USER MOD reduce.3.24.130724 H: found=0, std=0, add=979, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 981 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 41 CYS SG : rot -75:sc= 0.919 USER MOD Set 1.2: A 66 CYS SG : rot 140:sc= 0.947 USER MOD Set 1.3: A 128 CYS SG : rot -27:sc= 2.05 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot -124:sc= 1.02 USER MOD Single : A 13 GLN : amide:sc= -0.335 X(o=-0.34,f=-0.18) USER MOD Single : A 16 MET CE :methyl -159:sc= -0.261 (180deg=-1.06) USER MOD Single : A 18 HIS : no HD1:sc= 0.336 K(o=0.34,f=-3.2!) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -170:sc=-0.00174 (180deg=-0.0812) USER MOD Single : A 21 ASN : amide:sc= -0.967 X(o=-0.97,f=-1.1) USER MOD Single : A 24 ASN : amide:sc= -2.63 K(o=-2.6,f=-6.8!) USER MOD Single : A 25 LYS NZ :NH3+ 166:sc= -0.0366 (180deg=-0.286) USER MOD Single : A 29 ASN : amide:sc= -0.0823 X(o=-0.082,f=-0.56) USER MOD Single : A 31 SER OG : rot -78:sc= 0.969 USER MOD Single : A 36 MET CE :methyl -149:sc= -5.5! (180deg=-6.22!) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 38 ASN : amide:sc= -5.89! C(o=-5.9!,f=-7!) USER MOD Single : A 40 THR OG1 : rot -12:sc= 1.04 USER MOD Single : A 48 THR OG1 : rot -90:sc= 1.03 USER MOD Single : A 49 MET CE :methyl -133:sc= -2.77! (180deg=-4.76!) USER MOD Single : A 50 LYS NZ :NH3+ -164:sc= 2.31 (180deg=1.82) USER MOD Single : A 60 LYS NZ :NH3+ -170:sc= 1.16 (180deg=0.847) USER MOD Single : A 67 SER OG : rot 180:sc= 0.0252 USER MOD Single : A 69 SER OG : rot 9:sc= 0.623 USER MOD Single : A 70 MET CE :methyl 136:sc= -0.403 (180deg=-3.46!) USER MOD Single : A 72 SER OG : rot 79:sc= 0.269 USER MOD Single : A 74 SER OG : rot 99:sc= 0.425 USER MOD Single : A 75 MET CE :methyl -166:sc= -0.0384 (180deg=-0.364) USER MOD Single : A 76 MET CE :methyl 158:sc= -4.73! (180deg=-7.06!) USER MOD Single : A 77 THR OG1 : rot 78:sc= 1.22 USER MOD Single : A 78 GLN : amide:sc= -0.0338 X(o=-0.034,f=-0.45) USER MOD Single : A 81 LYS NZ :NH3+ -178:sc= 1.14 (180deg=1.14) USER MOD Single : A 83 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.00865) USER MOD Single : A 87 THR OG1 : rot -145:sc= 0.969 USER MOD Single : A 90 SER OG : rot -94:sc= 1.12 USER MOD Single : A 91 MET CE :methyl 163:sc= -0.121 (180deg=-0.551) USER MOD Single : A 92 SER OG : rot 115:sc= -0.378! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -1.34 X(o=-1.3,f=-1.7) USER MOD Single : A 120 SER OG : rot -64:sc= 1.17 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0416) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 82:sc= 0.699 USER MOD Single : A 134 LYS NZ :NH3+ -169:sc= -0.0217 (180deg=-0.192) USER MOD Single : A 138 LYS NZ :NH3+ 168:sc=-0.00969 (180deg=-0.199) USER MOD Single : A 142 LYS NZ :NH3+ -128:sc= 0.657 (180deg=-0.767) USER MOD ----------------------------------------------------------------- ATOM 89 N LEU A 7 -10.010 -7.731 12.185 1.00 0.00 N ATOM 90 CA LEU A 7 -9.536 -7.741 10.809 1.00 0.00 C ATOM 91 C LEU A 7 -10.668 -8.057 9.843 1.00 0.00 C ATOM 92 O LEU A 7 -10.859 -7.352 8.849 1.00 0.00 O ATOM 93 CB LEU A 7 -8.399 -8.754 10.645 1.00 0.00 C ATOM 94 CG LEU A 7 -7.763 -8.803 9.253 1.00 0.00 C ATOM 95 CD1 LEU A 7 -7.101 -7.474 8.921 1.00 0.00 C ATOM 96 CD2 LEU A 7 -6.758 -9.941 9.173 1.00 0.00 C ATOM 0 HA LEU A 7 -9.158 -6.746 10.574 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -7.622 -8.524 11.374 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -8.780 -9.746 10.888 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.547 -8.984 8.518 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.655 -7.528 7.928 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -7.848 -6.681 8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.325 -7.260 9.656 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.313 -9.964 8.178 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -5.976 -9.789 9.917 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.263 -10.887 9.367 1.00 0.00 H new ATOM 108 N ASP A 8 -11.429 -9.104 10.155 1.00 0.00 N ATOM 109 CA ASP A 8 -12.494 -9.572 9.272 1.00 0.00 C ATOM 110 C ASP A 8 -13.529 -8.483 9.020 1.00 0.00 C ATOM 111 O ASP A 8 -13.891 -8.213 7.874 1.00 0.00 O ATOM 112 CB ASP A 8 -13.178 -10.811 9.851 1.00 0.00 C ATOM 113 CG ASP A 8 -14.237 -11.365 8.914 1.00 0.00 C ATOM 114 OD1 ASP A 8 -13.873 -12.096 7.966 1.00 0.00 O ATOM 115 OD2 ASP A 8 -15.433 -11.062 9.118 1.00 0.00 O ATOM 0 H ASP A 8 -11.327 -9.645 11.014 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.031 -9.834 8.320 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -12.430 -11.579 10.048 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -13.636 -10.559 10.807 1.00 0.00 H new ATOM 120 N THR A 9 -13.972 -7.829 10.084 1.00 0.00 N ATOM 121 CA THR A 9 -15.019 -6.826 9.968 1.00 0.00 C ATOM 122 C THR A 9 -14.481 -5.549 9.319 1.00 0.00 C ATOM 123 O THR A 9 -15.236 -4.784 8.714 1.00 0.00 O ATOM 124 CB THR A 9 -15.658 -6.501 11.342 1.00 0.00 C ATOM 125 OG1 THR A 9 -16.731 -5.563 11.179 1.00 0.00 O ATOM 126 CG2 THR A 9 -14.633 -5.938 12.314 1.00 0.00 C ATOM 0 H THR A 9 -13.625 -7.974 11.032 1.00 0.00 H new ATOM 0 HA THR A 9 -15.796 -7.244 9.329 1.00 0.00 H new ATOM 0 HB THR A 9 -16.045 -7.433 11.755 1.00 0.00 H new ATOM 0 HG1 THR A 9 -17.129 -5.366 12.053 1.00 0.00 H new ATOM 0 HG21 THR A 9 -15.116 -5.721 13.267 1.00 0.00 H new ATOM 0 HG22 THR A 9 -13.838 -6.668 12.468 1.00 0.00 H new ATOM 0 HG23 THR A 9 -14.209 -5.021 11.905 1.00 0.00 H new ATOM 134 N LEU A 10 -13.171 -5.338 9.414 1.00 0.00 N ATOM 135 CA LEU A 10 -12.547 -4.158 8.836 1.00 0.00 C ATOM 136 C LEU A 10 -12.555 -4.249 7.317 1.00 0.00 C ATOM 137 O LEU A 10 -13.060 -3.360 6.636 1.00 0.00 O ATOM 138 CB LEU A 10 -11.110 -4.007 9.343 1.00 0.00 C ATOM 139 CG LEU A 10 -10.348 -2.794 8.804 1.00 0.00 C ATOM 140 CD1 LEU A 10 -11.043 -1.499 9.197 1.00 0.00 C ATOM 141 CD2 LEU A 10 -8.912 -2.806 9.305 1.00 0.00 C ATOM 0 H LEU A 10 -12.524 -5.970 9.886 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.119 -3.282 9.142 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -11.131 -3.947 10.431 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -10.555 -4.908 9.084 1.00 0.00 H new ATOM 0 HG LEU A 10 -10.336 -2.853 7.716 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -10.483 -0.651 8.803 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.053 -1.489 8.787 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -11.092 -1.428 10.284 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.383 -1.937 8.913 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.906 -2.773 10.395 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -8.416 -3.716 8.967 1.00 0.00 H new ATOM 153 N TYR A 11 -12.031 -5.347 6.789 1.00 0.00 N ATOM 154 CA TYR A 11 -11.923 -5.508 5.352 1.00 0.00 C ATOM 155 C TYR A 11 -13.284 -5.817 4.751 1.00 0.00 C ATOM 156 O TYR A 11 -13.487 -5.642 3.560 1.00 0.00 O ATOM 157 CB TYR A 11 -10.892 -6.586 4.966 1.00 0.00 C ATOM 158 CG TYR A 11 -11.361 -8.025 5.103 1.00 0.00 C ATOM 159 CD1 TYR A 11 -12.159 -8.620 4.127 1.00 0.00 C ATOM 160 CD2 TYR A 11 -10.990 -8.794 6.193 1.00 0.00 C ATOM 161 CE1 TYR A 11 -12.576 -9.931 4.244 1.00 0.00 C ATOM 162 CE2 TYR A 11 -11.401 -10.109 6.316 1.00 0.00 C ATOM 163 CZ TYR A 11 -12.194 -10.671 5.340 1.00 0.00 C ATOM 164 OH TYR A 11 -12.603 -11.981 5.458 1.00 0.00 O ATOM 0 H TYR A 11 -11.677 -6.133 7.334 1.00 0.00 H new ATOM 0 HA TYR A 11 -11.564 -4.564 4.941 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -10.589 -6.419 3.933 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -10.005 -6.452 5.584 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -12.457 -8.045 3.263 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -10.368 -8.359 6.961 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -13.198 -10.373 3.480 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -11.101 -10.693 7.174 1.00 0.00 H new ATOM 0 HH TYR A 11 -13.073 -12.101 6.309 1.00 0.00 H new ATOM 174 N ARG A 12 -14.215 -6.282 5.575 1.00 0.00 N ATOM 175 CA ARG A 12 -15.580 -6.491 5.115 1.00 0.00 C ATOM 176 C ARG A 12 -16.214 -5.143 4.795 1.00 0.00 C ATOM 177 O ARG A 12 -16.975 -5.007 3.840 1.00 0.00 O ATOM 178 CB ARG A 12 -16.399 -7.244 6.167 1.00 0.00 C ATOM 179 CG ARG A 12 -17.715 -7.790 5.638 1.00 0.00 C ATOM 180 CD ARG A 12 -18.419 -8.643 6.676 1.00 0.00 C ATOM 181 NE ARG A 12 -18.934 -7.849 7.787 1.00 0.00 N ATOM 182 CZ ARG A 12 -18.651 -8.080 9.071 1.00 0.00 C ATOM 183 NH1 ARG A 12 -17.797 -9.043 9.410 1.00 0.00 N ATOM 184 NH2 ARG A 12 -19.217 -7.336 10.015 1.00 0.00 N ATOM 0 H ARG A 12 -14.052 -6.519 6.554 1.00 0.00 H new ATOM 0 HA ARG A 12 -15.565 -7.102 4.212 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -15.803 -8.070 6.556 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -16.603 -6.575 7.003 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -18.362 -6.963 5.345 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -17.531 -8.383 4.742 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -19.242 -9.181 6.204 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -17.726 -9.392 7.058 1.00 0.00 H new ATOM 0 HE ARG A 12 -19.550 -7.066 7.568 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -17.354 -9.610 8.687 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -17.585 -9.214 10.393 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -19.865 -6.592 9.758 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -19.004 -7.509 10.997 1.00 0.00 H new ATOM 198 N GLN A 13 -15.861 -4.137 5.588 1.00 0.00 N ATOM 199 CA GLN A 13 -16.269 -2.769 5.313 1.00 0.00 C ATOM 200 C GLN A 