOM 0 HD11 LEU A 50 -2.332 -1.666 6.896 1.00 1.00 H new ATOM 0 HD12 LEU A 50 -3.419 -2.446 5.722 1.00 1.00 H new ATOM 0 HD13 LEU A 50 -2.101 -1.394 5.153 1.00 1.00 H new ATOM 0 HD21 LEU A 50 -2.459 0.782 7.304 1.00 1.00 H new ATOM 0 HD22 LEU A 50 -2.216 1.095 5.569 1.00 1.00 H new ATOM 0 HD23 LEU A 50 -3.628 1.780 6.407 1.00 1.00 H new ATOM 805 N TYR A 51 -6.279 -0.831 2.170 1.00 1.00 N ATOM 806 CA TYR A 51 -7.393 -0.496 1.302 1.00 1.00 C ATOM 807 C TYR A 51 -8.384 -1.655 1.235 1.00 1.00 C ATOM 808 O TYR A 51 -9.588 -1.473 1.420 1.00 1.00 O ATOM 809 CB TYR A 51 -6.865 -0.166 -0.103 1.00 1.00 C ATOM 810 CG TYR A 51 -7.998 -0.233 -1.113 1.00 1.00 C ATOM 811 CD1 TYR A 51 -8.847 0.859 -1.280 1.00 1.00 C ATOM 812 CD2 TYR A 51 -8.201 -1.403 -1.865 1.00 1.00 C ATOM 813 CE1 TYR A 51 -9.900 0.791 -2.203 1.00 1.00 C ATOM 814 CE2 TYR A 51 -9.253 -1.467 -2.785 1.00 1.00 C ATOM 815 CZ TYR A 51 -10.100 -0.371 -2.955 1.00 1.00 C ATOM 816 OH TYR A 51 -11.135 -0.434 -3.864 1.00 1.00 O ATOM 0 H TYR A 51 -5.364 -0.820 1.720 1.00 1.00 H new ATOM 0 HA TYR A 51 -7.911 0.374 1.706 1.00 1.00 H new ATOM 0 HB2 TYR A 51 -6.420 0.829 -0.109 1.00 1.00 H new ATOM 0 HB3 TYR A 51 -6.079 -0.868 -0.379 1.00 1.00 H new ATOM 0 HD1 TYR A 51 -8.694 1.757 -0.699 1.00 1.00 H new ATOM 0 HD2 TYR A 51 -7.546 -2.251 -1.733 1.00 1.00 H new ATOM 0 HE1 TYR A 51 -10.558 1.637 -2.334 1.00 1.00 H new ATOM 0 HE2 TYR A 51 -9.410 -2.365 -3.364 1.00 1.00 H new ATOM 0 HH TYR A 51 -11.132 -1.310 -4.303 1.00 1.00 H new ATOM 826 N ASN A 52 -7.882 -2.857 0.970 1.00 1.00 N ATOM 827 CA ASN A 52 -8.738 -4.027 0.876 1.00 1.00 C ATOM 828 C ASN A 52 -9.466 -4.266 2.190 1.00 1.00 C ATOM 829 O ASN A 52 -10.574 -4.800 2.196 1.00 1.00 O ATOM 830 CB ASN A 52 -7.902 -5.252 0.510 1.00 1.00 C ATOM 831 CG ASN A 52 -8.794 -6.484 0.404 1.00 1.00 C ATOM 832 OD1 ASN A 52 -9.991 -6.365 0.144 1.00 1.00 O ATOM 833 ND2 ASN A 52 -8.278 -7.666 0.592 1.00 1.00 N ATOM 0 H ASN A 52 -6.891 -3.043 0.818 1.00 1.00 H new ATOM 0 HA ASN A 52 -9.481 -3.853 0.098 1.00 1.00 H new ATOM 0 HB2 ASN A 52 -7.390 -5.082 -0.437 1.00 1.00 H new ATOM 0 HB3 ASN A 52 -7.132 -5.415 1.264 1.00 1.00 H new ATOM 0 HD21 ASN A 52 -8.867 -8.496 0.524 1.00 1.00 H new ATOM 0 HD22 ASN A 52 -7.286 -7.761 0.807 1.00 1.00 H new ATOM 840 N LEU A 53 -8.834 -3.873 3.291 1.00 1.00 N ATOM 841 CA LEU A 53 -9.419 -4.049 4.616 1.00 1.00 C ATOM 842 C LEU A 53 -10.503 -3.019 4.866 1.00 1.00 C ATOM 843 O LEU A 53 -11.082 -2.961 5.950 1.00 1.00 O ATOM 844 CB LEU A 53 -8.326 -3.952 5.700 1.00 1.00 C ATOM 845 CG LEU A 53 -7.472 -5.238 5.700 1.00 1.00 C ATOM 846 CD1 LEU A 53 -6.176 -5.007 6.498 1.00 1.00 C ATOM 847 CD2 LEU A 53 -8.286 -6.406 6.314 1.00 1.00 C ATOM 0 H LEU A 53 -7.915 -3.430 3.292 1.00 1.00 H new ATOM 0 HA LEU A 53 -9.872 -5.039 4.662 1.00 1.00 H new ATOM 0 HB2 LEU A 53 -7.693 -3.084 5.514 1.00 1.00 H new ATOM 0 HB3 LEU A 53 -8.784 -3.809 6.679 1.00 1.00 H new ATOM 0 HG LEU A 53 -7.207 -5.496 4.675 1.00 1.00 H new ATOM 0 HD11 LEU A 53 -5.579 -5.919 6.494 1.00 1.00 H new ATOM 0 HD12 LEU A 53 -5.607 -4.198 6.041 1.00 1.00 H new ATOM 0 HD13 LEU A 53 -6.424 -4.741 7.525 1.00 1.00 H new ATOM 0 HD21 LEU A 53 -7.680 -7.312 6.312 1.00 1.00 H new ATOM 0 HD22 LEU A 53 -8.564 -6.157 7.338 1.00 1.00 H new ATOM 0 HD23 LEU A 53 -9.187 -6.571 5.724 1.00 1.00 H new ATOM 859 N GLU A 54 -10.798 -2.202 3.860 1.00 1.00 N ATOM 860 CA GLU A 54 -11.832 -1.169 3.954 1.00 1.00 C ATOM 861 C GLU A 54 -11.292 0.053 4.688 1.00 1.00 C ATOM 862 O GLU A 54 -12.052 0.813 5.289 1.00 1.00 O ATOM 863 CB GLU A 54 -13.070 -1.713 4.707 1.00 1.00 C ATOM 864 CG GLU A 54 -14.327 -0.919 4.333 1.00 1.00 C ATOM 865 CD GLU A 54 -15.548 -1.542 5.001 1.00 1.00 C ATOM 866 OE1 GLU A 54 -15.365 -2.385 5.864 1.00 1.00 O ATOM 867 OE2 GLU A 54 -16.650 -1.171 4.633 1.00 1.00 O ATOM 0 H GLU A 54 -10.329 -2.235 2.955 1.00 1.00 H new ATOM 0 HA GLU A 54 -12.123 -0.884 2.943 1.00 1.00 H new ATOM 0 HB2 GLU A 54 -13.214 -2.766 4.466 1.00 1.00 H new ATOM 0 HB3 GLU A 54 -12.903 -1.653 5.782 1.00 1.00 H new ATOM 0 HG2 GLU A 54 -14.219 0.119 4.647 1.00 1.00 H new ATOM 0 HG3 GLU A 54 -14.456 -0.913 3.251 1.00 1.00 H new ATOM 874 N ARG A 55 -9.978 0.249 4.641 1.00 1.00 N ATOM 875 CA ARG A 55 -9.338 1.382 5.303 1.00 1.00 C ATOM 876 C ARG A 55 -8.785 2.353 4.264 1.00 1.00 C ATOM 877 O ARG A 55 -7.572 2.525 4.140 1.00 1.00 O ATOM 878 CB ARG A 55 -8.203 0.884 6.201 1.00 1.00 C ATOM 879 CG ARG A 55 -8.709 -0.246 7.100 1.00 1.00 C ATOM 880 CD ARG A 55 -7.580 -0.710 8.025 1.00 1.00 C ATOM 881 NE ARG A 55 -8.032 -1.824 8.855 1.00 1.00 N ATOM 882 CZ ARG A 55 -8.714 -1.615 9.977 1.00 1.00 C ATOM 883 NH1 ARG A 55 -8.994 -0.396 10.353 1.00 1.00 N ATOM 884 NH2 ARG A 55 -9.104 -2.627 10.701 1.00 1.00 N ATOM 0 H ARG A 55 -9.331 -0.367 4.148 1.00 1.00 H new ATOM 0 HA ARG A 55 -10.079 1.900 5.913 1.00 1.00 H new ATOM 0 HB2 ARG A 55 -7.372 0.530 5.590 1.00 1.00 H new ATOM 0 HB3 ARG A 55 -7.824 1.704 6.811 1.00 1.00 H new ATOM 0 HG2 ARG A 55 -9.558 0.098 7.690 1.00 1.00 H new ATOM 0 HG3 ARG A 55 -9.060 -1.079 6.491 1.00 1.00 H new ATOM 0 HD2 ARG A 55 -6.717 -1.015 7.433 1.00 1.00 H new ATOM 0 HD3 ARG A 55 -7.256 0.116 8.658 1.00 1.00 H new ATOM 0 HE ARG A 55 -7.820 -2.780 8.568 1.00 1.00 H new ATOM 0 HH11 ARG A 55 -8.689 0.395 9.786 1.00 1.00 H new ATOM 0 HH12 ARG A 55 -9.517 -0.235 11.214 1.00 1.00 H new ATOM 0 HH21 ARG A 55 -8.886 -3.579 10.407 1.00 1.00 H new ATOM 0 HH22 ARG A 55 -9.627 -2.467 11.562 1.00 1.00 H new ATOM 898 N TYR A 56 -9.686 2.989 3.522 1.00 1.00 N ATOM 899 CA TYR A 56 -9.281 3.941 2.491 1.00 1.00 C ATOM 900 C TYR A 56 -8.448 5.065 3.107 1.00 1.00 C ATOM 901 O TYR A 56 -7.455 5.510 2.531 1.00 1.00 O ATOM 902 CB TYR A 56 -10.524 4.531 1.813 1.00 1.00 C ATOM 903 CG TYR A 56 -11.516 3.422 1.538 1.00 1.00 C ATOM 904 CD1 TYR A 56 -12.460 3.073 2.511 1.00 1.00 C ATOM 905 CD2 TYR A 56 -11.495 2.749 0.311 1.00 1.00 C ATOM 906 