13 -15.478 -2.225 4.134 1.00 0.00 C ATOM 201 O GLN A 13 -16.017 -1.503 3.293 1.00 0.00 O ATOM 202 CB GLN A 13 -16.056 -1.868 6.536 1.00 0.00 C ATOM 203 CG GLN A 13 -17.042 -2.108 7.666 1.00 0.00 C ATOM 204 CD GLN A 13 -18.480 -1.847 7.256 1.00 0.00 C ATOM 205 OE1 GLN A 13 -18.969 -0.719 7.347 1.00 0.00 O ATOM 206 NE2 GLN A 13 -19.176 -2.888 6.830 1.00 0.00 N ATOM 0 H GLN A 13 -15.292 -4.246 6.427 1.00 0.00 H new ATOM 0 HA GLN A 13 -17.333 -2.774 5.074 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -15.045 -2.020 6.913 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -16.126 -0.826 6.223 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -16.948 -3.138 8.011 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -16.786 -1.465 8.508 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -18.735 -3.806 6.769 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -20.154 -2.773 6.563 1.00 0.00 H new ATOM 215 N VAL A 14 -14.194 -2.585 4.072 1.00 0.00 N ATOM 216 CA VAL A 14 -13.344 -2.168 2.963 1.00 0.00 C ATOM 217 C VAL A 14 -13.891 -2.699 1.639 1.00 0.00 C ATOM 218 O VAL A 14 -14.067 -1.944 0.687 1.00 0.00 O ATOM 219 CB VAL A 14 -11.883 -2.643 3.149 1.00 0.00 C ATOM 220 CG1 VAL A 14 -11.036 -2.290 1.935 1.00 0.00 C ATOM 221 CG2 VAL A 14 -11.280 -2.033 4.405 1.00 0.00 C ATOM 0 H VAL A 14 -13.726 -3.160 4.773 1.00 0.00 H new ATOM 0 HA VAL A 14 -13.348 -1.078 2.947 1.00 0.00 H new ATOM 0 HB VAL A 14 -11.893 -3.728 3.255 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -10.014 -2.635 2.092 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -11.450 -2.773 1.050 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -11.036 -1.209 1.793 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -10.252 -2.378 4.520 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -11.291 -0.946 4.323 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -11.864 -2.337 5.274 1.00 0.00 H new ATOM 231 N ILE A 15 -14.179 -3.995 1.600 1.00 0.00 N ATOM 232 CA ILE A 15 -14.731 -4.634 0.410 1.00 0.00 C ATOM 233 C ILE A 15 -16.037 -3.973 -0.002 1.00 0.00 C ATOM 234 O ILE A 15 -16.189 -3.557 -1.145 1.00 0.00 O ATOM 235 CB ILE A 15 -14.978 -6.148 0.632 1.00 0.00 C ATOM 236 CG1 ILE A 15 -13.652 -6.892 0.800 1.00 0.00 C ATOM 237 CG2 ILE A 15 -15.785 -6.749 -0.515 1.00 0.00 C ATOM 238 CD1 ILE A 15 -12.757 -6.830 -0.418 1.00 0.00 C ATOM 0 H ILE A 15 -14.038 -4.629 2.386 1.00 0.00 H new ATOM 0 HA ILE A 15 -13.993 -4.514 -0.383 1.00 0.00 H new ATOM 0 HB ILE A 15 -15.558 -6.261 1.548 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -13.118 -6.474 1.653 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -13.859 -7.936 1.034 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -15.942 -7.812 -0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -16.749 -6.246 -0.584 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -15.240 -6.619 -1.450 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.837 -7.380 -0.222 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -13.271 -7.275 -1.270 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.518 -5.790 -0.641 1.00 0.00 H new ATOM 250 N MET A 16 -16.961 -3.860 0.943 1.00 0.00 N ATOM 251 CA MET A 16 -18.299 -3.353 0.652 1.00 0.00 C ATOM 252 C MET A 16 -18.261 -1.929 0.099 1.00 0.00 C ATOM 253 O MET A 16 -18.783 -1.657 -0.987 1.00 0.00 O ATOM 254 CB MET A 16 -19.162 -3.397 1.911 1.00 0.00 C ATOM 255 CG MET A 16 -20.600 -2.952 1.687 1.00 0.00 C ATOM 256 SD MET A 16 -21.600 -3.068 3.181 1.00 0.00 S ATOM 257 CE MET A 16 -21.416 -4.807 3.572 1.00 0.00 C ATOM 0 H MET A 16 -16.810 -4.113 1.920 1.00 0.00 H new ATOM 0 HA MET A 16 -18.734 -3.996 -0.113 1.00 0.00 H new ATOM 0 HB2 MET A 16 -19.163 -4.414 2.304 1.00 0.00 H new ATOM 0 HB3 MET A 16 -18.710 -2.762 2.673 1.00 0.00 H new ATOM 0 HG2 MET A 16 -20.607 -1.923 1.329 1.00 0.00 H new ATOM 0 HG3 MET A 16 -21.049 -3.565 0.905 1.00 0.00 H new ATOM 0 HE1 MET A 16 -22.236 -5.124 4.217 1.00 0.00 H new ATOM 0 HE2 MET A 16 -21.432 -5.391 2.652 1.00 0.00 H new ATOM 0 HE3 MET A 16 -20.468 -4.966 4.086 1.00 0.00 H new ATOM 267 N ASP A 17 -17.625 -1.028 0.833 1.00 0.00 N ATOM 268 CA ASP A 17 -17.629 0.386 0.467 1.00 0.00 C ATOM 269 C ASP A 17 -16.792 0.632 -0.783 1.00 0.00 C ATOM 270 O ASP A 17 -17.164 1.432 -1.642 1.00 0.00 O ATOM 271 CB ASP A 17 -17.116 1.242 1.624 1.00 0.00 C ATOM 272 CG ASP A 17 -17.360 2.722 1.399 1.00 0.00 C ATOM 273 OD1 ASP A 17 -18.491 3.187 1.664 1.00 0.00 O ATOM 274 OD2 ASP A 17 -16.425 3.433 0.977 1.00 0.00 O ATOM 0 H ASP A 17 -17.102 -1.246 1.681 1.00 0.00 H new ATOM 0 HA ASP A 17 -18.658 0.672 0.249 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -17.606 0.932 2.547 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -16.048 1.068 1.756 1.00 0.00 H new ATOM 279 N HIS A 18 -15.676 -0.080 -0.904 1.00 0.00 N ATOM 280 CA HIS A 18 -14.790 0.093 -2.050 1.00 0.00 C ATOM 281 C HIS A 18 -15.354 -0.611 -3.283 1.00 0.00 C ATOM 282 O HIS A 18 -14.946 -0.329 -4.404 1.00 0.00 O ATOM 283 CB HIS A 18 -13.374 -0.413 -1.745 1.00 0.00 C ATOM 284 CG HIS A 18 -12.375 -0.063 -2.806 1.00 0.00 C ATOM 285 ND1 HIS A 18 -11.790 1.180 -2.909 1.00 0.00 N ATOM 286 CD2 HIS A 18 -11.878 -0.797 -3.830 1.00 0.00 C ATOM 287 CE1 HIS A 18 -10.982 1.198 -3.952 1.00 0.00 C ATOM 288 NE2 HIS A 18 -11.015 0.009 -4.527 1.00 0.00 N ATOM 0 H HIS A 18 -15.365 -0.778 -0.228 1.00 0.00 H new ATOM 0 HA HIS A 18 -14.727 1.161 -2.258 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -13.044 0.005 -0.794 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -13.401 -1.496 -1.625 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -12.117 -1.826 -4.056 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -10.393 2.042 -4.280 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -10.485 -0.265 -5.354 1.00 0.00 H new ATOM 297 N TYR A 19 -16.275 -1.544 -3.070 1.00 0.00 N ATOM 298 CA TYR A 19 -16.974 -2.192 -4.176 1.00 0.00 C ATOM 299 C TYR A 19 -17.898 -1.183 -4.846 1.00 0.00 C ATOM 300 O TYR A 19 -18.138 -1.238 -6.053 1.00 0.00 O ATOM 301 CB TYR A 19 -17.776 -3.393 -3.670 1.00 0.00 C ATOM 302 CG TYR A 19 -18.363 -4.249 -4.768 1.00 0.00 C ATOM 303 CD1 TYR A 19 -17.570 -5.143 -5.477 1.00 0.00 C ATOM 304 CD2 TYR A 19 -19.710 -4.167 -5.093 1.00 0.00 C ATOM 305 CE1 TYR A 19 -18.104 -5.934 -6.479 1.00 0.00 C ATOM 306 CE2 TYR A 19 -20.252 -4.954 -6.090 1.00 0.00 C ATOM 307 CZ TYR A 19 -19.446 -5.835 -6.781 1.00 0.00 C ATOM 308 OH TYR A 19 -19.986 -6.620 -7.776 1.00 0.00 O ATOM 0 H TYR A 19 -16.555 -1.869 -2.145 1.00 0.00 H new ATOM 0 HA TYR A 19 -16.244 -2.552 -4.902 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -17.130 -4.012 -3.048 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -18.584 -3.034 -3.032 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -16.519 -5.222 -5.242 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -20.345 -3.476 -4.557 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -17.474 -6.624 -7.021 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -21.303 -4.880 -6.328 1.00 0.00 H new ATOM 0 HH TYR A 19 -20.943 -6.428 -7.861 1.00 0.00 H new ATOM 318 N LYS A 20 -18.408 -0.260 -4.038 1.00 0.00 N ATOM 319 CA LYS A 20 -19.207 0.848 -4.538 1.00 0.00 C ATOM 320 C LYS A 20 -18.297 1.856 -5.245 1.00 0.00 C ATOM 321 O LYS A 20 -18.739 2.635 -6.094 1.00 0.00 O ATOM 322 CB LYS A 20 -19.959 1.506 -3.375 1.00 0.00 C ATOM 323 CG LYS A 20 -20.982 2.547 -3.797 1.00 0.00 C ATOM 324 CD LYS A 20 -21.766 3.054 -2.598 1.00 0.00 C ATOM 325 CE LYS A 20 -22.762 4.135 -2.984 1.00 0.00 C ATOM 326 NZ LYS A 20 -22.089 5.383 -3.426 1.00 0.00 N ATOM 0 H LYS A 20 -18.280 -0.260 -3.026 1.00 0.00 H new ATOM 0 HA LYS A 20 -19.940 0.482 -5.257 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -20.464 0.730 -2.800 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -19.235 1.975 -2.709 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -20.478 3.381 -4.286 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -21.666 2.115 -4.528 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -22.296 2.222 -2.133 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -21.075 3.448 -1.853 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -23.404 3.767 -3.784 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -23.407 4.353 -2.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -22.793 6.143 -3.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -21.371 5.657 -2.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -21.631 5.223 -4.346 1.00 0.00 H new ATOM 340 N ASN A 21 -17.019 1.824 -4.886 1.00 0.00 N ATOM 341 CA ASN A 21 -15.998 2.614 -5.567 1.00 0.00 C ATOM 342 C ASN A 21 -15.470 1.831 -6.766 1.00 0.00 C ATOM 343 O ASN A 21 -15.796 0.655 -6.927 1.00 0.00 O ATOM 344 CB ASN A 21 -14.818 2.915 -4.631 1.00 0.00 C ATOM 345 CG ASN A 21 -15.188 3.697 -3.389 1.00 0.00 C ATOM 346 OD1 ASN A 21 -14.554 3.543 -2.348 1.00 0.00 O ATOM 347 ND2 ASN A 21 -16.197 4.546 -3.483 1.00 0.00 N ATOM 0 H ASN A 21 -16.662 1.254 -4.119 1.00 0.00 H new ATOM 0 HA ASN A 21 -16.452 3.553 -5.885 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -14.360 1.973 -4.329 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -14.064 3.473 -5.185 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -16.473 5.101 -2.673 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -16.699 4.646 -4.365 1.00 0.00 H new ATOM 354 N PRO A 22 -14.669 2.462 -7.640 1.00 0.00 N ATOM 355 CA PRO A 22 -13.941 1.738 -8.682 1.00 0.00 C ATOM 356 C PRO A 22 -13.032 0.674 -8.069 1.00 0.00 C ATOM 357 O PRO A 22 -12.239 0.972 -7.175 1.00 0.00 O ATOM 358 CB PRO A 22 -13.112 2.826 -9.374 1.00 0.00 C ATOM 359 CG PRO A 22 -13.819 4.100 -9.068 1.00 0.00 C ATOM 360 CD PRO A 22 -14.432 3.914 -7.708 1.00 0.00 C ATOM 0 HA PRO A 22 -14.603 1.211 -9.369 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -12.089 2.842 -8.998 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.054 2.655 -10.449 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -13.127 4.942 -9.073 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.584 4.312 -9.815 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -13.763 4.250 -6.916 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -15.359 4.478 -7.604 1.00 0.00 H new ATOM 368 N ARG A 23 -13.174 -0.567 -8.529 1.00 0.00 N ATOM 369 CA ARG A 23 -12.396 -1.683 -7.996 1.00 0.00 C ATOM 370 C ARG A 23 -10.902 -1.408 -8.140 1.00 0.00 C ATOM 371 O ARG A 23 -10.221 -1.100 -7.162 1.00 0.00 O ATOM 372 CB ARG A 23 -12.754 -2.978 -8.732 1.00 0.00 C ATOM 373 CG ARG A 23 -12.247 -4.235 -8.042 1.00 0.00 C ATOM 374 CD ARG A 23 -12.145 -5.402 -9.011 1.00 0.00 C ATOM 375 NE ARG A 23 -11.012 -5.246 -9.926 1.00 0.00 N ATOM 376 CZ ARG A 23 -10.887 -5.887 -11.090 1.00 0.00 C ATOM 377 NH1 ARG A 23 -11.851 -6.690 -11.526 1.00 0.00 N ATOM 378 NH2 ARG A 23 -9.797 -5.714 -11.825 1.00 0.00 N ATOM 0 H ARG A 23 -13.823 -0.826 -9.272 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.636 -1.794 -6.938 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -13.838 -3.041 -8.831 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -12.343 -2.937 -9.741 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -11.269 -4.040 -7.602 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -12.918 -4.498 -7.224 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -12.037 -6.331 -8.452 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -13.068 -5.481 -9.585 1.00 0.00 H new ATOM 0 HE ARG A 23 -10.268 -4.604 -9.655 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -12.696 -6.821 -10.970 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.746 -7.176 -12.417 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -9.056 -5.092 -11.500 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.699 -6.203 -12.715 1.00 0.00 H new ATOM 392 N ASN A 24 -10.415 -1.524 -9.372 1.00 0.00 N ATOM 393 CA ASN A 24 -9.028 -1.224 -9.715 1.00 0.00 C ATOM 394 C ASN A 24 -8.816 -1.401 -11.213 1.00 0.00 C ATOM 395 O ASN A 24 -8.952 -2.506 -11.743 1.00 0.00 O ATOM 396 CB ASN A 24 -8.015 -2.087 -8.930 1.00 0.00 C ATOM 397 CG ASN A 24 -8.341 -3.569 -8.896 1.00 0.00 C ATOM 398 OD1 ASN A 24 -8.068 -4.308 -9.839 1.00 0.00 O ATOM 399 ND2 ASN A 24 -8.883 -4.027 -7.778 1.00 0.00 N ATOM 0 H ASN A 24 -10.976 -1.831 -10.167 1.00 0.00 H new ATOM 0 HA ASN A 24 -8.845 -0.187 -9.432 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.027 -1.956 -9.371 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.959 -1.717 -7.906 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -9.087 -5.022 -7.680 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -9.097 -3.385 -7.015 1.00 0.00 H new ATOM 406 N LYS A 25 -8.525 -0.296 -11.895 1.00 0.00 N ATOM 407 CA LYS A 25 -8.286 -0.306 -13.336 1.00 0.00 C ATOM 408 C LYS A 25 -7.292 0.782 -13.730 1.00 0.00 C ATOM 409 O LYS A 25 -7.598 1.972 -13.624 1.00 0.00 O ATOM 410 CB LYS A 25 -9.594 -0.078 -14.106 1.00 0.00 C ATOM 411 CG LYS A 25 -10.568 -1.240 -14.045 1.00 0.00 C ATOM 412 CD LYS A 25 -10.018 -2.461 -14.760 1.00 0.00 C ATOM 413 CE LYS A 25 -10.979 -3.633 -14.678 1.00 0.00 C ATOM 414 NZ LYS A 25 -12.304 -3.306 -15.266 1.00 0.00 N ATOM 0 H LYS A 25 -8.448 0.627 -11.467 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.876 -1.283 -13.591 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.084 0.812 -13.711 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.356 0.126 -15.150 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.776 -1.489 -13.004 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.515 -0.947 -14.498 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -9.828 -2.217 -15.805 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.061 -2.742 -14.319 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.552 -4.490 -15.199 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.107 -3.925 -13.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.846 -4.182 -15.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.824 -2.677 -14.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.170 -2.830 -16.181 1.00 0.00 H new ATOM 428 N GLY A 26 -6.101 0.387 -14.156 1.00 0.00 N ATOM 429 CA GLY A 26 -5.183 1.348 -14.730 1.00 0.00 C ATOM 430 C GLY A 26 -3.726 0.960 -14.587 1.00 0.00 C ATOM 431 O GLY A 26 -3.318 0.411 -13.566 1.00 0.00 O ATOM 0 H GLY A 26 -5.757 -0.572 -14.115 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -5.415 1.471 -15.788 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -5.340 2.316 -14.254 1.00 0.00 H new ATOM 435 N VAL A 27 -2.946 1.253 -15.625 1.00 0.00 N ATOM 436 CA VAL A 27 -1.499 1.069 -15.596 1.00 0.00 C ATOM 437 C VAL A 27 -0.829 2.283 -16.237 1.00 0.00 C ATOM 438 O VAL A 27 -0.858 2.440 -17.458 1.00 0.00 O ATOM 439 CB VAL A 27 -1.047 -0.210 -16.343 1.00 0.00 C ATOM 440 CG1 VAL A 27 0.451 -0.423 -16.177 1.00 0.00 C ATOM 441 CG2 VAL A 27 -1.813 -1.432 -15.861 1.00 0.00 C ATOM 0 H VAL A 27 -3.299 1.624 -16.507 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.203 0.962 -14.552 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.267 -0.073 -17.402 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.751 -1.326 -16.708 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.988 0.433 -16.585 1.00 0.00 H new ATOM 0 HG13 VAL A 27 0.688 -0.529 -15.118 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.472 -2.313 -16.405 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.638 -1.574 -14.795 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.879 -1.286 -16.038 1.00 0.00 H new ATOM 451 N LEU A 28 -0.251 3.147 -15.415 1.00 0.00 N ATOM 452 CA LEU A 28 0.324 4.399 -15.894 1.00 0.00 C ATOM 453 C LEU A 28 1.848 4.296 -15.958 1.00 0.00 C ATOM 454 O LEU A 28 2.549 4.622 -14.999 1.00 0.00 O ATOM 455 CB LEU A 28 -0.107 5.544 -14.963 1.00 0.00 C ATOM 456 CG LEU A 28 -0.153 6.949 -15.580 1.00 0.00 C ATOM 457 CD1 LEU A 28 -0.822 7.923 -14.624 1.00 0.00 C ATOM 458 CD2 LEU A 28 1.237 7.447 -15.930 1.00 0.00 C ATOM 0 H LEU A 28 -0.167 3.004 -14.409 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.040 4.603 -16.901 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.097 5.311 -14.572 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.575 5.567 -14.113 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.734 6.887 -16.500 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.848 8.915 -15.074 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.840 7.591 -14.419 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.259 7.962 -13.692 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.168 8.444 -16.365 1.00 0.00 H new ATOM 0 HD22 LEU A 28 1.847 7.486 -15.028 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.696 6.769 -16.649 1.00 0.00 H new ATOM 470 N ASN A 29 2.359 3.818 -17.081 1.00 0.00 N ATOM 471 CA ASN A 29 3.799 3.686 -17.261 1.00 0.00 C ATOM 472 C ASN A 29 4.409 5.049 -17.551 1.00 0.00 C ATOM 473 O ASN A 29 4.314 5.555 -18.671 1.00 0.00 O ATOM 474 CB ASN A 29 4.124 2.714 -18.401 1.00 0.00 C ATOM 475 CG ASN A 29 3.576 1.321 -18.158 1.00 0.00 C ATOM 476 OD1 ASN A 29 2.430 1.024 -18.506 1.00 0.00 O ATOM 477 ND2 ASN A 29 4.391 0.451 -17.585 1.00 0.00 N ATOM 0 H ASN A 29 1.802 3.515 -17.880 1.00 0.00 H new ATOM 0 HA ASN A 29 4.225 3.286 -16.341 1.00 0.00 H new ATOM 0 HB2 ASN A 29 3.714 3.104 -19.333 1.00 0.00 H new ATOM 0 HB3 ASN A 29 5.205 2.657 -18.527 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.079 -0.505 -17.416 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.331 0.736 -17.312 1.00 0.00 H new ATOM 484 N ASP A 30 4.997 5.656 -16.529 1.00 0.00 N ATOM 485 CA ASP A 30 5.591 6.982 -16.666 1.00 0.00 C ATOM 486 C ASP A 30 6.764 7.168 -15.714 1.00 0.00 C ATOM 487 O ASP A 30 7.917 7.220 -16.138 1.00 0.00 O ATOM 488 CB ASP A 30 4.548 8.068 -16.405 1.00 0.00 C ATOM 489 CG ASP A 30 5.147 9.462 -16.411 1.00 0.00 C ATOM 490 OD1 ASP A 30 5.451 9.978 -17.508 1.00 0.00 O ATOM 491 OD2 ASP A 30 5.308 10.047 -15.318 1.00 0.00 O ATOM 0 H ASP A 30 5.076 5.253 -15.595 1.00 0.00 H new ATOM 0 HA ASP A 30 5.957 7.069 -17.689 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.768 8.008 -17.164 1.00 0.00 H new ATOM 0 HB3 ASP A 30 4.071 7.885 -15.442 1.00 0.00 H new ATOM 496 N SER A 31 6.469 7.282 -14.429 1.00 0.00 N ATOM 497 CA SER A 31 7.499 7.523 -13.436 1.00 0.00 C ATOM 498 C SER A 31 7.584 6.360 -12.456 1.00 0.00 C ATOM 499 O SER A 31 8.545 5.589 -12.480 1.00 0.00 O ATOM 500 CB SER A 31 7.214 8.841 -12.717 1.00 0.00 C ATOM 501 OG SER A 31 5.820 9.112 -12.701 1.00 0.00 O ATOM 0 H SER A 31 5.524 7.211 -14.051 1.00 0.00 H new ATOM 0 HA SER A 31 8.467 7.600 -13.931 1.00 0.00 H new ATOM 0 HB2 SER A 31 7.592 8.793 -11.696 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.742 9.654 -13.215 1.00 0.00 H new ATOM 0 HG SER A 31 5.545 9.463 -13.574 1.00 0.00 H new ATOM 507 N ILE A 32 6.578 6.218 -11.602 1.00 0.00 N ATOM 508 CA ILE A 32 6.516 5.071 -10.713 1.00 0.00 C ATOM 509 C ILE A 32 5.819 3.919 -11.406 1.00 0.00 C ATOM 510 O ILE A 32 4.646 4.011 -11.763 1.00 0.00 O ATOM 511 CB ILE A 32 5.791 5.379 -9.389 1.00 0.00 C ATOM 512 CG1 ILE A 32 6.589 6.393 -8.577 1.00 0.00 C ATOM 513 CG2 ILE A 32 5.571 4.100 -8.587 1.00 0.00 C ATOM 514 CD1 ILE A 32 6.005 6.652 -7.210 1.00 0.00 C ATOM 0 H ILE A 32 5.804 6.876 -11.508 1.00 0.00 H