CE1 TYR A 56 -13.380 2.049 2.258 1.00 1.00 C ATOM 907 CE2 TYR A 56 -12.415 1.725 0.058 1.00 1.00 C ATOM 908 CZ TYR A 56 -13.357 1.376 1.030 1.00 1.00 C ATOM 909 OH TYR A 56 -14.266 0.367 0.781 1.00 1.00 O ATOM 0 H TYR A 56 -10.694 2.865 3.613 1.00 1.00 H new ATOM 0 HA TYR A 56 -8.677 3.420 1.749 1.00 1.00 H new ATOM 0 HB2 TYR A 56 -10.976 5.289 2.453 1.00 1.00 H new ATOM 0 HB3 TYR A 56 -10.245 5.025 0.882 1.00 1.00 H new ATOM 0 HD1 TYR A 56 -12.478 3.594 3.457 1.00 1.00 H new ATOM 0 HD2 TYR A 56 -10.769 3.020 -0.441 1.00 1.00 H new ATOM 0 HE1 TYR A 56 -14.107 1.778 3.009 1.00 1.00 H new ATOM 0 HE2 TYR A 56 -12.397 1.205 -0.888 1.00 1.00 H new ATOM 0 HH TYR A 56 -14.115 0.005 -0.117 1.00 1.00 H new ATOM 919 N GLU A 57 -8.866 5.515 4.286 1.00 1.00 N ATOM 920 CA GLU A 57 -8.151 6.586 4.968 1.00 1.00 C ATOM 921 C GLU A 57 -6.752 6.130 5.375 1.00 1.00 C ATOM 922 O GLU A 57 -5.766 6.808 5.092 1.00 1.00 O ATOM 923 CB GLU A 57 -8.940 7.014 6.210 1.00 1.00 C ATOM 924 CG GLU A 57 -8.336 8.292 6.803 1.00 1.00 C ATOM 925 CD GLU A 57 -8.634 9.485 5.897 1.00 1.00 C ATOM 926 OE1 GLU A 57 -9.390 9.316 4.954 1.00 1.00 O ATOM 927 OE2 GLU A 57 -8.106 10.551 6.162 1.00 1.00 O ATOM 0 H GLU A 57 -9.684 5.161 4.782 1.00 1.00 H new ATOM 0 HA GLU A 57 -8.051 7.431 4.286 1.00 1.00 H new ATOM 0 HB2 GLU A 57 -9.984 7.184 5.946 1.00 1.00 H new ATOM 0 HB3 GLU A 57 -8.925 6.217 6.953 1.00 1.00 H new ATOM 0 HG2 GLU A 57 -8.746 8.470 7.797 1.00 1.00 H new ATOM 0 HG3 GLU A 57 -7.259 8.174 6.919 1.00 1.00 H new ATOM 934 N GLU A 58 -6.685 4.981 6.042 1.00 1.00 N ATOM 935 CA GLU A 58 -5.398 4.461 6.483 1.00 1.00 C ATOM 936 C GLU A 58 -4.532 4.082 5.281 1.00 1.00 C ATOM 937 O GLU A 58 -3.327 4.330 5.269 1.00 1.00 O ATOM 938 CB GLU A 58 -5.607 3.233 7.383 1.00 1.00 C ATOM 939 CG GLU A 58 -4.447 3.115 8.387 1.00 1.00 C ATOM 940 CD GLU A 58 -4.586 4.180 9.471 1.00 1.00 C ATOM 941 OE1 GLU A 58 -5.609 4.847 9.496 1.00 1.00 O ATOM 942 OE2 GLU A 58 -3.669 4.315 10.262 1.00 1.00 O ATOM 0 H GLU A 58 -7.490 4.404 6.284 1.00 1.00 H new ATOM 0 HA GLU A 58 -4.887 5.239 7.050 1.00 1.00 H new ATOM 0 HB2 GLU A 58 -6.554 3.319 7.916 1.00 1.00 H new ATOM 0 HB3 GLU A 58 -5.665 2.331 6.774 1.00 1.00 H new ATOM 0 HG2 GLU A 58 -4.445 2.123 8.838 1.00 1.00 H new ATOM 0 HG3 GLU A 58 -3.494 3.232 7.870 1.00 1.00 H new ATOM 949 N ALA A 59 -5.157 3.476 4.275 1.00 1.00 N ATOM 950 CA ALA A 59 -4.430 3.058 3.086 1.00 1.00 C ATOM 951 C ALA A 59 -3.659 4.232 2.491 1.00 1.00 C ATOM 952 O ALA A 59 -2.543 4.065 2.001 1.00 1.00 O ATOM 953 CB ALA A 59 -5.408 2.491 2.056 1.00 1.00 C ATOM 0 H ALA A 59 -6.155 3.266 4.261 1.00 1.00 H new ATOM 0 HA ALA A 59 -3.715 2.284 3.364 1.00 1.00 H new ATOM 0 HB1 ALA A 59 -4.860 2.179 1.167 1.00 1.00 H new ATOM 0 HB2 ALA A 59 -5.928 1.633 2.482 1.00 1.00 H new ATOM 0 HB3 ALA A 59 -6.135 3.257 1.784 1.00 1.00 H new ATOM 959 N VAL A 60 -4.261 5.417 2.544 1.00 1.00 N ATOM 960 CA VAL A 60 -3.615 6.617 2.028 1.00 1.00 C ATOM 961 C VAL A 60 -2.331 6.894 2.803 1.00 1.00 C ATOM 962 O VAL A 60 -1.372 7.440 2.257 1.00 1.00 O ATOM 963 CB VAL A 60 -4.577 7.817 2.105 1.00 1.00 C ATOM 964 CG1 VAL A 60 -3.813 9.146 1.954 1.00 1.00 C ATOM 965 CG2 VAL A 60 -5.622 7.707 0.988 1.00 1.00 C ATOM 0 H VAL A 60 -5.190 5.570 2.937 1.00 1.00 H new ATOM 0 HA VAL A 60 -3.356 6.459 0.981 1.00 1.00 H new ATOM 0 HB VAL A 60 -5.065 7.804 3.079 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -4.515 9.978 2.012 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -3.077 9.236 2.753 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -3.305 9.166 0.990 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -6.303 8.556 1.042 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -5.121 7.705 0.020 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -6.186 6.782 1.107 1.00 1.00 H new ATOM 975 N ASP A 61 -2.292 6.528 4.079 1.00 1.00 N ATOM 976 CA ASP A 61 -1.120 6.769 4.904 1.00 1.00 C ATOM 977 C ASP A 61 0.098 6.063 4.314 1.00 1.00 C ATOM 978 O ASP A 61 1.206 6.596 4.362 1.00 1.00 O ATOM 979 CB ASP A 61 -1.368 6.270 6.334 1.00 1.00 C ATOM 980 CG ASP A 61 -2.658 6.873 6.889 1.00 1.00 C ATOM 981 OD1 ASP A 61 -3.230 7.721 6.226 1.00 1.00 O ATOM 982 OD2 ASP A 61 -3.054 6.475 7.973 1.00 1.00 O ATOM 0 H ASP A 61 -3.060 6.063 4.563 1.00 1.00 H new ATOM 0 HA ASP A 61 -0.929 7.842 4.929 1.00 1.00 H new ATOM 0 HB2 ASP A 61 -1.435 5.182 6.341 1.00 1.00 H new ATOM 0 HB3 ASP A 61 -0.527 6.542 6.972 1.00 1.00 H new ATOM 987 N CYS A 62 -0.116 4.875 3.760 1.00 1.00 N ATOM 988 CA CYS A 62 0.984 4.124 3.162 1.00 1.00 C ATOM 989 C CYS A 62 1.519 4.849 1.932 1.00 1.00 C ATOM 990 O CYS A 62 2.721 5.085 1.815 1.00 1.00 O ATOM 991 CB CYS A 62 0.513 2.724 2.766 1.00 1.00 C ATOM 992 SG CYS A 62 -0.046 1.842 4.241 1.00 1.00 S ATOM 0 H CYS A 62 -1.026 4.416 3.712 1.00 1.00 H new ATOM 0 HA CYS A 62 1.782 4.040 3.899 1.00 1.00 H new ATOM 0 HB2 CYS A 62 -0.297 2.792 2.040 1.00 1.00 H new ATOM 0 HB3 CYS A 62 1.325 2.177 2.287 1.00 1.00 H new ATOM 0 HG CYS A 62 -0.876 2.590 4.905 1.00 1.00 H new ATOM 998 N TYR A 63 0.617 5.201 1.021 1.00 1.00 N ATOM 999 CA TYR A 63 1.023 5.901 -0.193 1.00 1.00 C ATOM 1000 C TYR A 63 1.627 7.258 0.150 1.00 1.00 C ATOM 1001 O TYR A 63 2.654 7.650 -0.404 1.00 1.00 O ATOM 1002 CB TYR A 63 -0.180 6.093 -1.125 1.00 1.00 C ATOM 1003 CG TYR A 63 -0.821 4.747 -1.453 1.00 1.00 C ATOM 1004 CD1 TYR A 63 -0.037 3.677 -1.912 1.00 1.00 C ATOM 1005 CD2 TYR A 63 -2.205 4.570 -1.296 1.00 1.00 C ATOM 1006 CE1 TYR A 63 -0.630 2.449 -2.211 1.00 1.00 C ATOM 1007 CE2 TYR A 63 -2.794 3.339 -1.596 1.00 1.00 C ATOM 1008 CZ TYR A 63 -2.008 2.278 -2.052 1.00 1.00 C ATOM 1009 OH TYR A 63 -2.592 1.062 -2.347 1.00 1.00 O ATOM 0 H TYR A 63 -0.383 5.017 1.097 1.00 1.00 H new ATOM 0 HA TYR A 63 1.775 5.297 -0.700 1.00 1.00 H new ATOM 0 HB2 TYR A 63 -0.913 6.746 -0.652 1.00 1.00 H new ATOM 0 HB3 TYR A 63 0.139 6.584 -2.044 1.00 1.00 H new ATOM 0 HD1 TYR A 63 1.029 3.804 -2.034 1.00 1.00 H new ATOM 0 HD2 TYR A 63 -2.816 5.387 -0.942 1.00 1.00 H new ATOM 0 HE1 TYR A 63 -0.023 1.629 -2.566 1.00 1.00 H new ATOM 0 HE2 TYR A 63 -3.859 3.208 -1.475 1.00 1.00 H new ATOM 0 HH TYR A 63 -3.556 1.113 -2.180 1.00 1.00 H new ATOM 1019 N ASN A 64 0.987 7.972 1.070 1.00 1.00 N ATOM 1020 CA ASN A 64 1.484 9.285 1.464 1.00 1.00 C ATOM 1021 C ASN A 64 2.897 9.177 2.031 1.00 1.00 C ATOM 1022 O ASN A 64 3.747 10.015 1.733 1.00 1.00 O ATOM 1023 CB ASN A 64 0.548 9.900 2.507 1.00 1.00 C ATOM 1024 CG ASN A 64 1.046 11.286 2.901 1.00 1.00 C ATOM 1025 OD1 ASN A 64 1.710 11.956 2.109 1.00 1.00 O ATOM 1026 ND2 ASN A 64 0.758 11.763 4.080 1.00 1.00 N ATOM 0 H ASN A 64 0.138 7.671 1.549 1.00 1.00 H new ATOM 0 HA ASN A 64 1.514 9.926 0.583 1.00 1.00 H new ATOM 0 HB2 ASN A 64 -0.463 9.968 2.105 1.00 1.00 H new ATOM 0 HB3 ASN A 64 0.499 9.258 3.387 1.00 1.00 H new ATOM 0 HD21 ASN A 64 1.083 12.692 4.347 1.00 1.00 H new ATOM 0 HD22 ASN A 64 0.208 11.207 4.735 1.00 1.00 H new ATOM 1033 N TYR A 65 3.113 8.139 2.833 1.00 1.00 N ATOM 1034 CA TYR A 65 4.427 7.928 3.424 1.00 1.00 C ATOM 1035 C TYR A 65 5.476 7.772 2.327 1.00 1.00 C ATOM 1036 O TYR A 65 6.578 8.309 2.442 1.00 1.00 O ATOM 1037 CB TYR A 65 4.409 6.680 4.305 1.00 1.00 C ATOM 1038 CG TYR A 65 5.779 6.443 4.898 1.00 1.00 C ATOM 1039 CD1 TYR A 65 6.756 5.769 4.153 1.00 1.00 C ATOM 1040 CD2 TYR A 65 6.076 6.904 6.188 1.00 1.00 C ATOM 1041 CE1 TYR A 65 8.027 5.552 4.699 1.00 1.00 C ATOM 1042 CE2 TYR A 65 7.347 6.687 6.733 1.00 1.00 C ATOM 1043 CZ TYR A 65 8.323 6.010 5.988 1.00 1.00 C ATOM 1044 OH TYR A 65 9.574 5.796 6.526 1.00 1.00 O ATOM 0 H TYR A 65 2.410 7.444 3.084 1.00 1.00 H new ATOM 0 HA TYR A 65 4.680 8.793 4.037 1.00 1.00 H new ATOM 0 HB2 TYR A 65 3.675 6.798 5.102 1.00 1.00 H new ATOM 0 HB3 TYR A 65 4.104 5.814 3.717 1.00 1.00 H new ATOM 0 HD1 TYR A 65 6.529 5.417 3.158 1.00 1.00 H new ATOM 0 HD2 TYR A 65 5.324 7.426 6.761 1.00 1.00 H new ATOM 0 HE1 TYR A 65 8.779 5.031 4.125 1.00 1.00 H new ATOM 0 HE2 TYR A 65 7.576 7.041 7.727 1.00 1.00 H new ATOM 0 HH TYR A 65 9.612 6.178 7.428 1.00 1.00 H new ATOM 1054 N VAL A 66 5.129 7.035 1.276 1.00 1.00 N ATOM 1055 CA VAL A 66 6.065 6.821 0.173 1.00 1.00 C ATOM 1056 C VAL A 66 6.294 8.117 -0.597 1.00 1.00 C ATOM 1057 O VAL A 66 7.430 8.469 -0.916 1.00 1.00 O ATOM 1058 CB VAL A 66 5.523 5.743 -0.769 1.00 1.00 C ATOM 1059 CG1 VAL A 66 6.423 5.610 -2.008 1.00 1.00 C ATOM 1060 CG2 VAL A 66 5.487 4.407 -0.031 1.00 1.00 C ATOM 0 H VAL A 66 4.222 6.582 1.163 1.00 1.00 H new ATOM 0 HA VAL A 66 7.018 6.491 0.586 1.00 1.00 H new ATOM 0 HB VAL A 66 4.520 6.025 -1.090 1.00 1.00 H new ATOM 0 HG11 VAL A 66 6.023 4.839 -2.667 1.00 1.00 H new ATOM 0 HG12 VAL A 66 6.454 6.561 -2.539 1.00 1.00 H new ATOM 0 HG13 VAL A 66 7.431 5.335 -1.698 1.00 1.00 H new ATOM 0 HG21 VAL A 66 5.102 3.634 -0.696 1.00 1.00 H new ATOM 0 HG22 VAL A 66 6.494 4.141 0.289 1.00 1.00 H new ATOM 0 HG23 VAL A 66 4.839 4.491 0.842 1.00 1.00 H new ATOM 1070 N ILE A 67 5.216 8.833 -0.903 1.00 1.00 N ATOM 1071 CA ILE A 67 5.308 10.086 -1.644 1.00 1.00 C ATOM 1072 C ILE A 67 6.043 11.132 -0.811 1.00 1.00 C ATOM 1073 O ILE A 67 6.846 11.908 -1.329 1.00 1.00 O ATOM 1074 CB ILE A 67 3.902 10.574 -2.039 1.00 1.00 C ATOM 1075 CG1 ILE A 67 3.292 9.610 -3.071 1.00 1.00 C ATOM 1076 CG2 ILE A 67 3.966 11.983 -2.653 1.00 1.00 C ATOM 1077 CD1 ILE A 67 1.793 9.890 -3.211 1.00 1.00 C ATOM 0 H ILE A 67 4.265 8.565 -0.648 1.00 1.00 H new ATOM 0 HA ILE A 67 5.876 9.921 -2.560 1.00 1.00 H new ATOM 0 HB ILE A 67 3.286 10.605 -1.141 1.00 1.00 H new ATOM 0 HG12 ILE A 67 3.787 9.732 -4.035 1.00 1.00 H new ATOM 0 HG13 ILE A 67 3.452 8.578 -2.759 1.00 1.00 H new ATOM 0 HG21 ILE A 67 2.961 12.308 -2.925 1.00 1.00 H new ATOM 0 HG22 ILE A 67 4.388 12.678 -1.927 1.00 1.00 H new ATOM 0 HG23 ILE A 67 4.594 11.964 -3.544 1.00 1.00 H new ATOM 0 HD11 ILE A 67 1.362 9.206 -3.942 1.00 1.00 H new ATOM 0 HD12 ILE A 67 1.304 9.746 -2.247 1.00 1.00 H new ATOM 0 HD13 ILE A 67 1.644 10.918 -3.543 1.00 1.00 H new ATOM 1089 N ASN A 68 5.766 11.160 0.489 1.00 1.00 N ATOM 1090 CA ASN A 68 6.398 12.122 1.383 1.00 1.00 C ATOM 1091 C ASN A 68 7.847 11.743 1.663 1.00 1.00 C ATOM 1092 O ASN A 68 8.763 12.470 1.281 1.00 1.00 O ATOM 1093 CB ASN A 68 5.610 12.190 2.695 1.00 1.00 C ATOM 1094 CG ASN A 68 6.079 13.382 3.522 1.00 1.00 C ATOM 1095 OD1 ASN A 68 6.545 14.377 2.969 1.00 1.00 O ATOM 1096 ND2 ASN A 68 5.982 13.337 4.822 1.00 1.00 N ATOM 0 H ASN A 68 5.109 10.528 0.946 1.00 1.00 H new ATOM 0 HA ASN A 68 6.395 13.099 0.900 1.00 1.00 H new ATOM 0 HB2 ASN A 68 4.544 12.279 2.485 1.00 1.00 H new ATOM 0 HB3 ASN A 68 5.747 11.268 3.260 1.00 1.00 H new ATOM 0 HD21 ASN A 68 6.293 14.129 5.384 1.00 1.00 H new ATOM 0 HD22 ASN A 68 5.595 12.510 5.276 1.00 1.00 H new ATOM 1103 N VAL A 69 8.020 10.607 2.329 1.00 1.00 N ATOM 1104 CA VAL A 69 9.364 10.148 2.662 1.00 1.00 C ATOM 1105 C VAL A 69 10.214 10.051 1.405 1.00 1.00 C ATOM 1106 O VAL A 69 11.356 10.512 1.391 1.00 1.00 O ATOM 1107 CB VAL A 69 9.295 8.773 3.339 1.00 1.00 C ATOM 1108 CG1 VAL A 69 10.715 8.257 3.619 1.00 1.00 C ATOM 1109 CG2 VAL A 69 8.473 8.882 4.658 1.00 1.00 C ATOM 0 H VAL A 69 7.265 9.998 2.644 1.00 1.00 H new ATOM 0 HA VAL A 69 9.817 10.866 3.345 1.00 1.00 H new ATOM 0 HB VAL A 69 8.798 8.063 2.678 1.00 1.00 H new ATOM 0 HG11 VAL A 69 10.659 7.280 4.100 1.00 1.00 H new ATOM 0 HG12 VAL A 69 11.262 8.169 2.680 1.00 1.00 H new ATOM 0 HG13 VAL A 69 11.233 8.956 4.276 1.00 1.00 H new ATOM 0 HG21 VAL A 69 8.424 7.905 5.138 1.00 1.00 H new ATOM 0 HG22 VAL A 69 8.955 9.593 5.329 1.00 1.00 H new ATOM 0 HG23 VAL A 69 7.464 9.225 4.430 1.00 1.00 H new ATOM 1119 N ILE A 70 9.672 9.459 0.347 1.00 1.00 N ATOM 1120 CA ILE A 70 10.395 9.308 -0.919 1.00 1.00 C ATOM 1121 C ILE A 70 9.734 10.162 -1.997 1.00 1.00 C ATOM 1122 O ILE A 70 8.528 10.087 -2.233 1.00 1.00 O ATOM 1123 CB ILE A 70 10.395 7.831 -1.356 1.00 1.00 C ATOM 1124 CG1 ILE A 70 10.880 6.952 -0.195 1.00 1.00 C ATOM 1125 CG2 ILE A 70 11.337 7.648 -2.546 1.00 1.00 C ATOM 1126 CD1 ILE A 70 10.777 5.474 -0.588 1.00 1.00 C ATOM 0 H ILE A 70 8.728 9.072 0.337 1.00 1.00 H new ATOM 0 HA ILE A 70 11.425 9.637 -0.778 1.00 1.00 H new ATOM 0 HB ILE A 70 9.383 7.542 -1.640 1.00 1.00 H new ATOM 0 HG12 ILE A 70 11.911 7.201 0.056 1.00 1.00 H new ATOM 0 HG13 ILE A 70 10.280 7.144 0.695 1.00 1.00 H new ATOM 0 HG21 ILE A 70 11.336 6.602 -2.854 1.00 1.00 H new ATOM 0 HG22 ILE A 70 11.001 8.271 -3.375 1.00 1.00 H new ATOM 0 HG23 ILE A 70 12.347 7.940 -2.259 1.00 1.00 H new ATOM 0 HD11 ILE A 70 11.122 4.853 0.239 1.00 1.00 H new ATOM 0 HD12 ILE A 70 9.740 5.230 -0.817 1.00 1.00 H new ATOM 0 HD13 ILE A 70 11.396 5.287 -1.466 1.00 1.00 H new ATOM 1138 N GLU A 71 10.524 10.990 -2.673 1.00 1.00 N ATOM 1139 CA GLU A 71 10.019 11.859 -3.726 1.00 1.00 C ATOM 1140 C GLU A 71 9.795 11.061 -5.007 1.00 1.00 C ATOM 1141 O GLU A 71 9.699 11.623 -6.097 1.00 1.00 O ATOM 1142 CB GLU A 71 11.023 12.983 -3.995 1.00 1.00 C ATOM 1143 CG GLU A 71 11.133 13.901 -2.768 1.00 1.00 C ATOM 1144 CD GLU A 71 12.223 14.945 -2.991 1.00 1.00 C ATOM 1145 OE1 GLU A 71 12.773 14.979 -4.080 1.00 1.00 O ATOM 1146 OE2 GLU A 71 12.493 15.695 -2.068 1.00 1.00 O ATOM 0 H GLU A 71 11.527 11.076 -2.506 1.00 1.00 H new ATOM 0 HA GLU A 71 9.070 12.287 -3.402 1.00 1.00 H new ATOM 0 HB2 GLU A 71 11.999 12.560 -4.230 1.00 1.00 H new ATOM 0 HB3 GLU A 71 10.709 13.561 -4.864 1.00 1.00 H new ATOM 0 HG2 GLU A 71 10.178 14.394 -2.586 1.00 1.00 H new ATOM 0 HG3 GLU A 71 11.361 13.310 -1.881 1.00 1.00 H new ATOM 1153 N ASP A 72 9.710 9.739 -4.891 1.00 1.00 N ATOM 1154 CA ASP A 72 9.501 8.869 -6.045 1.00 1.00 C ATOM 1155 C ASP A 72 8.032 8.887 -6.462 1.00 1.00 C ATOM 1156 O ASP A 72 7.461 7.852 -6.805 1.00 1.00 O ATOM 1157 CB ASP A 72 9.934 7.432 -5.702 1.00 1.00 C ATOM 1158 CG ASP A 72 11.459 7.329 -5.671 1.00 1.00 C ATOM 1159 OD1 ASP A 72 12.109 8.302 -6.018 1.00 1.00 O ATOM 1160 OD2 ASP A 72 11.953 6.280 -5.294 1.00 1.00 O ATOM 0 H ASP A 72 9.783 9.243 -4.003 1.00 1.00 H new ATOM 0 HA ASP A 72 10.104 9.235 -6.876 1.00 1.00 H new ATOM 0 HB2 ASP A 72 9.524 7.143 -4.734 1.00 1.00 H new ATOM 0 HB3 ASP A 72 9.531 6.738 -6.440 1.00 1.00 H new ATOM 1165 N GLU A 73 7.418 10.066 -6.437 1.00 1.00 N ATOM 1166 CA GLU A 73 6.021 10.222 -6.814 1.00 1.00 C ATOM 1167 C GLU A 73 5.798 9.750 -8.246 1.00 1.00 C ATOM 1168 O GLU A 73 4.686 9.370 -8.614 1.00 1.00 O ATOM 1169 CB GLU A 73 5.609 11.698 -6.671 1.00 1.00 C ATOM 1170 CG GLU A 73 6.510 12.582 -7.537 1.00 1.00 C ATOM 1171 CD GLU A 73 6.122 14.047 -7.365 1.00 1.00 C ATOM 1172 OE1 GLU A 73 4.934 14.325 -7.313 1.00 1.00 O ATOM 1173 OE2 GLU A 73 7.019 14.869 -7.283 1.00 1.00 O ATOM 0 H GLU A 73 7.873 10.934 -6.156 1.00 1.00 H new ATOM 0 HA GLU A 73 5.406 9.612 -6.152 1.00 1.00 H new ATOM 0 HB2 GLU A 73 4.568 11.824 -6.969 1.00 1.00 H new ATOM 0 HB3 GLU A 73 5.681 12.004 -5.627 1.00 1.00 H new ATOM 0 HG2 GLU A 73 7.553 12.438 -7.256 1.00 1.00 H new ATOM 0 HG3 GLU A 73 6.419 12.293 -8.584 1.00 1.00 H new ATOM 1180 N TYR A 74 6.856 9.772 -9.046 1.00 1.00 N ATOM 1181 CA TYR A 74 6.756 9.336 -10.433 1.00 1.00 C ATOM 1182 C TYR A 74 6.179 7.929 -10.502 1.00 1.00 C ATOM 1183 O TYR A 74 5.521 7.572 -11.479 1.00 1.00 O ATOM 1184 CB TYR A 74 8.136 9.346 -11.085 1.00 1.00 C ATOM 1185 CG TYR A 74 8.640 10.769 -11.152 1.00 1.00 C ATOM 1186 CD1 TYR A 74 8.298 11.579 -12.242 1.00 1.00 C ATOM 1187 CD2 TYR A 74 9.444 11.281 -10.125 1.00 1.00 C ATOM 1188 CE1 TYR A 74 8.761 12.898 -12.306 1.00 1.00 C ATOM 1189 CE2 TYR A 74 9.906 12.599 -10.189 1.00 1.00 C ATOM 1190 CZ TYR A 74 9.564 13.409 -11.280 1.00 1.00 C ATOM 1191 OH TYR A 74 10.022 14.711 -11.344 1.00 1.00 O ATOM 0 H TYR A 74 7.785 10.084 -8.762 1.00 1.00 H new ATOM 0 HA TYR A 74 6.097 10.022 -10.965 1.00 1.00 H new ATOM 0 HB2 TYR A 74 8.827 8.729 -10.512 1.00 1.00 H new ATOM 0 HB3 TYR A 74 8.082 8.918 -12.086 1.00 1.00 H new ATOM 0 HD1 TYR A 74 7.677 11.186 -13.033 1.00 1.00 H new ATOM 0 HD2 TYR A 74 9.707 10.657 -9.284 1.00 1.00 H new ATOM 0 HE1 TYR A 74 8.499 13.522 -13.148 1.00 1.00 H new ATOM 0 HE2 TYR A 74 10.526 12.993 -9.398 1.00 1.00 H new ATOM 0 HH TYR A 74 10.565 14.906 -10.552 1.00 1.00 H new ATOM 1201 N ASN A 75 6.427 7.135 -9.467 1.00 1.00 N ATOM 1202 CA ASN A 75 5.936 5.762 -9.421 1.00 1.00 C ATOM 1203 C ASN A 75 4.460 5.705 -9.828 1.00 1.00 C ATOM 1204 O ASN A 75 3.562 6.107 -9.088 1.00 1.00 O ATOM 1205 CB ASN A 75 6.130 5.189 -8.003 1.00 1.00 C ATOM 1206 CG ASN A 75 7.613 4.965 -7.698 1.00 1.00 C ATOM 1207 OD1 ASN A 75 8.448 4.961 -8.603 1.00 1.00 O ATOM 1208 ND2 ASN A 75 7.982 4.772 -6.459 1.00 1.00 N ATOM 0 H ASN A 75 6.965 7.418 -8.648 1.00 1.00 H new ATOM 0 HA ASN A 75 6.505 5.158 -10.128 1.00 1.00 H new ATOM 0 HB2 ASN A 75 5.704 5.873 -7.269 1.00 1.00 H new ATOM 0 HB3 ASN A 75 5.590 4.247 -7.911 1.00 1.00 H new ATOM 0 HD21 ASN A 75 8.966 4.617 -6.238 1.00 1.00 H new ATOM 0 HD22 ASN A 75 7.286 4.776 -5.713 1.00 1.00 H new ATOM 1215 N LYS A 76 4.206 5.202 -11.030 1.00 1.00 N ATOM 1216 CA LYS A 76 2.848 5.090 -11.555 1.00 1.00 C ATOM 1217 C LYS A 76 2.031 4.101 -10.731 1.00 1.00 C ATOM 1218 O LYS A 76 0.824 4.266 -10.554 1.00 1.00 O ATOM 1219 CB LYS A 76 2.896 4.646 -13.021 1.00 1.00 C ATOM 1220 CG LYS A 76 3.639 3.308 -13.143 1.00 1.00 C ATOM 1221 CD LYS A 76 3.798 2.936 -14.620 1.00 1.00 C ATOM 1222 CE LYS A 76 4.512 1.584 -14.741 1.00 1.00 C ATOM 1223 NZ LYS A 76 3.650 0.515 -14.164 1.00 1.00 N ATOM 0 H LYS A 76 4.928 4.862 -11.665 1.00 1.00 H new ATOM 0 HA LYS A 76 2.366 6.066 -11.491 1.00 1.00 H new ATOM 0 HB2 LYS A 76 1.884 4.546 -13.412 1.00 1.00 H new ATOM 0 HB3 LYS A 76 3.396 5.405 -13.623 1.00 1.00 H new ATOM 0 HG2 LYS A 76 4.618 3.381 -12.669 1.00 1.00 H new ATOM 0 HG3 LYS A 76 3.089 2.527 -12.619 1.00 1.00 H new ATOM 0 HD2 LYS A 76 2.820 2.885 -15.099 1.00 1.00 H new ATOM 0 HD3 LYS A 76 4.368 3.706 -15.139 1.00 1.00 H new ATOM 0 HE2 LYS A 76 4.728 1.367 -15.787 1.00 1.00 H new ATOM 0 HE3 LYS A 76 5.468 1.617 -14.218 1.00 1.00 H new ATOM 0 HZ1 LYS A 76 3.950 -0.410 -14.533 1.00 1.00 H new ATOM 0 HZ2 LYS A 76 3.738 0.520 -13.128 1.00 1.00 H new ATOM 0 HZ3 LYS A 76 2.659 0.688 -14.428 1.00 1.00 H new ATOM 1237 N ASP A 77 2.703 3.070 -10.230 1.00 1.00 N ATOM 1238 CA ASP A 77 2.031 2.056 -9.426 1.00 1.00 C ATOM 1239 C ASP A 77 1.419 2.679 -8.174 1.00 1.00 C ATOM 1240 O ASP A 77 0.284 2.371 -7.810 1.00 1.00 O ATOM 1241 CB ASP A 77 3.031 0.972 -9.025 1.00 1.00 C ATOM 1242 CG ASP A 77 2.307 -0.228 -8.424 1.00 1.00 C ATOM 1243 OD1 ASP A 77 1.113 -0.125 -8.192 1.00 1.00 O ATOM 1244 OD2 ASP A 77 2.958 -1.236 -8.202 1.00 1.00 O ATOM 0 H ASP A 77 3.702 2.915 -10.364 1.00 1.00 H new ATOM 0 HA ASP A 77 1.231 1.615 -10.021 1.00 1.00 H new ATOM 0 HB2 ASP A 77 3.605 0.658 -9.897 1.00 1.00 H new ATOM 0 HB3 ASP A 77 3.742 1.374 -8.303 1.00 1.00 H new ATOM 1249 N VAL A 78 2.176 3.555 -7.519 1.00 1.00 N ATOM 1250 CA VAL A 78 1.699 4.214 -6.307 1.00 1.00 C ATOM 1251 C VAL A 78 0.510 5.117 -6.626 1.00 1.00 C ATOM 1252 O VAL A 78 -0.488 5.111 -5.906 1.00 1.00 O ATOM 1253 CB VAL A 78 2.830 5.033 -5.662 1.00 1.00 C ATOM 1254 CG1 VAL A 78 2.295 5.839 -4.472 1.00 1.00 C ATOM 1255 CG2 VAL A 78 3.943 4.095 -5.163 1.00 1.00 C ATOM 0 H VAL A 78 3.117 3.824 -7.805 1.00 1.00 H new ATOM 0 HA VAL A 78 1.377 3.448 -5.601 1.00 1.00 H new ATOM 0 HB VAL A 78 3.229 5.714 -6.414 1.00 1.00 H new ATOM 0 HG11 VAL A 78 3.108 6.413 -4.027 1.00 1.00 H new ATOM 0 HG12 VAL A 78 1.515 6.519 -4.814 1.00 1.00 H new ATOM 0 HG13 VAL A 78 1.881 5.158 -3.728 1.00 1.00 H new ATOM 0 HG21 VAL A 78 4.739 4.685 -4.708 1.00 1.00 H new ATOM 0 HG22 VAL A 78 3.534 3.406 -4.424 1.00 1.00 H new ATOM 0 HG23 VAL A 78 4.346 3.529 -6.003 1.00 1.00 H new ATOM 1265 N TRP A 79 0.612 5.892 -7.700 1.00 1.00 N ATOM 1266 CA TRP A 79 -0.466 6.790 -8.090 1.00 1.00 C ATOM 1267 C TRP A 79 -1.706 5.989 -8.482 1.00 1.00 C ATOM 1268 O TRP A 79 -2.808 6.261 -8.006 1.00 1.00 O ATOM 1269 CB TRP A 79 -0.008 7.679 -9.267 1.00 1.00 C ATOM 1270 CG TRP A 79 0.773 8.856 -8.762 1.00 1.00 C ATOM 1271 CD1 TRP A 79 2.076 9.101 -9.025 1.00 1.00 C ATOM 1272 CD2 TRP A 79 0.313 9.944 -7.917 1.00 1.00 C ATOM 1273 NE1 TRP A 79 2.444 10.278 -8.393 1.00 1.00 N ATOM 1274 CE2 TRP A 79 1.389 10.834 -7.695 1.00 1.00 C ATOM 1275 CE3 TRP A 79 -0.926 10.244 -7.325 1.00 1.00 C ATOM 1276 CZ2 TRP A 79 1.243 11.982 -6.914 1.00 1.00 C ATOM 1277 CZ3 TRP A 79 -1.079 11.395 -6.539 1.00 1.00 C ATOM 1278 CH2 TRP A 79 0.003 12.262 -6.333 1.00 1.00 C ATOM 0 H TRP A 79 1.427 5.916 -8.313 1.00 1.00 H new ATOM 0 HA TRP A 79 -0.720 7.428 -7.243 1.00 1.00 H new ATOM 0 HB2 TRP A 79 0.605 7.096 -9.954 1.00 1.00 H new ATOM 0 HB3 TRP A 79 -0.876 8.025 -9.829 1.00 1.00 H new ATOM 0 HD1 TRP A 79 2.723 8.482 -9.628 1.00 1.00 H new ATOM 0 HE1 TRP A 79 3.379 10.684 -8.438 1.00 1.00 H new ATOM 0 HE3 TRP A 79 -1.767 9.583 -7.477 1.00 1.00 H new ATOM 0 HZ2 TRP A 79 2.080 12.647 -6.760 1.00 1.00 H new ATOM 0 HZ3 TRP A 79 -2.036 11.615 -6.090 1.00 1.00 H new ATOM 0 HH2 TRP A 79 -0.121 13.146 -5.725 1.00 1.00 H new ATOM 1289 N ALA A 80 -1.534 4.997 -9.349 1.00 1.00 N ATOM 1290 CA ALA A 80 -2.653 4.173 -9.787 1.00 1.00 C ATOM 1291 C ALA A 80 -3.329 3.502 -8.596 1.00 1.00 C ATOM 1292 O ALA A 80 -4.554 3.522 -8.477 1.00 1.00 O ATOM 1293 CB ALA A 80 -2.152 3.107 -10.764 1.00 1.00 C ATOM 0 H ALA A 80 -0.635 4.745 -9.760 1.00 1.00 H new ATOM 0 HA ALA A 80 -3.383 4.812 -10.283 1.00 1.00 H new ATOM 0 HB1 ALA A 80 -2.990 2.491 -11.091 1.00 1.00 H new ATOM 0 HB2 ALA A 80 -1.698 3.591 -11.629 1.00 1.00 H new ATOM 0 HB3 ALA A 80 -1.411 2.479 -10.269 1.00 1.00 H new ATOM 1299 N ALA A 81 -2.521 2.910 -7.722 1.00 1.00 N ATOM 1300 CA ALA A 81 -3.055 2.234 -6.544 1.00 1.00 C ATOM 1301 C ALA A 81 -3.778 3.223 -5.633 1.00 1.00 C ATOM 1302 O ALA A 81 -4.888 2.961 -5.172 1.00 1.00 O ATOM 1303 CB ALA A 81 -1.922 1.562 -5.766 1.00 1.00 C ATOM 0 H ALA A 81 -1.505 2.884 -7.805 1.00 1.00 H new ATOM 0 HA ALA A 81 -3.766 1.479 -6.879 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -2.331 1.060 -4.889 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -1.426 0.831 -6.404 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -1.201 2.316 -5.450 1.00 1.00 H new ATOM 1309 N LYS A 82 -3.140 4.363 -5.381 1.00 1.00 N ATOM 1310 CA LYS A 82 -3.726 5.386 -4.522 1.00 1.00 C ATOM 1311 C LYS A 82 -5.060 5.860 -5.094 1.00 1.00 C ATOM 1312 O LYS A 82 -5.996 6.148 -4.349 1.00 1.00 O ATOM 1313 CB LYS A 82 -2.750 6.566 -4.385 1.00 1.00 C ATOM 1314 CG LYS A 82 -3.286 7.596 -3.379 1.00 1.00 C ATOM 1315 CD LYS A 82 -2.243 8.703 -3.163 1.00 1.00 C ATOM 1316 CE LYS A 82 -2.757 9.717 -2.135 1.00 1.00 C ATOM 1317 NZ LYS A 82 -1.715 10.756 -1.898 1.00 1.00 N ATOM 0 H LYS A 82 -2.222 4.600 -5.757 1.00 1.00 H new ATOM 0 HA LYS A 82 -3.910 4.961 -3.535 1.00 1.00 H new ATOM 0 HB2 LYS A 82 -1.776 6.203 -4.058 1.00 1.00 H new ATOM 0 HB3 LYS A 82 -2.604 7.039 -5.356 1.00 1.00 H new ATOM 0 HG2 LYS A 82 -4.217 8.027 -3.747 1.00 1.00 H new ATOM 0 HG3 LYS A 82 -3.514 7.108 -2.431 1.00 1.00 H new ATOM 0 HD2 LYS A 82 -1.305 8.268 -2.818 1.00 1.00 H new ATOM 0 HD3 LYS A 82 -2.033 9.205 -4.107 1.00 1.00 H new ATOM 0 HE2 LYS A 82 -3.675 10.182 -2.495 1.00 1.00 H new ATOM 0 HE3 LYS A 82 -3.001 9.212 -1.201 1.00 1.00 H new ATOM 0 HZ1 LYS A 82 -2.063 11.444 -1.200 1.00 1.00 H new ATOM 0 HZ2 LYS A 82 -0.850 10.305 -1.537 1.00 1.00 H new ATOM 0 HZ3 LYS A 82 -1.503 11.245 -2.791 1.00 1.00 H new ATOM 1331 N ALA A 83 -5.146 5.935 -6.418 1.00 1.00 N ATOM 1332 CA ALA A 83 -6.380 6.370 -7.068 1.00 1.00 C ATOM 1333 C ALA A 83 -7.548 5.486 -6.649 1.00 1.00 C ATOM 1334 O ALA A 83 -8.597 5.989 -6.243 1.00 1.00 O ATOM 1335 CB ALA A 83 -6.211 