new ATOM 0 HA ILE A 32 7.545 4.806 -10.469 1.00 0.00 H new ATOM 0 HB ILE A 32 4.815 5.808 -9.617 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.613 6.035 -8.466 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.638 7.332 -9.128 1.00 0.00 H new ATOM 0 HG21 ILE A 32 5.058 4.338 -7.655 1.00 0.00 H new ATOM 0 HG22 ILE A 32 4.964 3.406 -9.168 1.00 0.00 H new ATOM 0 HG23 ILE A 32 6.534 3.641 -8.363 1.00 0.00 H new ATOM 0 HD11 ILE A 32 6.620 7.382 -6.684 1.00 0.00 H new ATOM 0 HD12 ILE A 32 4.991 7.039 -7.315 1.00 0.00 H new ATOM 0 HD13 ILE A 32 5.981 5.722 -6.642 1.00 0.00 H new ATOM 526 N VAL A 33 6.553 2.845 -11.601 1.00 0.00 N ATOM 527 CA VAL A 33 6.024 1.662 -12.256 1.00 0.00 C ATOM 528 C VAL A 33 6.372 0.428 -11.440 1.00 0.00 C ATOM 529 O VAL A 33 7.447 -0.154 -11.602 1.00 0.00 O ATOM 530 CB VAL A 33 6.571 1.493 -13.694 1.00 0.00 C ATOM 531 CG1 VAL A 33 5.928 0.295 -14.377 1.00 0.00 C ATOM 532 CG2 VAL A 33 6.354 2.757 -14.515 1.00 0.00 C ATOM 0 H VAL A 33 7.528 2.764 -11.313 1.00 0.00 H new ATOM 0 HA VAL A 33 4.943 1.784 -12.323 1.00 0.00 H new ATOM 0 HB VAL A 33 7.644 1.316 -13.625 1.00 0.00 H new ATOM 0 HG11 VAL A 33 6.327 0.194 -15.387 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.147 -0.609 -13.809 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.849 0.440 -14.426 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.748 2.610 -15.521 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.288 2.976 -14.571 1.00 0.00 H new ATOM 0 HG23 VAL A 33 6.871 3.592 -14.041 1.00 0.00 H new ATOM 542 N VAL A 34 5.485 0.054 -10.535 1.00 0.00 N ATOM 543 CA VAL A 34 5.724 -1.095 -9.685 1.00 0.00 C ATOM 544 C VAL A 34 4.727 -2.202 -9.987 1.00 0.00 C ATOM 545 O VAL A 34 3.547 -2.105 -9.648 1.00 0.00 O ATOM 546 CB VAL A 34 5.649 -0.733 -8.189 1.00 0.00 C ATOM 547 CG1 VAL A 34 6.013 -1.937 -7.336 1.00 0.00 C ATOM 548 CG2 VAL A 34 6.565 0.437 -7.875 1.00 0.00 C ATOM 0 H VAL A 34 4.597 0.528 -10.371 1.00 0.00 H new ATOM 0 HA VAL A 34 6.734 -1.443 -9.901 1.00 0.00 H new ATOM 0 HB VAL A 34 4.626 -0.438 -7.956 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.956 -1.667 -6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 34 5.318 -2.751 -7.540 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.027 -2.258 -7.574 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.498 0.677 -6.814 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.593 0.171 -8.122 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.263 1.304 -8.463 1.00 0.00 H new ATOM 558 N ASP A 35 5.207 -3.232 -10.658 1.00 0.00 N ATOM 559 CA ASP A 35 4.408 -4.419 -10.911 1.00 0.00 C ATOM 560 C ASP A 35 4.896 -5.528 -9.999 1.00 0.00 C ATOM 561 O ASP A 35 6.075 -5.885 -10.037 1.00 0.00 O ATOM 562 CB ASP A 35 4.535 -4.872 -12.373 1.00 0.00 C ATOM 563 CG ASP A 35 4.213 -3.781 -13.375 1.00 0.00 C ATOM 564 OD1 ASP A 35 3.047 -3.351 -13.442 1.00 0.00 O ATOM 565 OD2 ASP A 35 5.128 -3.373 -14.126 1.00 0.00 O ATOM 0 H ASP A 35 6.152 -3.271 -11.040 1.00 0.00 H new ATOM 0 HA ASP A 35 3.360 -4.189 -10.717 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.551 -5.227 -12.548 1.00 0.00 H new ATOM 0 HB3 ASP A 35 3.868 -5.718 -12.542 1.00 0.00 H new ATOM 570 N MET A 36 4.017 -6.089 -9.189 1.00 0.00 N ATOM 571 CA MET A 36 4.413 -7.091 -8.255 1.00 0.00 C ATOM 572 C MET A 36 3.556 -8.309 -8.490 1.00 0.00 C ATOM 573 O MET A 36 2.475 -8.227 -9.079 1.00 0.00 O ATOM 574 CB MET A 36 4.274 -6.579 -6.819 1.00 0.00 C ATOM 575 CG MET A 36 4.879 -7.488 -5.756 1.00 0.00 C ATOM 576 SD MET A 36 6.685 -7.422 -5.693 1.00 0.00 S ATOM 577 CE MET A 36 7.164 -8.316 -7.172 1.00 0.00 C ATOM 0 H MET A 36 3.024 -5.857 -9.170 1.00 0.00 H new ATOM 0 HA MET A 36 5.463 -7.348 -8.397 1.00 0.00 H new ATOM 0 HB2 MET A 36 4.746 -5.599 -6.750 1.00 0.00 H new ATOM 0 HB3 MET A 36 3.216 -6.440 -6.599 1.00 0.00 H new ATOM 0 HG2 MET A 36 4.479 -7.210 -4.781 1.00 0.00 H new ATOM 0 HG3 MET A 36 4.567 -8.515 -5.947 1.00 0.00 H new ATOM 0 HE1 MET A 36 8.117 -8.817 -7.002 1.00 0.00 H new ATOM 0 HE2 MET A 36 6.402 -9.057 -7.412 1.00 0.00 H new ATOM 0 HE3 MET A 36 7.265 -7.617 -8.003 1.00 0.00 H new ATOM 587 N ASN A 37 4.053 -9.418 -8.038 1.00 0.00 N ATOM 588 CA ASN A 37 3.447 -10.704 -8.318 1.00 0.00 C ATOM 589 C ASN A 37 3.804 -11.744 -7.263 1.00 0.00 C ATOM 590 O ASN A 37 4.928 -11.786 -6.761 1.00 0.00 O ATOM 591 CB ASN A 37 3.889 -11.218 -9.701 1.00 0.00 C ATOM 592 CG ASN A 37 5.386 -11.472 -9.790 1.00 0.00 C ATOM 593 OD1 ASN A 37 5.861 -12.560 -9.467 1.00 0.00 O ATOM 594 ND2 ASN A 37 6.133 -10.483 -10.257 1.00 0.00 N ATOM 0 H ASN A 37 4.893 -9.468 -7.462 1.00 0.00 H new ATOM 0 HA ASN A 37 2.367 -10.556 -8.304 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.355 -12.141 -9.927 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.604 -10.491 -10.461 1.00 0.00 H new ATOM 0 HD21 ASN A 37 7.140 -10.609 -10.360 1.00 0.00 H new ATOM 0 HD22 ASN A 37 5.701 -9.595 -10.514 1.00 0.00 H new ATOM 601 N ASN A 38 2.814 -12.536 -6.905 1.00 0.00 N ATOM 602 CA ASN A 38 3.020 -13.788 -6.201 1.00 0.00 C ATOM 603 C ASN A 38 2.096 -14.798 -6.865 1.00 0.00 C ATOM 604 O ASN A 38 0.909 -14.860 -6.544 1.00 0.00 O ATOM 605 CB ASN A 38 2.731 -13.641 -4.694 1.00 0.00 C ATOM 606 CG ASN A 38 3.067 -14.894 -3.889 1.00 0.00 C ATOM 607 OD1 ASN A 38 2.883 -16.019 -4.354 1.00 0.00 O ATOM 608 ND2 ASN A 38 3.569 -14.709 -2.669 1.00 0.00 N ATOM 0 H ASN A 38 1.834 -12.328 -7.096 1.00 0.00 H new ATOM 0 HA ASN A 38 4.058 -14.114 -6.263 1.00 0.00 H new ATOM 0 HB2 ASN A 38 3.304 -12.801 -4.302 1.00 0.00 H new ATOM 0 HB3 ASN A 38 1.677 -13.400 -4.555 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.813 -15.513 -2.091 1.00 0.00 H new ATOM 0 HD22 ASN A 38 3.709 -13.763 -2.313 1.00 0.00 H new ATOM 615 N PRO A 39 2.639 -15.553 -7.844 1.00 0.00 N ATOM 616 CA PRO A 39 1.863 -16.338 -8.836 1.00 0.00 C ATOM 617 C PRO A 39 1.054 -17.497 -8.252 1.00 0.00 C ATOM 618 O PRO A 39 1.089 -18.614 -8.769 1.00 0.00 O ATOM 619 CB PRO A 39 2.941 -16.882 -9.788 1.00 0.00 C ATOM 620 CG PRO A 39 4.152 -16.059 -9.524 1.00 0.00 C ATOM 621 CD PRO A 39 4.083 -15.694 -8.073 1.00 0.00 C ATOM 0 HA PRO A 39 1.109 -15.706 -9.304 1.00 0.00 H new ATOM 0 HB2 PRO A 39 3.135 -17.938 -9.600 1.00 0.00 H new ATOM 0 HB3 PRO A 39 2.626 -16.796 -10.828 1.00 0.00 H new ATOM 0 HG2 PRO A 39 5.061 -16.618 -9.745 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.165 -15.168 -10.152 1.00 0.00 H new ATOM 0 HD2 PRO A 39 4.520 -16.466 -7.440 1.00 0.00 H new ATOM 0 HD3 PRO A 39 4.619 -14.768 -7.862 1.00 0.00 H new ATOM 629 N THR A 40 0.307 -17.219 -7.202 1.00 0.00 N ATOM 630 CA THR A 40 -0.599 -18.184 -6.609 1.00 0.00 C ATOM 631 C THR A 40 -1.663 -17.472 -5.771 1.00 0.00 C ATOM 632 O THR A 40 -2.851 -17.767 -5.881 1.00 0.00 O ATOM 633 CB THR A 40 0.149 -19.211 -5.723 1.00 0.00 C ATOM 634 OG1 THR A 40 1.099 -19.950 -6.504 1.00 0.00 O ATOM 635 CG2 THR A 40 -0.823 -20.184 -5.069 1.00 0.00 C ATOM 0 H THR A 40 0.311 -16.313 -6.733 1.00 0.00 H new ATOM 0 HA THR A 40 -1.074 -18.723 -7.429 1.00 0.00 H new ATOM 0 HB THR A 40 0.670 -18.654 -4.944 1.00 0.00 H new ATOM 0 HG1 THR A 40 0.938 -19.785 -7.457 1.00 0.00 H new ATOM 0 HG21 THR A 40 -0.269 -20.893 -4.453 1.00 0.00 H new ATOM 0 HG22 THR A 40 -1.525 -19.632 -4.444 1.00 0.00 H new ATOM 0 HG23 THR A 40 -1.371 -20.725 -5.841 1.00 0.00 H new ATOM 643 N CYS A 41 -1.234 -16.517 -4.950 1.00 0.00 N ATOM 644 CA CYS A 41 -2.127 -15.891 -3.979 1.00 0.00 C ATOM 645 C CYS A 41 -1.983 -14.368 -4.001 1.00 0.00 C ATOM 646 O CYS A 41 -2.543 -13.659 -3.158 1.00 0.00 O ATOM 647 CB CYS A 41 -1.812 -16.451 -2.593 1.00 0.00 C ATOM 648 SG CYS A 41 -3.071 -16.154 -1.332 1.00 0.00 S ATOM 0 H CYS A 41 -0.278 -16.161 -4.937 1.00 0.00 H new ATOM 0 HA CYS A 41 -3.161 -16.118 -4.237 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -1.657 -17.526 -2.681 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -0.871 -16.020 -2.251 1.00 0.00 H new ATOM 0 HG CYS A 41 -3.015 -14.914 -0.947 1.00 0.00 H new ATOM 654 N GLY A 42 -1.220 -13.878 -4.965 1.00 0.00 N ATOM 655 CA GLY A 42 -1.006 -12.453 -5.117 1.00 0.00 C ATOM 656 C GLY A 42 -0.555 -12.137 -6.525 1.00 0.00 C ATOM 657 O GLY A 42 0.386 -11.375 -6.735 1.00 0.00 O ATOM 0 H GLY A 42 -0.737 -14.452 -5.656 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.927 -11.914 -4.893 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -0.256 -12.113 -4.403 1.00 0.00 H new ATOM 661 N ASP A 43 -1.255 -12.755 -7.470 1.00 0.00 N ATOM 662 CA ASP A 43 -0.905 -12.758 -8.897 1.00 0.00 C ATOM 663 C ASP A 43 -0.362 -11.424 -9.415 1.00 0.00 C ATOM 664 O ASP A 43 0.808 -11.342 -9.786 1.00 0.00 O ATOM 665 CB ASP A 43 -2.116 -13.176 -9.732 1.00 0.00 C ATOM 666 CG ASP A 43 -1.766 -13.398 -11.189 1.00 0.00 C ATOM 667 OD1 ASP A 43 -1.047 -14.379 -11.486 1.00 0.00 O ATOM 668 OD2 ASP A 43 -2.204 -12.602 -12.039 1.00 0.00 O ATOM 0 H ASP A 43 -2.104 -13.283 -7.266 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.094 -13.479 -9.001 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -2.539 -14.092 -9.320 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -2.886 -12.408 -9.659 1.00 0.00 H new ATOM 673 N ARG A 44 -1.184 -10.378 -9.459 1.00 0.00 N ATOM 674 CA ARG A 44 -0.738 -9.122 -10.047 1.00 0.00 C ATOM 675 C ARG A 44 -1.137 -7.926 -9.204 1.00 0.00 C ATOM 676 O ARG A 44 -2.235 -7.884 -8.652 1.00 0.00 O ATOM 677 CB ARG A 44 -1.327 -8.945 -11.448 1.00 0.00 C ATOM 678 CG ARG A 44 -0.807 -9.928 -12.482 1.00 0.00 C ATOM 679 CD ARG A 44 -1.564 -9.784 -13.792 1.00 0.00 C ATOM 680 NE ARG A 44 -1.111 -10.734 -14.802 1.00 0.00 N ATOM 681 CZ ARG A 44 -1.935 -11.482 -15.537 1.00 0.00 C