6.316 -8.588 1.00 1.00 C ATOM 0 H ALA A 83 -4.386 5.703 -7.057 1.00 1.00 H new ATOM 0 HA ALA A 83 -6.591 7.394 -6.761 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -7.134 6.641 -9.068 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -5.395 6.974 -8.887 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -5.984 5.294 -8.893 1.00 1.00 H new ATOM 1341 N ASP A 84 -7.359 4.175 -6.749 1.00 1.00 N ATOM 1342 CA ASP A 84 -8.407 3.228 -6.375 1.00 1.00 C ATOM 1343 C ASP A 84 -8.936 3.547 -4.977 1.00 1.00 C ATOM 1344 O ASP A 84 -10.142 3.494 -4.735 1.00 1.00 O ATOM 1345 CB ASP A 84 -7.860 1.797 -6.403 1.00 1.00 C ATOM 1346 CG ASP A 84 -7.542 1.385 -7.836 1.00 1.00 C ATOM 1347 OD1 ASP A 84 -7.973 2.078 -8.744 1.00 1.00 O ATOM 1348 OD2 ASP A 84 -6.867 0.382 -8.006 1.00 1.00 O ATOM 0 H ASP A 84 -6.497 3.744 -7.083 1.00 1.00 H new ATOM 0 HA ASP A 84 -9.223 3.314 -7.093 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -6.961 1.731 -5.790 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -8.591 1.112 -5.973 1.00 1.00 H new ATOM 1353 N ALA A 85 -8.034 3.884 -4.062 1.00 1.00 N ATOM 1354 CA ALA A 85 -8.424 4.217 -2.697 1.00 1.00 C ATOM 1355 C ALA A 85 -9.221 5.519 -2.667 1.00 1.00 C ATOM 1356 O ALA A 85 -10.192 5.652 -1.921 1.00 1.00 O ATOM 1357 CB ALA A 85 -7.179 4.352 -1.819 1.00 1.00 C ATOM 0 H ALA A 85 -7.031 3.934 -4.240 1.00 1.00 H new ATOM 0 HA ALA A 85 -9.054 3.415 -2.312 1.00 1.00 H new ATOM 0 HB1 ALA A 85 -7.477 4.601 -0.801 1.00 1.00 H new ATOM 0 HB2 ALA A 85 -6.631 3.410 -1.817 1.00 1.00 H new ATOM 0 HB3 ALA A 85 -6.540 5.142 -2.213 1.00 1.00 H new ATOM 1363 N LEU A 86 -8.804 6.479 -3.486 1.00 1.00 N ATOM 1364 CA LEU A 86 -9.477 7.772 -3.555 1.00 1.00 C ATOM 1365 C LEU A 86 -10.849 7.627 -4.204 1.00 1.00 C ATOM 1366 O LEU A 86 -11.785 8.355 -3.875 1.00 1.00 O ATOM 1367 CB LEU A 86 -8.618 8.759 -4.350 1.00 1.00 C ATOM 1368 CG LEU A 86 -7.312 9.055 -3.592 1.00 1.00 C ATOM 1369 CD1 LEU A 86 -6.363 9.828 -4.513 1.00 1.00 C ATOM 1370 CD2 LEU A 86 -7.586 9.888 -2.316 1.00 1.00 C ATOM 0 H LEU A 86 -8.003 6.386 -4.111 1.00 1.00 H new ATOM 0 HA LEU A 86 -9.615 8.152 -2.543 1.00 1.00 H new ATOM 0 HB2 LEU A 86 -8.391 8.346 -5.333 1.00 1.00 H new ATOM 0 HB3 LEU A 86 -9.170 9.684 -4.513 1.00 1.00 H new ATOM 0 HG LEU A 86 -6.860 8.109 -3.292 1.00 1.00 H new ATOM 0 HD11 LEU A 86 -5.435 10.042 -3.983 1.00 1.00 H new ATOM 0 HD12 LEU A 86 -6.146 9.229 -5.397 1.00 1.00 H new ATOM 0 HD13 LEU A 86 -6.832 10.764 -4.815 1.00 1.00 H new ATOM 0 HD21 LEU A 86 -6.646 10.083 -1.800 1.00 1.00 H new ATOM 0 HD22 LEU A 86 -8.051 10.834 -2.592 1.00 1.00 H new ATOM 0 HD23 LEU A 86 -8.254 9.334 -1.656 1.00 1.00 H new ATOM 1382 N ARG A 87 -10.954 6.681 -5.133 1.00 1.00 N ATOM 1383 CA ARG A 87 -12.215 6.459 -5.829 1.00 1.00 C ATOM 1384 C ARG A 87 -13.330 6.139 -4.846 1.00 1.00 C ATOM 1385 O ARG A 87 -14.463 6.586 -5.024 1.00 1.00 O ATOM 1386 CB ARG A 87 -12.057 5.304 -6.826 1.00 1.00 C ATOM 1387 CG ARG A 87 -11.175 5.754 -8.024 1.00 1.00 C ATOM 1388 CD ARG A 87 -12.061 6.119 -9.216 1.00 1.00 C ATOM 1389 NE ARG A 87 -12.960 7.211 -8.854 1.00 1.00 N ATOM 1390 CZ ARG A 87 -14.086 7.427 -9.525 1.00 1.00 C ATOM 1391 NH1 ARG A 87 -14.401 6.651 -10.525 1.00 1.00 N ATOM 1392 NH2 ARG A 87 -14.873 8.409 -9.187 1.00 1.00 N ATOM 0 H ARG A 87 -10.193 6.065 -5.417 1.00 1.00 H new ATOM 0 HA ARG A 87 -12.479 7.372 -6.363 1.00 1.00 H new ATOM 0 HB2 ARG A 87 -11.603 4.445 -6.332 1.00 1.00 H new ATOM 0 HB3 ARG A 87 -13.036 4.985 -7.184 1.00 1.00 H new ATOM 0 HG2 ARG A 87 -10.566 6.611 -7.737 1.00 1.00 H new ATOM 0 HG3 ARG A 87 -10.488 4.954 -8.302 1.00 1.00 H new ATOM 0 HD2 ARG A 87 -11.442 6.413 -10.064 1.00 1.00 H new ATOM 0 HD3 ARG A 87 -12.639 5.250 -9.530 1.00 1.00 H new ATOM 0 HE ARG A 87 -12.719 7.819 -8.071 1.00 1.00 H new ATOM 0 HH11 ARG A 87 -13.784 5.883 -10.788 1.00 1.00 H new ATOM 0 HH12 ARG A 87 -15.264 6.812 -11.044 1.00 1.00 H new ATOM 0 HH21 ARG A 87 -14.625 9.015 -8.405 1.00 1.00 H new ATOM 0 HH22 ARG A 87 -15.737 8.572 -9.705 1.00 1.00 H new ATOM 1406 N TYR A 88 -13.002 5.368 -3.814 1.00 1.00 N ATOM 1407 CA TYR A 88 -13.978 4.985 -2.791 1.00 1.00 C ATOM 1408 C TYR A 88 -13.641 5.641 -1.462 1.00 1.00 C ATOM 1409 O TYR A 88 -13.138 4.996 -0.542 1.00 1.00 O ATOM 1410 CB TYR A 88 -13.989 3.461 -2.641 1.00 1.00 C ATOM 1411 CG TYR A 88 -14.404 2.833 -3.958 1.00 1.00 C ATOM 1412 CD1 TYR A 88 -15.753 2.829 -4.328 1.00 1.00 C ATOM 1413 CD2 TYR A 88 -13.446 2.260 -4.806 1.00 1.00 C ATOM 1414 CE1 TYR A 88 -16.146 2.255 -5.543 1.00 1.00 C ATOM 1415 CE2 TYR A 88 -13.840 1.683 -6.020 1.00 1.00 C ATOM 1416 CZ TYR A 88 -15.191 1.682 -6.388 1.00 1.00 C ATOM 1417 OH TYR A 88 -15.581 1.115 -7.584 1.00 1.00 O ATOM 0 H TYR A 88 -12.066 4.993 -3.661 1.00 1.00 H new ATOM 0 HA TYR A 88 -14.967 5.324 -3.099 1.00 1.00 H new ATOM 0 HB2 TYR A 88 -13.001 3.105 -2.350 1.00 1.00 H new ATOM 0 HB3 TYR A 88 -14.679 3.166 -1.850 1.00 1.00 H new ATOM 0 HD1 TYR A 88 -16.492 3.269 -3.675 1.00 1.00 H new ATOM 0 HD2 TYR A 88 -12.404 2.263 -4.523 1.00 1.00 H new ATOM 0 HE1 TYR A 88 -17.188 2.255 -5.828 1.00 1.00 H new ATOM 0 HE2 TYR A 88 -13.102 1.239 -6.672 1.00 1.00 H new ATOM 0 HH TYR A 88 -14.795 0.763 -8.051 1.00 1.00 H new ATOM 1427 N ILE A 89 -13.917 6.937 -1.348 1.00 1.00 N ATOM 1428 CA ILE A 89 -13.655 7.709 -0.130 1.00 1.00 C ATOM 1429 C ILE A 89 -14.895 8.484 0.295 1.00 1.00 C ATOM 1430 O ILE A 89 -15.867 8.594 -0.453 1.00 1.00 O ATOM 1431 CB ILE A 89 -12.488 8.685 -0.361 1.00 1.00 C ATOM 1432 CG1 ILE A 89 -12.108 9.365 0.972 1.00 1.00 C ATOM 1433 CG2 ILE A 89 -12.885 9.757 -1.388 1.00 1.00 C ATOM 1434 CD1 ILE A 89 -10.678 9.898 0.894 1.00 1.00 C ATOM 0 H ILE A 89 -14.331 7.487 -2.100 1.00 1.00 H new ATOM 0 HA ILE A 89 -13.389 7.011 0.664 1.00 1.00 H new ATOM 0 HB ILE A 89 -11.634 8.127 -0.744 1.00 1.00 H new ATOM 0 HG12 ILE A 89 -12.799 10.181 1.184 1.00 1.00 H new ATOM 0 HG13 ILE A 89 -12.196 8.652 1.792 1.00 1.00 H new ATOM 0 HG21 ILE A 89 -12.050 10.441 -1.542 1.00 1.00 H new ATOM 0 HG22 ILE A 89 -13.141 9.278 -2.333 1.00 1.00 H new ATOM 0 HG23 ILE A 89 -13.746 10.314 -1.019 1.00 1.00 H new ATOM 0 HD11 ILE A 89 -10.416 10.377 1.838 1.00 1.00 H new ATOM 0 HD12 ILE A 89 -9.992 9.073 0.703 1.00 1.00 H new ATOM 0 HD13 ILE A 89 -10.604 10.625 0.086 1.00 1.00 H new ATOM 1446 N GLU A 90 -14.864 9.033 1.506 1.00 1.00 N ATOM 1447 CA GLU A 90 -15.988 9.801 2.025 1.00 1.00 C ATOM 1448 C GLU A 90 -16.520 10.762 0.964 1.00 1.00 C ATOM 1449 O GLU A 90 -17.718 10.790 0.684 1.00 1.00 O ATOM 1450 CB GLU A 90 -15.551 10.588 3.272 1.00 1.00 C ATOM 1451 CG GLU A 90 -15.215 9.609 4.403 1.00 1.00 C ATOM 1452 CD GLU A 90 -16.485 8.942 4.925 1.00 1.00 C ATOM 1453 OE1 GLU A 90 -17.561 9.356 4.523 1.00 1.00 O ATOM 1454 OE2 GLU A 90 -16.364 8.031 5.728 1.00 1.00 O ATOM 0 H GLU A 90 -14.072 8.960 2.145 1.00 1.00 H new ATOM 0 HA GLU A 90 -16.785 9.109 2.296 1.00 1.00 H new ATOM 0 HB2 GLU A 90 -14.682 11.204 3.040 1.00 1.00 H new ATOM 0 HB3 GLU A 90 -16.347 11.264 3.586 1.00 1.00 H new ATOM 0 HG2 GLU A 90 -14.521 8.851 4.042 1.00 1.00 H new ATOM 0 HG3 GLU A 90 -14.715 10.138 5.214 1.00 1.00 H new ATOM 1505 N VAL A 94 -13.297 16.067 -6.400 1.00 1.00 N ATOM 1506 CA VAL A 94 -12.418 16.188 -7.558 1.00 1.00 C ATOM 1507 C VAL A 94 -11.100 15.461 -7.298 1.00 1.00 C ATOM 1508 O VAL A 94 -10.308 15.271 -8.221 1.00 1.00 O ATOM 1509 CB VAL A 94 -12.152 17.671 -7.863 1.00 1.00 C ATOM 1510 CG1 VAL A 94 -11.000 17.796 -8.878 1.00 1.00 C ATOM 1511 CG2 VAL A 94 -13.420 18.313 -8.454 1.00 1.00 C ATOM 0 HA VAL A 94 -12.906 15.731 -8.419 1.00 1.00 H new ATOM 0 HB VAL A 94 -11.880 18.181 -6.939 1.00 1.00 H new ATOM 0 HG11 VAL A 94 -10.815 18.849 -9.091 1.00 1.00 H new ATOM 0 HG12 VAL A 94 -10.098 17.346 -8.462 1.00 1.00 H new ATOM 0 HG13 VAL A 94 -11.270 17.281 -9.800 1.00 1.00 H new ATOM 0 HG21 VAL A 94 -13.229 19.364 -8.669 1.00 1.00 H new ATOM 0 HG22 VAL A 94 -13.693 17.798 -9.375 1.00 1.00 H new ATOM 0 HG23 VAL A 94 -14.237 18.232 -7.737 1.00 1.00 H new ATOM 1521 N GLU A 95 -10.864 15.063 -6.052 1.00 1.00 N ATOM 1522 CA GLU A 95 -9.627 14.381 -5.704 1.00 1.00 C ATOM 1523 C GLU A 95 -9.470 13.109 -6.532 1.00 1.00 C ATOM 1524 O GLU A 95 -8.440 12.897 -7.171 1.00 1.00 O ATOM 1525 CB GLU A 95 -9.635 14.035 -4.205 1.00 1.00 C ATOM 1526 CG GLU A 95 -8.249 13.555 -3.765 1.00 1.00 C ATOM 1527 CD GLU A 95 -8.246 13.289 -2.261 1.00 1.00 C ATOM 1528 OE1 GLU A 95 -9.317 13.275 -1.678 1.00 1.00 O ATOM 1529 OE2 GLU A 95 -7.170 13.107 -1.714 1.00 1.00 O ATOM 0 H GLU A 95 -11.509 15.200 -5.273 1.00 1.00 H new ATOM 0 HA GLU A 95 -8.786 15.040 -5.919 1.00 1.00 H new ATOM 0 HB2 GLU A 95 -9.926 14.910 -3.624 1.00 1.00 H new ATOM 0 HB3 GLU A 95 -10.376 13.260 -4.007 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -7.981 12.647 -4.305 1.00 1.00 H new ATOM 0 HG3 GLU A 95 -7.499 14.306 -4.012 1.00 1.00 H new ATOM 1536 N ALA A 96 -10.495 12.263 -6.524 1.00 1.00 N ATOM 1537 CA ALA A 96 -10.450 11.023 -7.287 1.00 1.00 C ATOM 1538 C ALA A 96 -10.231 11.305 -8.773 1.00 1.00 C ATOM 1539 O ALA A 96 -9.498 10.580 -9.446 1.00 1.00 O ATOM 1540 CB ALA A 96 -11.758 10.253 -7.104 1.00 1.00 C ATOM 0 H ALA A 96 -11.359 12.412 -6.003 1.00 1.00 H new ATOM 0 HA ALA A 96 -9.616 10.426 -6.918 1.00 1.00 H new ATOM 0 HB1 ALA A 96 -11.718 9.327 -7.677 1.00 1.00 H new ATOM 0 HB2 ALA A 96 -11.899 10.021 -6.048 1.00 1.00 H new ATOM 0 HB3 ALA A 96 -12.591 10.862 -7.456 1.00 1.00 H new ATOM 1546 N GLU A 97 -10.869 12.358 -9.275 1.00 1.00 N ATOM 1547 CA GLU A 97 -10.732 12.702 -10.689 1.00 1.00 C ATOM 1548 C GLU A 97 -9.277 13.016 -11.032 1.00 1.00 C ATOM 1549 O GLU A 97 -8.713 12.456 -11.973 1.00 1.00 O ATOM 1550 CB GLU A 97 -11.608 13.923 -11.009 1.00 1.00 C ATOM 1551 CG GLU A 97 -11.573 14.234 -12.512 1.00 1.00 C ATOM 1552 CD GLU A 97 -12.532 15.380 -12.822 1.00 1.00 C ATOM 1553 OE1 GLU A 97 -13.693 15.269 -12.460 1.00 1.00 O ATOM 1554 OE2 GLU A 97 -12.094 16.351 -13.414 1.00 1.00 O ATOM 0 H GLU A 97 -11.475 12.978 -8.737 1.00 1.00 H new ATOM 0 HA GLU A 97 -11.054 11.848 -11.285 1.00 1.00 H new ATOM 0 HB2 GLU A 97 -12.634 13.733 -10.695 1.00 1.00 H new ATOM 0 HB3 GLU A 97 -11.257 14.787 -10.445 1.00 1.00 H new ATOM 0 HG2 GLU A 97 -10.561 14.502 -12.814 1.00 1.00 H new ATOM 0 HG3 GLU A 97 -11.852 13.349 -13.083 1.00 1.00 H new ATOM 1561 N ILE A 98 -8.668 13.913 -10.264 1.00 1.00 N ATOM 1562 CA ILE A 98 -7.275 14.289 -10.495 1.00 1.00 C ATOM 1563 C ILE A 98 -6.376 13.057 -10.395 1.00 1.00 C ATOM 1564 O ILE A 98 -5.449 12.895 -11.189 1.00 1.00 O ATOM 1565 CB ILE A 98 -6.834 15.345 -9.461 1.00 1.00 C ATOM 1566 CG1 ILE A 98 -7.567 16.670 -9.728 1.00 1.00 C ATOM 1567 CG2 ILE A 98 -5.313 15.578 -9.535 1.00 1.00 C ATOM 1568 CD1 ILE A 98 -7.375 17.615 -8.538 1.00 1.00 C ATOM 0 H ILE A 98 -9.112 14.392 -9.480 1.00 1.00 H new ATOM 0 HA ILE A 98 -7.186 14.713 -11.495 1.00 1.00 H new ATOM 0 HB ILE A 98 -7.085 14.979 -8.465 1.00 1.00 H new ATOM 0 HG12 ILE A 98 -7.183 17.132 -10.637 1.00 1.00 H new ATOM 0 HG13 ILE A 98 -8.629 16.483 -9.889 1.00 1.00 H new ATOM 0 HG21 ILE A 98 -5.023 16.326 -8.797 1.00 1.00 H new ATOM 0 HG22 ILE A 98 -4.791 14.644 -9.328 1.00 1.00 H new ATOM 0 HG23 ILE A 98 -5.047 15.929 -10.532 1.00 1.00 H new ATOM 0 HD11 ILE A 98 -7.896 18.553 -8.731 1.00 1.00 H new ATOM 0 HD12 ILE A 98 -7.780 17.153 -7.638 1.00 1.00 H new ATOM 0 HD13 ILE A 98 -6.312 17.812 -8.398 1.00 1.00 H new ATOM 1580 N ALA A 99 -6.652 12.192 -9.425 1.00 1.00 N ATOM 1581 CA ALA A 99 -5.844 10.993 -9.249 1.00 1.00 C ATOM 1582 C ALA A 99 -5.918 10.098 -10.481 1.00 1.00 C ATOM 1583 O ALA A 99 -4.889 9.724 -11.045 1.00 1.00 O ATOM 1584 CB ALA A 99 -6.326 10.229 -8.016 1.00 1.00 C ATOM 0 H ALA A 99 -7.417 12.296 -8.758 1.00 1.00 H new ATOM 0 HA ALA A 99 -4.805 11.291 -9.111 1.00 1.00 H new ATOM 0 HB1 ALA A 99 -5.721 9.332 -7.884 1.00 