ATOM 682 NH1 ARG A 44 -3.249 -11.378 -15.378 1.00 0.00 N ATOM 683 NH2 ARG A 44 -1.444 -12.328 -16.430 1.00 0.00 N ATOM 0 H ARG A 44 -2.140 -10.375 -9.103 1.00 0.00 H new ATOM 0 HA ARG A 44 0.350 -9.170 -10.097 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -2.411 -9.042 -11.387 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -1.116 -7.932 -11.791 1.00 0.00 H new ATOM 0 HG2 ARG A 44 0.256 -9.757 -12.650 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -0.911 -10.946 -12.107 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.629 -9.930 -13.611 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -1.441 -8.769 -14.170 1.00 0.00 H new ATOM 0 HE ARG A 44 -0.107 -10.832 -14.955 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.630 -10.725 -14.693 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.878 -11.951 -15.941 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.435 -12.408 -16.556 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -2.075 -12.900 -16.992 1.00 0.00 H new ATOM 697 N ILE A 45 -0.239 -6.961 -9.099 1.00 0.00 N ATOM 698 CA ILE A 45 -0.606 -5.646 -8.621 1.00 0.00 C ATOM 699 C ILE A 45 0.124 -4.595 -9.439 1.00 0.00 C ATOM 700 O ILE A 45 1.348 -4.462 -9.368 1.00 0.00 O ATOM 701 CB ILE A 45 -0.345 -5.442 -7.108 1.00 0.00 C ATOM 702 CG1 ILE A 45 -0.613 -3.981 -6.718 1.00 0.00 C ATOM 703 CG2 ILE A 45 1.066 -5.856 -6.734 1.00 0.00 C ATOM 704 CD1 ILE A 45 -0.457 -3.701 -5.241 1.00 0.00 C ATOM 0 H ILE A 45 0.747 -7.067 -9.339 1.00 0.00 H new ATOM 0 HA ILE A 45 -1.684 -5.544 -8.750 1.00 0.00 H new ATOM 0 HB ILE A 45 -1.031 -6.081 -6.551 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.068 -3.336 -7.274 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.625 -3.714 -7.023 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.220 -5.701 -5.666 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.211 -6.910 -6.973 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.782 -5.255 -7.294 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.663 -2.648 -5.046 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.157 -4.318 -4.678 1.00 0.00 H new ATOM 0 HD13 ILE A 45 0.562 -3.935 -4.932 1.00 0.00 H new ATOM 716 N ARG A 46 -0.631 -3.906 -10.271 1.00 0.00 N ATOM 717 CA ARG A 46 -0.087 -2.849 -11.098 1.00 0.00 C ATOM 718 C ARG A 46 -0.250 -1.533 -10.363 1.00 0.00 C ATOM 719 O ARG A 46 -1.366 -1.043 -10.219 1.00 0.00 O ATOM 720 CB ARG A 46 -0.820 -2.774 -12.444 1.00 0.00 C ATOM 721 CG ARG A 46 -1.229 -4.125 -13.021 1.00 0.00 C ATOM 722 CD ARG A 46 -0.034 -5.010 -13.346 1.00 0.00 C ATOM 723 NE ARG A 46 0.852 -4.402 -14.332 1.00 0.00 N ATOM 724 CZ ARG A 46 0.750 -4.580 -15.651 1.00 0.00 C ATOM 725 NH1 ARG A 46 -0.228 -5.323 -16.160 1.00 0.00 N ATOM 726 NH2 ARG A 46 1.623 -3.996 -16.461 1.00 0.00 N ATOM 0 H ARG A 46 -1.632 -4.062 -10.392 1.00 0.00 H new ATOM 0 HA ARG A 46 0.966 -3.054 -11.294 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.713 -2.160 -12.323 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.179 -2.265 -13.164 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -1.874 -4.640 -12.309 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -1.816 -3.967 -13.926 1.00 0.00 H new ATOM 0 HD2 ARG A 46 0.526 -5.211 -12.433 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -0.387 -5.970 -13.721 1.00 0.00 H new ATOM 0 HE ARG A 46 1.601 -3.800 -13.990 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -0.909 -5.763 -15.541 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -0.297 -5.453 -17.169 1.00 0.00 H new ATOM 0 HH21 ARG A 46 2.367 -3.415 -16.075 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.550 -4.128 -17.470 1.00 0.00 H new ATOM 740 N LEU A 47 0.841 -0.985 -9.868 1.00 0.00 N ATOM 741 CA LEU A 47 0.790 0.263 -9.132 1.00 0.00 C ATOM 742 C LEU A 47 1.691 1.285 -9.793 1.00 0.00 C ATOM 743 O LEU A 47 2.919 1.201 -9.718 1.00 0.00 O ATOM 744 CB LEU A 47 1.199 0.057 -7.673 1.00 0.00 C ATOM 745 CG LEU A 47 1.103 1.307 -6.797 1.00 0.00 C ATOM 746 CD1 LEU A 47 -0.331 1.815 -6.733 1.00 0.00 C ATOM 747 CD2 LEU A 47 1.630 1.019 -5.404 1.00 0.00 C ATOM 0 H LEU A 47 1.775 -1.384 -9.962 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.236 0.630 -9.143 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.570 -0.722 -7.241 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.225 -0.310 -7.646 1.00 0.00 H new ATOM 0 HG LEU A 47 1.718 2.087 -7.246 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.374 2.704 -6.104 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.674 2.063 -7.737 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -0.973 1.041 -6.311 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.555 1.919 -4.793 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.041 0.222 -4.950 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.673 0.709 -5.466 1.00 0.00 H new ATOM 759 N THR A 48 1.076 2.238 -10.459 1.00 0.00 N ATOM 760 CA THR A 48 1.806 3.233 -11.201 1.00 0.00 C ATOM 761 C THR A 48 1.393 4.632 -10.764 1.00 0.00 C ATOM 762 O THR A 48 0.246 5.031 -10.937 1.00 0.00 O ATOM 763 CB THR A 48 1.556 3.027 -12.697 1.00 0.00 C ATOM 764 OG1 THR A 48 0.193 2.621 -12.890 1.00 0.00 O ATOM 765 CG2 THR A 48 2.490 1.967 -13.264 1.00 0.00 C ATOM 0 H THR A 48 0.062 2.342 -10.499 1.00 0.00 H new ATOM 0 HA THR A 48 2.873 3.127 -11.003 1.00 0.00 H new ATOM 0 HB THR A 48 1.748 3.964 -13.219 1.00 0.00 H new ATOM 0 HG1 THR A 48 0.135 1.643 -12.856 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.292 1.839 -14.328 1.00 0.00 H new ATOM 0 HG22 THR A 48 3.524 2.280 -13.122 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.323 1.021 -12.748 1.00 0.00 H new ATOM 773 N MET A 49 2.326 5.369 -10.187 1.00 0.00 N ATOM 774 CA MET A 49 2.001 6.642 -9.562 1.00 0.00 C ATOM 775 C MET A 49 2.652 7.803 -10.297 1.00 0.00 C ATOM 776 O MET A 49 3.750 7.673 -10.841 1.00 0.00 O ATOM 777 CB MET A 49 2.415 6.633 -8.085 1.00 0.00 C ATOM 778 CG MET A 49 1.536 5.741 -7.221 1.00 0.00 C ATOM 779 SD MET A 49 2.062 5.677 -5.497 1.00 0.00 S ATOM 780 CE MET A 49 3.513 4.637 -5.610 1.00 0.00 C ATOM 0 H MET A 49 3.311 5.110 -10.137 1.00 0.00 H new ATOM 0 HA MET A 49 0.921 6.779 -9.620 1.00 0.00 H new ATOM 0 HB2 MET A 49 3.449 6.298 -8.006 1.00 0.00 H new ATOM 0 HB3 MET A 49 2.379 7.651 -7.698 1.00 0.00 H new ATOM 0 HG2 MET A 49 0.508 6.101 -7.267 1.00 0.00 H new ATOM 0 HG3 MET A 49 1.539 4.732 -7.632 1.00 0.00 H new ATOM 0 HE1 MET A 49 3.475 3.873 -4.833 1.00 0.00 H new ATOM 0 HE2 MET A 49 3.542 4.158 -6.589 1.00 0.00 H new ATOM 0 HE3 MET A 49 4.408 5.245 -5.477 1.00 0.00 H new ATOM 790 N LYS A 50 1.966 8.937 -10.297 1.00 0.00 N ATOM 791 CA LYS A 50 2.413 10.110 -11.019 1.00 0.00 C ATOM 792 C LYS A 50 2.937 11.158 -10.051 1.00 0.00 C ATOM 793 O LYS A 50 2.190 12.017 -9.589 1.00 0.00 O ATOM 794 CB LYS A 50 1.261 10.698 -11.844 1.00 0.00 C ATOM 795 CG LYS A 50 1.524 10.780 -13.341 1.00 0.00 C ATOM 796 CD LYS A 50 2.724 11.655 -13.664 1.00 0.00 C ATOM 797 CE LYS A 50 2.832 11.902 -15.160 1.00 0.00 C ATOM 798 NZ LYS A 50 4.125 12.531 -15.533 1.00 0.00 N ATOM 0 H LYS A 50 1.087 9.065 -9.797 1.00 0.00 H new ATOM 0 HA LYS A 50 3.218 9.814 -11.692 1.00 0.00 H new ATOM 0 HB2 LYS A 50 0.369 10.094 -11.679 1.00 0.00 H new ATOM 0 HB3 LYS A 50 1.041 11.699 -11.473 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.691 9.777 -13.735 1.00 0.00 H new ATOM 0 HG3 LYS A 50 0.641 11.177 -13.842 1.00 0.00 H new ATOM 0 HD2 LYS A 50 2.636 12.607 -13.140 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.635 11.176 -13.304 1.00 0.00 H new ATOM 0 HE2 LYS A 50 2.723 10.957 -15.691 1.00 0.00 H new ATOM 0 HE3 LYS A 50 2.012 12.544 -15.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.055 12.925 -16.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.347 13.293 -14.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.879 11.816 -15.507 1.00 0.00 H new ATOM 812 N LEU A 51 4.203 11.049 -9.702 1.00 0.00 N ATOM 813 CA LEU A 51 4.860 12.089 -8.944 1.00 0.00 C ATOM 814 C LEU A 51 5.502 13.075 -9.895 1.00 0.00 C ATOM 815 O LEU A 51 6.690 12.991 -10.202 1.00 0.00 O ATOM 816 CB LEU A 51 5.888 11.540 -7.936 1.00 0.00 C ATOM 817 CG LEU A 51 6.528 10.180 -8.244 1.00 0.00 C ATOM 818 CD1 LEU A 51 7.375 10.219 -9.506 1.00 0.00 C ATOM 819 CD2 LEU A 51 7.374 9.738 -7.061 1.00 0.00 C ATOM 0 H LEU A 51 4.795 10.251 -9.932 1.00 0.00 H new ATOM 0 HA LEU A 51 4.100 12.595 -8.349 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.688 12.274 -7.839 1.00 0.00 H new ATOM 0 HB3 LEU A 51 5.401 11.469 -6.964 1.00 0.00 H new ATOM 0 HG LEU A 51 5.725 9.464 -8.416 1.00 0.00 H new ATOM 0 HD11 LEU A 51 7.808 9.235 -9.684 1.00 0.00 H new ATOM 0 HD12 LEU A 51 6.751 10.500 -10.354 1.00 0.00 H new ATOM 0 HD13 LEU A 51 8.174 10.950 -9.385 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.829 8.772 -7.280 1.00 0.00 H new ATOM 0 HD22 LEU A 51 8.157 10.474 -6.878 1.00 0.00 H new ATOM 0 HD23 LEU A 51 6.744 9.650 -6.176 1.00 0.00 H new ATOM 831 N ASP A 52 4.705 14.007 -10.377 1.00 0.00 N ATOM 832 CA ASP A 52 5.185 14.956 -11.367 1.00 0.00 C ATOM 833 C ASP A 52 5.817 16.121 -10.634 1.00 0.00 C ATOM 834 O ASP A 52 5.352 17.259 -10.694 1.00 0.00 O ATOM 835 CB ASP A 52 4.029 15.425 -12.251 1.00 0.00 C ATOM 836 CG ASP A 52 4.487 15.861 -13.626 1.00 0.00 C ATOM 837 OD1 ASP A 52 4.663 14.981 -14.498 1.00 0.00 O ATOM 838 OD2 ASP A 52 4.652 17.079 -13.854 1.00 0.00 O ATOM 0 H ASP A 52 3.730 14.129 -10.104 1.00 0.00 H new ATOM 0 HA ASP A 52 5.925 14.488 -12.016 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.304 14.618 -12.353 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.517 16.254 -11.763 1.00 0.00 H new ATOM 843 N GLY A 53 6.877 15.796 -9.918 1.00 0.00 N ATOM 844 CA GLY A 53 7.528 16.741 -9.054 1.00 0.00 C ATOM 845 C GLY A 53 8.055 16.048 -7.819 1.00 0.00 C ATOM 846 O GLY A 53 9.107 15.407 -7.849 1.00 0.00 O ATOM 0 H GLY A 53 7.304 14.870 -9.924 1.00 0.00 H new ATOM 0 HA2 GLY A 53 8.348 17.225 -9.585 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.827 17.525 -8.768 1.00 0.00 H new ATOM 850 N ASP A 54 7.302 16.173 -6.737 1.00 0.00 N ATOM 851 CA ASP A 54 7.650 15.558 -5.463 1.00 0.00 C ATOM 852 C ASP A 54 6.387 15.228 -4.668 1.00 0.00 C ATOM 853 O ASP A 54 6.394 15.236 -3.437 1.00 0.00 O ATOM 854 CB ASP A 54 8.562 16.496 -4.659 1.00 0.00 C ATOM 855 CG ASP A 54 8.020 17.911 -4.558 1.00 0.00 C ATOM 856 OD1 ASP A 54 8.161 18.679 -5.537 1.00 0.00 O ATOM 857 OD2 ASP A 54 7.464 18.273 -3.503 1.00 0.00 O ATOM 0 H ASP A 54 6.431 16.704 -6.716 1.00 0.00 H new ATOM 0 HA ASP A 54 8.186 14.629 -5.655 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.695 16.092 -3.656 1.00 0.00 H new ATOM 0 HB3 ASP A 54 9.547 16.523 -5.125 1.00 0.00 H new ATOM 862 N ILE A 55 5.320 14.871 -5.383 1.00 0.00 N ATOM 863 CA ILE A 55 4.026 14.647 -4.786 1.00 0.00 C ATOM 864 C ILE A 55 3.429 13.398 -5.401 1.00 0.00 C ATOM 865 O ILE A 55 3.704 13.077 -6.552 1.00 0.00 O ATOM 866 CB ILE A 55 3.052 15.842 -5.020 1.00 0.00 C ATOM 867 CG1 ILE A 55 2.479 15.855 -6.458 1.00 0.00 C ATOM 868 CG2 ILE A 55 3.731 17.170 -4.709 1.00 0.00 C ATOM 869 CD1 ILE A 55 3.510 15.898 -7.579 1.00 0.00 C ATOM 0 H ILE A 55 5.340 14.732 -6.393 1.00 0.00 H new ATOM 0 HA ILE A 55 4.161 14.539 -3.710 1.00 0.00 H new ATOM 0 HB ILE A 55 2.216 15.706 -4.334 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.861 14.967 -6.591 1.00 0.00 H new ATOM 0 HG13 ILE A 55 1.822 16.719 -6.560 1.00 0.00 H new ATOM 0 HG21 ILE A 55 3.029 17.986 -4.881 1.00 0.00 H new ATOM 0 HG22 ILE A 55 4.051 17.180 -3.667 1.00 0.00 H new ATOM 0 HG23 ILE A 55 4.599 17.295 -5.356 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.000 15.904 -8.542 1.00 0.00 H new ATOM 0 HD12 ILE A 55 4.115 16.800 -7.483 1.00 0.00 H new ATOM 0 HD13 ILE A 55 4.154 15.021 -7.515 1.00 0.00 H new ATOM 881 N VAL A 56 2.648 12.680 -4.648 1.00 0.00 N ATOM 882 CA VAL A 56 1.894 11.577 -5.213 1.00 0.00 C ATOM 883 C VAL A 56 0.597 12.122 -5.786 1.00 0.00 C ATOM 884 O VAL A 56 -0.411 12.230 -5.092 1.00 0.00 O ATOM 885 CB VAL A 56 1.598 10.464 -4.188 1.00 0.00 C ATOM 886 CG1 VAL A 56 0.884 9.299 -4.862 1.00 0.00 C ATOM 887 CG2 VAL A 56 2.884 9.989 -3.527 1.00 0.00 C ATOM 0 H VAL A 56 2.511 12.829 -3.648 1.00 0.00 H new ATOM 0 HA VAL A 56 2.501 11.119 -5.994 1.00 0.00 H new ATOM 0 HB VAL A 56 0.946 10.871 -3.416 1.00 0.00 H new ATOM 0 HG11 VAL A 56 0.682 8.521 -4.126 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.056 9.647 -5.290 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.515 8.894 -5.653 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.654 9.204 -2.807 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.561 9.598 -4.287 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.359 10.825 -3.013 1.00 0.00 H new ATOM 897 N GLU A 57 0.644 12.515 -7.048 1.00 0.00 N ATOM 898 CA GLU A 57 -0.490 13.173 -7.673 1.00 0.00 C ATOM 899 C GLU A 57 -1.518 12.146 -8.116 1.00 0.00 C ATOM 900 O GLU A 57 -2.630 12.093 -7.585 1.00 0.00 O ATOM 901 CB GLU A 57 -0.028 14.013 -8.865 1.00 0.00 C ATOM 902 CG GLU A 57 -1.151 14.775 -9.544 1.00 0.00 C ATOM 903 CD GLU A 57 -0.680 15.532 -10.766 1.00 0.00 C ATOM 904 OE1 GLU A 57 -0.615 14.924 -11.853 1.00 0.00 O ATOM 905 OE2 GLU A 57 -0.378 16.738 -10.645 1.00 0.00 O ATOM 0 H GLU A 57 1.452 12.390 -7.658 1.00 0.00 H new ATOM 0 HA GLU A 57 -0.954 13.835 -6.942 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.728 14.722 -8.528 1.00 0.00 H new ATOM 0 HB3 GLU A 57 0.450 13.360 -9.595 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.937 14.077 -9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -1.592 15.475 -8.834 1.00 0.00 H new ATOM 912 N ASP A 58 -1.140 11.312 -9.065 1.00 0.00 N ATOM 913 CA ASP A 58 -2.066 10.334 -9.605 1.00 0.00 C ATOM 914 C ASP A 58 -1.535 8.934 -9.357 1.00 0.00 C ATOM 915 O ASP A 58 -0.362 8.761 -9.030 1.00 0.00 O ATOM 916 CB ASP A 58 -2.296 10.577 -11.102 1.00 0.00 C ATOM 917 CG ASP A 58 -3.372 9.679 -11.682 1.00 0.00 C ATOM 918 OD1 ASP A 58 -4.334 9.347 -10.959 1.00 0.00 O ATOM 919 OD2 ASP A 58 -3.271 9.309 -12.867 1.00 0.00 O ATOM 0 H ASP A 58 -0.207 11.291 -9.476 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.027 10.437 -9.100 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -2.575 11.619 -11.258 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.362 10.413 -11.640 1.00 0.00 H new ATOM 924 N ALA A 59 -2.397 7.945 -9.488 1.00 0.00 N ATOM 925 CA ALA A 59 -2.014 6.566 -9.265 1.00 0.00 C ATOM 926 C ALA A 59 -2.951 5.631 -10.005 1.00 0.00 C ATOM 927 O ALA A 59 -4.174 5.764 -9.923 1.00 0.00 O ATOM 928 CB ALA A 59 -2.003 6.250 -7.778 1.00 0.00 C ATOM 0 H ALA A 59 -3.374 8.073 -9.750 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.006 6.419 -9.652 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.713 5.210 -7.629 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.290 6.901 -7.273 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -2.998 6.412 -7.364 1.00 0.00 H new ATOM 934 N LYS A 60 -2.372 4.697 -10.736 1.00 0.00 N ATOM 935 CA LYS A 60 -3.137 3.724 -11.479 1.00 0.00 C ATOM 936 C LYS A 60 -2.879 2.358 -10.887 1.00 0.00 C ATOM 937 O LYS A 60 -1.728 1.989 -10.643 1.00 0.00 O ATOM 938 CB LYS A 60 -2.768 3.763 -12.966 1.00 0.00 C ATOM 939 CG LYS A 60 -3.758 4.539 -13.825 1.00 0.00 C ATOM 940 CD LYS A 60 -4.030 5.927 -13.272 1.00 0.00 C ATOM 941 CE LYS A 60 -5.057 6.668 -14.110 1.00 0.00 C ATOM 942 NZ LYS A 60 -5.469 7.946 -13.475 1.00 0.00 N ATOM 0 H LYS A 60 -1.361 4.595 -10.829 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.200 3.955 -11.407 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.780 4.210 -13.074 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.699 2.742 -13.341 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -3.368 4.624 -14.839 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -4.694 3.985 -13.888 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -4.386 5.847 -12.245 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -3.101 6.497 -13.244 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -4.643 6.870 -15.098 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -5.933 6.035 -14.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -6.287 8.339 -13.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -5.729 7.773 -12.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -4.680 8.623 -13.513 1.00 0.00 H new ATOM 956 N PHE A 61 -3.943 1.625 -10.641 1.00 0.00 N ATOM 957 CA PHE A 61 -3.854 0.406 -9.870 1.00 0.00 C ATOM 958 C PHE A 61 -4.748 -0.675 -10.447 1.00 0.00 C ATOM 959 O PHE A 61 -5.885 -0.415 -10.834 1.00 0.00 O ATOM 960 CB PHE A 61 -4.210 0.682 -8.400 1.00 0.00 C ATOM 961 CG PHE A 61 -5.466 1.493 -8.204 1.00 0.00 C ATOM 962 CD1 PHE A 61 -5.425 2.879 -8.242 1.00 0.00 C ATOM 963 CD2 PHE A 61 -6.682 0.873 -7.976 1.00 0.00 C ATOM 964 CE1 PHE A 61 -6.573 3.626 -8.058 1.00 0.00 C ATOM 965 CE2 PHE A 61 -7.833 1.616 -7.791 1.00 0.00 C ATOM 966 CZ PHE A 61 -7.778 2.994 -7.833 1.00 0.00 C ATOM 0 H PHE A 61 -4.883 1.854 -10.965 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.827 0.045 -9.919 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.322 -0.270 -7.881 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -3.377 1.205 -7.929 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.485 3.380 -8.417 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.732 -0.205 -7.942 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.527 4.705 -8.090 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -8.775 1.118 -7.614 1.00 0.00 H new ATOM 0 HZ PHE A 61 -8.676 3.576 -7.690 1.00 0.00 H new ATOM 976 N GLU A 62 -4.208 -1.876 -10.528 1.00 0.00 N ATOM 977 CA GLU A 62 -4.959 -3.039 -10.965 1.00 0.00 C ATOM 978 C GLU A 62 -4.411 -4.270 -10.260 1.00 0.00 C ATOM 979 O GLU A 62 -3.231 -4.593 -10.393 1.00 0.00 O ATOM 980 CB GLU A 62 -4.857 -3.210 -12.480 1.00 0.00 C ATOM 981 CG GLU A 62 -5.740 -4.317 -13.025 1.00 0.00 C ATOM 982 CD GLU A 62 -5.466 -4.606 -14.483 1.00 0.00 C ATOM 983 OE1 GLU A 62 -5.824 -3.772 -15.340 1.00 0.00 O ATOM 984 OE2 GLU A 62 -4.881 -5.668 -14.778 1.00 0.00 O ATOM 0 H GLU A 62 -3.235 -2.074 -10.293 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.011 -2.905 -10.712 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.126 -2.270 -12.963 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.821 -3.419 -12.745 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.583 -5.224 -12.442 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.786 -4.037 -12.903 1.00 0.00 H new ATOM 991 N GLY A 63 -5.254 -4.943 -9.503 1.00 0.00 N ATOM 992 CA GLY A 63 -4.796 -6.077 -8.734 1.00 0.00 C ATOM 993 C GLY A 63 -5.557 -7.335 -9.066 1.00 0.00 C ATOM 994 O GLY A 63 -6.786 -7.318 -9.152 1.00 0.00 O ATOM 0 H GLY A 63 -6.246 -4.727 -9.406 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.734 -6.236 -8.922 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -4.902 -5.860 -7.671 1.00 0.00 H new ATOM 998 N GLU A 64 -4.835 -8.427 -9.252 1.00 0.00 N ATOM 999 CA GLU A 64 -5.463 -9.696 -9.527 1.00 0.00 C ATOM 1000 C GLU A 64 -4.985 -10.697 -8.492 1.00 0.00 C ATOM 1001 O GLU A 64 -3.785 -10.937 -8.351 1.00 0.00 O ATOM 1002 CB GLU A 64 -5.148 -10.155 -10.950 1.00 0.00 C ATOM 1003 CG GLU A 64 -6.177 -11.121 -11.512 1.00 0.00 C ATOM 1004 CD GLU A 64 -6.174 -11.169 -13.024 1.00 0.00 C ATOM 1005 OE1 GLU A 64 -6.132 -10.092 -13.658 1.00 0.00 O ATOM 1006 OE2 GLU A 64 -6.256 -12.280 -13.584 1.00 0.00 O ATOM 0 H GLU A 64 -3.816 -8.455 -9.217 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.547 -9.605 -9.461 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -5.086 -9.282 -11.600 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -4.168 -10.632 -10.962 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -5.982 -12.120 -11.121 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.169 -10.831 -11.165 1.00 0.00 H new ATOM 1013 N GLY A 65 -5.924 -11.247 -7.747 1.00 0.00 N ATOM 1014 CA GLY A 65 -5.576 -12.049 -6.602 1.00 0.00 C ATOM 1015 C GLY A 65 -6.743 -12.217 -5.661 1.00 0.00 C ATOM 1016 O GLY A 65 -7.843 -12.578 -6.080 1.00 0.00 O ATOM 0 H GLY A 65 -6.925 -11.151 -7.916 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.233 -13.029 -6.935 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.745 -11.584 -6.071 1.00 0.00 H new ATOM 1020 N CYS A 66 -6.506 -11.953 -4.389 1.00 0.00 N ATOM 1021 CA CYS A 66 -7.506 -12.180 -3.371 1.00 0.00 C ATOM 1022 C CYS A 66 -8.355 -10.937 -3.166 1.00 0.00 C ATOM 1023 O CYS A 66 -8.001 -9.844 -3.619 1.00 0.00 O ATOM 1024 CB CYS A 66 -6.828 -12.567 -2.063 1.00 0.00 C ATOM 1025 SG CYS A 66 -5.728 -13.997 -2.197 1.00 0.00 S ATOM 0 H CYS A 66 -5.624 -11.579 -4.039 1.00 0.00 H new ATOM 0 HA CYS A 66 -8.157 -12.992 -3.696 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -6.256 -11.715 -1.697 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -7.594 -12.780 -1.318 1.00 0.00 H new ATOM 0 HG CYS A 66 -4.661 -13.792 -1.483 1.00 0.00 H new ATOM 1031 N SER A 67 -9.463 -11.108 -2.465 1.00 0.00 N ATOM 1032 CA SER A 67 -10.383 -10.023 -2.195 1.00 0.00 C ATOM 1033 C SER A 67 -9.685 -8.907 -1.425 1.00 0.00 C ATOM 1034 O SER A 67 -9.870 -7.730 -1.716 1.00 0.00 O ATOM 1035 CB SER A 67 -11.569 -10.554 -1.390 1.00 0.00 C ATOM 1036 OG SER A 67 -11.994 -11.810 -1.892 1.00 0.00 O ATOM 0 H SER A 67 -9.748 -12.004 -2.068 1.00 0.00 H new ATOM 0 HA SER A 67 -10.738 -9.614 -3.141 1.00 0.00 H new ATOM 0 HB2 SER A 67 -11.288 -10.652 -0.341 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.393 -9.842 -1.434 1.00 0.00 H new ATOM 0 HG SER A 67 -12.753 -12.134 -1.363 1.00 0.00 H new ATOM 1042 N ILE A 68 -8.856 -9.291 -0.460 1.00 0.00 N ATOM 1043 CA ILE A 68 -8.198 -8.321 0.403 1.00 0.00 C ATOM 1044 C ILE A 68 -7.056 -7.605 -0.312 1.00 0.00 C ATOM 1045 O ILE A 68 -6.843 -6.417 -0.104 1.00 0.00 O ATOM 1046 CB ILE A 68 -7.693 -8.965 1.724 1.00 0.00 C ATOM 1047 CG1 ILE A 68 -6.865 -10.236 1.471 1.00 0.00 C ATOM 1048 CG2 ILE A 68 -8.870 -9.280 2.630 1.00 0.00 C ATOM 1049 CD1 ILE A 68 -5.401 -9.985 1.178 1.00 0.00 C ATOM 0 H ILE A 68 -8.625 -10.264 -0.258 1.00 0.00 H new ATOM 0 HA ILE A 68 -8.953 -7.578 0.660 1.00 0.00 H new ATOM 0 HB ILE A 68 -7.038 -8.243 2.211 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -6.942 -10.884 2.344 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -7.302 -10.778 0.633 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -8.508 -9.731 3.554 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -9.407 -8.360 2.862 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -9.541 -9.975 2.126 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -4.895 -10.936 1.013 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -5.310 -9.365 0.286 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.943 -9.473 2.024 1.00 0.00 H new ATOM 1061 N SER A 69 -6.351 -8.313 -1.183 1.00 0.00 N ATOM 1062 CA SER A 69 -5.180 -7.750 -1.833 1.00 0.00 C ATOM 1063 C SER A 69 -5.580 -6.702 -2.862 1.00 0.00 C ATOM 1064 O SER A 69 -4.928 -5.668 -2.994 1.00 0.00 O ATOM 1065 CB SER A 69 -4.351 -8.865 -2.472 1.00 0.00 C ATOM 1066 OG SER A 69 -5.174 -9.762 -3.194 1.00 0.00 O ATOM 0 H SER A 69 -6.569 -9.272 -1.454 1.00 0.00 H new ATOM 0 HA SER A 69 -4.567 -7.252 -1.081 1.00 0.00 H new ATOM 0 HB2 SER A 69 -3.607 -8.432 -3.140 1.00 0.00 H new ATOM 0 HB3 SER A 69 -3.808 -9.408 -1.698 1.00 0.00 H new ATOM 0 HG SER A 69 -6.081 -9.396 -3.256 1.00 0.00 H new ATOM 1072 N MET A 70 -6.665 -6.964 -3.579 1.00 0.00 N ATOM 1073 CA MET A 70 -7.170 -6.007 -4.559 1.00 0.00 C ATOM 1074 C MET A 70 -7.917 -4.869 -3.868 1.00 0.00 C ATOM 1075 O MET A 70 -8.143 -3.816 -4.459 1.00 0.00 O ATOM 1076 CB MET A 70 -8.090 -6.688 -5.579 1.00 0.00 C ATOM 1077 CG MET A 70 -9.396 -7.197 -4.992 1.00 0.00 C ATOM 1078 SD MET A 70 -10.510 -7.862 -6.243 1.00 0.00 S ATOM 1079 CE MET A 70 -11.881 -8.390 -5.221 1.00 0.00 C ATOM 0 H MET A 70 -7.210 -7.823 -3.503 1.00 0.00 H new ATOM 0 HA MET A 70 -6.310 -5.597 -5.089 1.00 0.00 H new ATOM 0 HB2 MET A 70 -8.314 -5.982 -6.379 1.00 0.00 H new ATOM 0 HB3 MET A 70 -7.557 -7.524 -6.032 1.00 0.00 H new ATOM 0 HG2 MET A 70 -9.181 -7.971 -4.255 1.00 0.00 H new ATOM 0 HG3 MET A 70 -9.894 -6.383 -4.464 1.00 0.00 H new ATOM 0 HE1 MET A 70 -12.819 -8.091 -5.688 1.00 0.00 H new ATOM 0 HE2 MET A 70 -11.858 -9.474 -5.114 1.00 0.00 H new ATOM 0 HE3 MET A 70 -11.801 -7.927 -4.238 1.00 0.00 H new ATOM 1089 N ALA A 71 -8.309 -5.092 -2.619 1.00 0.00 N ATOM 1090 CA ALA A 71 -9.019 -4.081 -1.853 1.00 0.00 C ATOM 1091 C ALA A 71 -8.049 -3.130 -1.165 1.00 0.00 C ATOM 1092 O ALA A 71 -8.120 -1.914 -1.353 1.00 0.00 O ATOM 1093 CB ALA A 71 -9.934 -4.728 -0.827 1.00 0.00 C ATOM 0 H ALA A 71 -8.146 -5.965 -2.117 1.00 0.00 H new ATOM 0 HA ALA A 71 -9.627 -3.504 -2.550 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -10.456 -3.953 -0.265 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.662 -5.360 -1.336 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.342 -5.336 -0.143 1.00 0.00 H new ATOM 1099 N SER A 72 -7.137 -3.696 -0.378 1.00 0.00 N ATOM 1100 CA SER A 72 -6.207 -2.907 0.414 1.00 0.00 C ATOM 1101 C SER A 72 -5.344 -2.029 -0.478 1.00 0.00 C ATOM 1102 O SER A 72 -5.247 -0.831 -0.252 1.00 0.00 O ATOM 1103 CB SER A 72 -5.330 -3.820 1.273 1.00 0.00 C ATOM 1104 OG SER A 72 -6.121 -4.585 2.168 1.00 0.00 O ATOM 0 H SER A 72 -7.025 -4.704 -0.274 1.00 0.00 H new ATOM 0 HA SER A 72 -6.786 -2.259 1.072 1.00 0.00 H new ATOM 0 HB2 SER A 72 -4.753 -4.486 0.631 1.00 0.00 H new ATOM 0 HB3 SER A 72 -4.615 -3.220 1.835 1.00 0.00 H new ATOM 0 HG SER A 72 -6.521 -5.340 1.688 1.00 0.00 H new ATOM 1110 N ALA A 73 -4.752 -2.627 -1.507 1.00 0.00 N ATOM 1111 CA ALA A 73 -3.883 -1.905 -2.431 1.00 0.00 C ATOM 1112 C ALA A 73 -4.530 -0.618 -2.935 1.00 0.00 C ATOM 1113 O ALA A 73 -3.881 0.423 -2.995 1.00 0.00 O ATOM 1114 CB ALA A 73 -3.514 -2.792 -3.604 1.00 0.00 C ATOM 0 H ALA A 73 -4.859 -3.618 -1.723 1.00 0.00 H new ATOM 0 HA ALA A 73 -2.981 -1.630 -1.884 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -2.866 -2.242 -4.286 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.991 -3.677 -3.241 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -4.419 -3.096 -4.130 1.00 0.00 H new ATOM 1120 N SER A 74 -5.811 -0.683 -3.281 1.00 0.00 N ATOM 1121 CA SER A 74 -6.516 0.477 -3.804 1.00 0.00 C ATOM 1122 C SER A 74 -6.771 1.519 -2.713 1.00 0.00 C ATOM 1123 O SER A 74 -6.809 2.718 -2.989 1.00 0.00 O ATOM 1124 CB SER A 74 -7.829 0.034 -4.432 1.00 0.00 C ATOM 1125 OG SER A 74 -7.606 -0.996 -5.376 1.00 0.00 O ATOM 0 H SER A 74 -6.380 -1.526 -3.208 1.00 0.00 H new ATOM 0 HA SER A 74 -5.889 0.946 -4.563 1.00 0.00 H new ATOM 0 HB2 SER A 74 -8.509 -0.317 -3.656 1.00 0.00 H new ATOM 0 HB3 SER A 74 -8.311 0.882 -4.918 1.00 0.00 H new ATOM 0 HG SER A 74 -7.796 -1.864 -4.963 1.00 0.00 H new ATOM 1131 N MET A 75 -6.929 1.065 -1.476 1.00 0.00 N ATOM 1132 CA MET A 75 -7.152 1.973 -0.355 1.00 0.00 C ATOM 1133 C MET A 75 -5.834 2.611 0.041 1.00 0.00 C ATOM 1134 O MET A 75 -5.760 3.813 0.306 1.00 0.00 O ATOM 1135 CB MET A 75 -7.763 1.236 0.841 1.00 0.00 C ATOM 1136 CG MET A 75 -9.106 0.587 0.541 1.00 0.00 C ATOM 1137 SD MET A 75 -10.347 1.763 -0.040 1.00 0.00 S ATOM 1138 CE MET A 75 -10.503 2.826 1.395 1.00 0.00 C ATOM 0 H MET A 75 -6.907 0.077 -1.223 1.00 0.00 H new ATOM 0 HA MET A 75 -7.856 2.745 -0.665 1.00 0.00 H new ATOM 0 HB2 MET A 75 -7.066 0.468 1.178 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.886 1.939 1.665 1.00 0.00 H new ATOM 0 HG2 MET A 75 -8.968 -0.188 -0.213 1.00 0.00 H new ATOM 0 HG3 MET A 75 -9.474 0.095 1.441 1.00 0.00 H new ATOM 0 HE1 MET A 75 -11.396 3.443 1.295 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.583 2.215 2.294 1.00 0.00 H new ATOM 0 HE3 MET A 75 -9.625 3.468 1.470 1.00 0.00 H new ATOM 1148 N MET A 76 -4.798 1.784 0.046 1.00 0.00 N ATOM 1149 CA MET A 76 -3.432 2.229 0.265 1.00 0.00 C ATOM 1150 C MET A 76 -3.057 3.266 -0.787 1.00 0.00 C ATOM 1151 O MET A 76 -2.366 4.240 -0.502 1.00 0.00 O ATOM 1152 CB MET A 76 -2.480 1.029 0.190 1.00 0.00 C ATOM 1153 CG MET A 76 -2.743 -0.032 1.251 1.00 0.00 C ATOM 1154 SD MET A 76 -2.035 -1.643 0.835 1.00 0.00 S ATOM 1155 CE MET A 76 -0.288 -1.266 0.830 1.00 0.00 C ATOM 0 H MET A 76 -4.884 0.779 -0.103 1.00 0.00 H new ATOM 0 HA MET A 76 -3.351 2.682 1.253 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.564 0.572 -0.796 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.454 1.384 0.291 1.00 0.00 H new ATOM 0 HG2 MET A 76 -2.331 0.304 2.202 1.00 0.00 H new ATOM 0 HG3 MET A 76 -3.819 -0.140 1.390 1.00 0.00 H new ATOM 0 HE1 MET A 76 0.282 -2.183 0.980 1.00 0.00 H new ATOM 0 HE2 MET A 76 -0.015 -0.821 -0.127 1.00 0.00 H new ATOM 0 HE3 MET A 76 -0.065 -0.564 1.634 1.00 0.00 H new ATOM 1165 N THR A 77 -3.546 3.054 -2.006 1.00 0.00 N ATOM 1166 CA THR A 77 -3.348 3.995 -3.100 1.00 0.00 C ATOM 1167 C THR A 77 -4.048 5.329 -2.817 1.00 