1.00 H new ATOM 0 HB2 ALA A 99 -6.231 10.863 -7.135 1.00 1.00 H new ATOM 0 HB3 ALA A 99 -7.370 9.946 -8.148 1.00 1.00 H new ATOM 1590 N GLU A 100 -7.144 9.769 -10.876 1.00 1.00 N ATOM 1591 CA GLU A 100 -7.337 8.913 -12.042 1.00 1.00 C ATOM 1592 C GLU A 100 -6.623 9.497 -13.260 1.00 1.00 C ATOM 1593 O GLU A 100 -5.972 8.769 -14.009 1.00 1.00 O ATOM 1594 CB GLU A 100 -8.832 8.776 -12.343 1.00 1.00 C ATOM 1595 CG GLU A 100 -9.053 7.673 -13.385 1.00 1.00 C ATOM 1596 CD GLU A 100 -8.777 6.305 -12.766 1.00 1.00 C ATOM 1597 OE1 GLU A 100 -8.600 6.246 -11.559 1.00 1.00 O ATOM 1598 OE2 GLU A 100 -8.739 5.339 -13.507 1.00 1.00 O ATOM 0 H GLU A 100 -8.002 10.074 -10.417 1.00 1.00 H new ATOM 0 HA GLU A 100 -6.916 7.931 -11.825 1.00 1.00 H new ATOM 0 HB2 GLU A 100 -9.376 8.540 -11.429 1.00 1.00 H new ATOM 0 HB3 GLU A 100 -9.226 9.723 -12.713 1.00 1.00 H new ATOM 0 HG2 GLU A 100 -10.077 7.713 -13.757 1.00 1.00 H new ATOM 0 HG3 GLU A 100 -8.397 7.833 -14.240 1.00 1.00 H new ATOM 1605 N ALA A 101 -6.749 10.807 -13.450 1.00 1.00 N ATOM 1606 CA ALA A 101 -6.108 11.467 -14.582 1.00 1.00 C ATOM 1607 C ALA A 101 -4.590 11.457 -14.424 1.00 1.00 C ATOM 1608 O ALA A 101 -3.863 11.100 -15.351 1.00 1.00 O ATOM 1609 CB ALA A 101 -6.600 12.909 -14.694 1.00 1.00 C ATOM 0 H ALA A 101 -7.283 11.427 -12.841 1.00 1.00 H new ATOM 0 HA ALA A 101 -6.370 10.922 -15.489 1.00 1.00 H new ATOM 0 HB1 ALA A 101 -6.116 13.394 -15.542 1.00 1.00 H new ATOM 0 HB2 ALA A 101 -7.680 12.915 -14.841 1.00 1.00 H new ATOM 0 HB3 ALA A 101 -6.355 13.449 -13.779 1.00 1.00 H new ATOM 1615 N ARG A 102 -4.115 11.851 -13.247 1.00 1.00 N ATOM 1616 CA ARG A 102 -2.678 11.888 -12.983 1.00 1.00 C ATOM 1617 C ARG A 102 -2.056 10.509 -13.192 1.00 1.00 C ATOM 1618 O ARG A 102 -0.963 10.385 -13.747 1.00 1.00 O ATOM 1619 CB ARG A 102 -2.408 12.349 -11.538 1.00 1.00 C ATOM 1620 CG ARG A 102 -2.702 13.853 -11.377 1.00 1.00 C ATOM 1621 CD ARG A 102 -1.485 14.686 -11.800 1.00 1.00 C ATOM 1622 NE ARG A 102 -0.322 14.355 -10.983 1.00 1.00 N ATOM 1623 CZ ARG A 102 0.854 14.934 -11.203 1.00 1.00 C ATOM 1624 NH1 ARG A 102 0.977 15.812 -12.161 1.00 1.00 N ATOM 1625 NH2 ARG A 102 1.882 14.624 -10.464 1.00 1.00 N ATOM 0 H ARG A 102 -4.698 12.148 -12.464 1.00 1.00 H new ATOM 0 HA ARG A 102 -2.228 12.595 -13.680 1.00 1.00 H new ATOM 0 HB2 ARG A 102 -3.028 11.777 -10.848 1.00 1.00 H new ATOM 0 HB3 ARG A 102 -1.369 12.147 -11.276 1.00 1.00 H new ATOM 0 HG2 ARG A 102 -3.566 14.128 -11.982 1.00 1.00 H new ATOM 0 HG3 ARG A 102 -2.957 14.071 -10.340 1.00 1.00 H new ATOM 0 HD2 ARG A 102 -1.261 14.503 -12.851 1.00 1.00 H new ATOM 0 HD3 ARG A 102 -1.713 15.747 -11.703 1.00 1.00 H new ATOM 0 HE ARG A 102 -0.413 13.670 -10.233 1.00 1.00 H new ATOM 0 HH11 ARG A 102 0.172 16.052 -12.739 1.00 1.00 H new ATOM 0 HH12 ARG A 102 1.878 16.258 -12.332 1.00 1.00 H new ATOM 0 HH21 ARG A 102 1.784 13.937 -9.717 1.00 1.00 H new ATOM 0 HH22 ARG A 102 2.784 15.069 -10.633 1.00 1.00 H new ATOM 1639 N ALA A 103 -2.749 9.465 -12.751 1.00 1.00 N ATOM 1640 CA ALA A 103 -2.244 8.106 -12.895 1.00 1.00 C ATOM 1641 C ALA A 103 -2.187 7.696 -14.362 1.00 1.00 C ATOM 1642 O ALA A 103 -1.274 6.990 -14.788 1.00 1.00 O ATOM 1643 CB ALA A 103 -3.139 7.139 -12.121 1.00 1.00 C ATOM 0 H ALA A 103 -3.658 9.534 -12.293 1.00 1.00 H new ATOM 0 HA ALA A 103 -1.232 8.071 -12.491 1.00 1.00 H new ATOM 0 HB1 ALA A 103 -2.758 6.124 -12.231 1.00 1.00 H new ATOM 0 HB2 ALA A 103 -3.143 7.413 -11.066 1.00 1.00 H new ATOM 0 HB3 ALA A 103 -4.155 7.190 -12.513 1.00 1.00 H new ATOM 1649 N LYS A 104 -3.179 8.145 -15.124 1.00 1.00 N ATOM 1650 CA LYS A 104 -3.256 7.825 -16.552 1.00 1.00 C ATOM 1651 C LYS A 104 -2.511 8.867 -17.376 1.00 1.00 C ATOM 1652 O LYS A 104 -2.651 8.913 -18.600 1.00 1.00 O ATOM 1653 CB LYS A 104 -4.734 7.768 -16.982 1.00 1.00 C ATOM 1654 CG LYS A 104 -4.894 6.915 -18.251 1.00 1.00 C ATOM 1655 CD LYS A 104 -6.376 6.770 -18.607 1.00 1.00 C ATOM 1656 CE LYS A 104 -6.513 5.902 -19.860 1.00 1.00 C ATOM 1657 NZ LYS A 104 -7.956 5.777 -20.211 1.00 1.00 N ATOM 0 H LYS A 104 -3.941 8.730 -14.781 1.00 1.00 H new ATOM 0 HA LYS A 104 -2.788 6.856 -16.725 1.00 1.00 H new ATOM 0 HB2 LYS A 104 -5.337 7.349 -16.177 1.00 1.00 H new ATOM 0 HB3 LYS A 104 -5.104 8.777 -17.166 1.00 1.00 H new ATOM 0 HG2 LYS A 104 -4.357 7.378 -19.079 1.00 1.00 H new ATOM 0 HG3 LYS A 104 -4.452 5.931 -18.095 1.00 1.00 H new ATOM 0 HD2 LYS A 104 -6.919 6.318 -17.777 1.00 1.00 H new ATOM 0 HD3 LYS A 104 -6.818 7.751 -18.780 1.00 1.00 H new ATOM 0 HE2 LYS A 104 -5.962 6.347 -20.688 1.00 1.00 H new ATOM 0 HE3 LYS A 104 -6.082 4.916 -19.684 1.00 1.00 H new ATOM 0 HZ1 LYS A 104 -8.056 5.188 -21.062 1.00 1.00 H new ATOM 0 HZ2 LYS A 104 -8.468 5.335 -19.421 1.00 1.00 H new ATOM 0 HZ3 LYS A 104 -8.352 6.721 -20.395 1.00 1.00 H new ATOM 1671 N LEU A 105 -1.724 9.697 -16.701 1.00 1.00 N ATOM 1672 CA LEU A 105 -0.970 10.738 -17.396 1.00 1.00 C ATOM 1673 C LEU A 105 0.397 10.198 -17.808 1.00 1.00 C ATOM 1674 O LEU A 105 1.249 9.904 -16.970 1.00 1.00 O ATOM 1675 CB LEU A 105 -0.809 11.961 -16.479 1.00 1.00 C ATOM 1676 CG LEU A 105 -0.589 13.244 -17.301 1.00 1.00 C ATOM 1677 CD1 LEU A 105 -0.365 14.421 -16.348 1.00 1.00 C ATOM 1678 CD2 LEU A 105 0.628 13.097 -18.236 1.00 1.00 C ATOM 0 H LEU A 105 -1.591 9.673 -15.690 1.00 1.00 H new ATOM 0 HA LEU A 105 -1.511 11.040 -18.293 1.00 1.00 H new ATOM 0 HB2 LEU A 105 -1.697 12.072 -15.856 1.00 1.00 H new ATOM 0 HB3 LEU A 105 0.035 11.807 -15.807 1.00 1.00 H new ATOM 0 HG LEU A 105 -1.473 13.422 -17.914 1.00 1.00 H new ATOM 0 HD11 LEU A 105 -0.209 15.332 -16.926 1.00 1.00 H new ATOM 0 HD12 LEU A 105 -1.239 14.542 -15.708 1.00 1.00 H new ATOM 0 HD13 LEU A 105 0.512 14.228 -15.731 1.00 1.00 H new ATOM 0 HD21 LEU A 105 0.762 14.016 -18.806 1.00 1.00 H new ATOM 0 HD22 LEU A 105 1.522 12.904 -17.642 1.00 1.00 H new ATOM 0 HD23 LEU A 105 0.462 12.266 -18.922 1.00 1.00 H new