0.00 C ATOM 1168 O THR A 77 -3.558 6.393 -3.185 1.00 0.00 O ATOM 1169 CB THR A 77 -3.877 3.405 -4.425 1.00 0.00 C ATOM 1170 OG1 THR A 77 -3.156 2.211 -4.757 1.00 0.00 O ATOM 1171 CG2 THR A 77 -3.754 4.404 -5.563 1.00 0.00 C ATOM 0 H THR A 77 -4.088 2.228 -2.261 1.00 0.00 H new ATOM 0 HA THR A 77 -2.277 4.176 -3.189 1.00 0.00 H new ATOM 0 HB THR A 77 -4.932 3.169 -4.286 1.00 0.00 H new ATOM 0 HG1 THR A 77 -3.493 1.465 -4.218 1.00 0.00 H new ATOM 0 HG21 THR A 77 -4.135 3.958 -6.482 1.00 0.00 H new ATOM 0 HG22 THR A 77 -4.332 5.298 -5.327 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.707 4.674 -5.698 1.00 0.00 H new ATOM 1179 N GLN A 78 -5.176 5.268 -2.127 1.00 0.00 N ATOM 1180 CA GLN A 78 -5.948 6.462 -1.821 1.00 0.00 C ATOM 1181 C GLN A 78 -5.276 7.208 -0.686 1.00 0.00 C ATOM 1182 O GLN A 78 -5.178 8.434 -0.697 1.00 0.00 O ATOM 1183 CB GLN A 78 -7.385 6.099 -1.442 1.00 0.00 C ATOM 1184 CG GLN A 78 -8.222 7.296 -1.014 1.00 0.00 C ATOM 1185 CD GLN A 78 -8.369 8.341 -2.106 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -8.393 8.021 -3.295 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -8.450 9.603 -1.708 1.00 0.00 N ATOM 0 H GLN A 78 -5.578 4.402 -1.768 1.00 0.00 H new ATOM 0 HA GLN A 78 -5.987 7.098 -2.705 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -7.865 5.616 -2.293 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -7.365 5.371 -0.631 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.211 6.951 -0.714 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.765 7.756 -0.138 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -8.427 9.826 -0.713 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -8.536 10.350 -2.397 1.00 0.00 H new ATOM 1196 N ALA A 79 -4.801 6.449 0.286 1.00 0.00 N ATOM 1197 CA ALA A 79 -4.035 7.004 1.379 1.00 0.00 C ATOM 1198 C ALA A 79 -2.741 7.606 0.852 1.00 0.00 C ATOM 1199 O ALA A 79 -2.295 8.655 1.310 1.00 0.00 O ATOM 1200 CB ALA A 79 -3.737 5.925 2.407 1.00 0.00 C ATOM 0 H ALA A 79 -4.936 5.439 0.337 1.00 0.00 H new ATOM 0 HA ALA A 79 -4.617 7.791 1.859 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.160 6.353 3.227 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -4.673 5.523 2.794 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -3.164 5.125 1.939 1.00 0.00 H new ATOM 1206 N ILE A 80 -2.161 6.943 -0.140 1.00 0.00 N ATOM 1207 CA ILE A 80 -0.887 7.370 -0.704 1.00 0.00 C ATOM 1208 C ILE A 80 -1.070 8.575 -1.635 1.00 0.00 C ATOM 1209 O ILE A 80 -0.172 9.403 -1.771 1.00 0.00 O ATOM 1210 CB ILE A 80 -0.189 6.191 -1.437 1.00 0.00 C ATOM 1211 CG1 ILE A 80 1.223 5.968 -0.884 1.00 0.00 C ATOM 1212 CG2 ILE A 80 -0.146 6.395 -2.944 1.00 0.00 C ATOM 1213 CD1 ILE A 80 2.147 7.160 -1.035 1.00 0.00 C ATOM 0 H ILE A 80 -2.553 6.106 -0.571 1.00 0.00 H new ATOM 0 HA ILE A 80 -0.242 7.685 0.116 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.786 5.299 -1.248 1.00 0.00 H new ATOM 0 HG12 ILE A 80 1.150 5.711 0.173 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.668 5.112 -1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.351 5.545 -3.412 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.162 6.478 -3.329 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.404 7.308 -3.172 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.125 6.918 -0.618 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.254 7.406 -2.091 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.728 8.015 -0.504 1.00 0.00 H new ATOM 1225 N LYS A 81 -2.251 8.682 -2.240 1.00 0.00 N ATOM 1226 CA LYS A 81 -2.566 9.783 -3.150 1.00 0.00 C ATOM 1227 C LYS A 81 -2.573 11.120 -2.405 1.00 0.00 C ATOM 1228 O LYS A 81 -2.468 12.187 -3.011 1.00 0.00 O ATOM 1229 CB LYS A 81 -3.925 9.541 -3.821 1.00 0.00 C ATOM 1230 CG LYS A 81 -4.310 10.599 -4.847 1.00 0.00 C ATOM 1231 CD LYS A 81 -5.699 10.348 -5.411 1.00 0.00 C ATOM 1232 CE LYS A 81 -6.181 11.510 -6.266 1.00 0.00 C ATOM 1233 NZ LYS A 81 -5.395 11.661 -7.520 1.00 0.00 N ATOM 0 H LYS A 81 -3.012 8.014 -2.115 1.00 0.00 H new ATOM 0 HA LYS A 81 -1.794 9.825 -3.918 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -3.909 8.566 -4.309 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -4.696 9.499 -3.051 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -4.277 11.585 -4.384 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -3.582 10.603 -5.658 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -5.689 9.437 -6.009 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.400 10.184 -4.592 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.232 11.362 -6.516 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.118 12.432 -5.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.741 12.486 -8.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -4.391 11.796 -7.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.503 10.806 -8.102 1.00 0.00 H new ATOM 1247 N GLY A 82 -2.705 11.058 -1.090 1.00 0.00 N ATOM 1248 CA GLY A 82 -2.702 12.267 -0.298 1.00 0.00 C ATOM 1249 C GLY A 82 -1.382 12.477 0.409 1.00 0.00 C ATOM 1250 O GLY A 82 -1.341 13.047 1.501 1.00 0.00 O ATOM 0 H GLY A 82 -2.814 10.194 -0.559 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.909 13.122 -0.941 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.504 12.220 0.438 1.00 0.00 H new ATOM 1254 N LYS A 83 -0.299 12.017 -0.205 1.00 0.00 N ATOM 1255 CA LYS A 83 1.012 12.092 0.408 1.00 0.00 C ATOM 1256 C LYS A 83 2.026 12.582 -0.617 1.00 0.00 C ATOM 1257 O LYS A 83 1.737 12.625 -1.814 1.00 0.00 O ATOM 1258 CB LYS A 83 1.413 10.722 0.985 1.00 0.00 C ATOM 1259 CG LYS A 83 0.512 10.276 2.133 1.00 0.00 C ATOM 1260 CD LYS A 83 0.798 8.851 2.598 1.00 0.00 C ATOM 1261 CE LYS A 83 -0.140 8.455 3.736 1.00 0.00 C ATOM 1262 NZ LYS A 83 0.025 7.035 4.169 1.00 0.00 N ATOM 0 H LYS A 83 -0.308 11.587 -1.130 1.00 0.00 H new ATOM 0 HA LYS A 83 0.987 12.802 1.235 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.379 9.975 0.192 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.444 10.768 1.336 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.639 10.959 2.973 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.529 10.347 1.819 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.677 8.160 1.764 1.00 0.00 H new ATOM 0 HD3 LYS A 83 1.833 8.772 2.930 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.037 9.111 4.589 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.171 8.614 3.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -0.847 6.710 4.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.217 6.439 3.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.820 6.966 4.836 1.00 0.00 H new ATOM 1276 N ASP A 84 3.202 12.957 -0.152 1.00 0.00 N ATOM 1277 CA ASP A 84 4.249 13.413 -1.018 1.00 0.00 C ATOM 1278 C ASP A 84 5.386 12.433 -0.899 1.00 0.00 C ATOM 1279 O ASP A 84 5.208 11.325 -0.403 1.00 0.00 O ATOM 1280 CB ASP A 84 4.725 14.814 -0.611 1.00 0.00 C ATOM 1281 CG ASP A 84 3.596 15.815 -0.491 1.00 0.00 C ATOM 1282 OD1 ASP A 84 3.040 16.227 -1.527 1.00 0.00 O ATOM 1283 OD2 ASP A 84 3.259 16.202 0.648 1.00 0.00 O ATOM 0 H ASP A 84 3.449 12.951 0.838 1.00 0.00 H new ATOM 0 HA ASP A 84 3.887 13.474 -2.044 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.248 14.750 0.343 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.445 15.174 -1.346 1.00 0.00 H new ATOM 1288 N ILE A 85 6.547 12.842 -1.319 1.00 0.00 N ATOM 1289 CA ILE A 85 7.719 11.986 -1.235 1.00 0.00 C ATOM 1290 C ILE A 85 8.354 12.129 0.140 1.00 0.00 C ATOM 1291 O ILE A 85 8.651 11.140 0.807 1.00 0.00 O ATOM 1292 CB ILE A 85 8.740 12.289 -2.367 1.00 0.00 C ATOM 1293 CG1 ILE A 85 8.330 11.580 -3.666 1.00 0.00 C ATOM 1294 CG2 ILE A 85 10.149 11.867 -1.969 1.00 0.00 C ATOM 1295 CD1 ILE A 85 6.925 11.896 -4.134 1.00 0.00 C ATOM 0 H ILE A 85 6.719 13.762 -1.725 1.00 0.00 H new ATOM 0 HA ILE A 85 7.403 10.952 -1.374 1.00 0.00 H new ATOM 0 HB ILE A 85 8.739 13.366 -2.533 1.00 0.00 H new ATOM 0 HG12 ILE A 85 9.032 11.855 -4.453 1.00 0.00 H new ATOM 0 HG13 ILE A 85 8.418 10.503 -3.521 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.839 12.092 -2.782 1.00 0.00 H new ATOM 0 HG22 ILE A 85 10.452 12.410 -1.074 1.00 0.00 H new ATOM 0 HG23 ILE A 85 10.164 10.796 -1.766 1.00 0.00 H new ATOM 0 HD11 ILE A 85 6.718 11.354 -5.057 1.00 0.00 H new ATOM 0 HD12 ILE A 85 6.210 11.595 -3.368 1.00 0.00 H new ATOM 0 HD13 ILE A 85 6.834 12.967 -4.314 1.00 0.00 H new ATOM 1307 N GLU A 86 8.502 13.367 0.580 1.00 0.00 N ATOM 1308 CA GLU A 86 9.085 13.652 1.880 1.00 0.00 C ATOM 1309 C GLU A 86 8.245 13.052 3.001 1.00 0.00 C ATOM 1310 O GLU A 86 8.781 12.540 3.981 1.00 0.00 O ATOM 1311 CB GLU A 86 9.226 15.163 2.085 1.00 0.00 C ATOM 1312 CG GLU A 86 10.327 15.804 1.249 1.00 0.00 C ATOM 1313 CD GLU A 86 10.130 15.619 -0.241 1.00 0.00 C ATOM 1314 OE1 GLU A 86 9.059 16.002 -0.754 1.00 0.00 O ATOM 1315 OE2 GLU A 86 11.052 15.100 -0.904 1.00 0.00 O ATOM 0 H GLU A 86 8.225 14.195 0.053 1.00 0.00 H new ATOM 0 HA GLU A 86 10.074 13.196 1.909 1.00 0.00 H new ATOM 0 HB2 GLU A 86 8.277 15.642 1.845 1.00 0.00 H new ATOM 0 HB3 GLU A 86 9.424 15.359 3.139 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.371 16.870 1.473 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.288 15.378 1.537 1.00 0.00 H new ATOM 1322 N THR A 87 6.928 13.092 2.844 1.00 0.00 N ATOM 1323 CA THR A 87 6.034 12.585 3.872 1.00 0.00 C ATOM 1324 C THR A 87 5.854 11.072 3.771 1.00 0.00 C ATOM 1325 O THR A 87 5.532 10.416 4.756 1.00 0.00 O ATOM 1326 CB THR A 87 4.660 13.277 3.813 1.00 0.00 C ATOM 1327 OG1 THR A 87 4.150 13.251 2.476 1.00 0.00 O ATOM 1328 CG2 THR A 87 4.763 14.717 4.290 1.00 0.00 C ATOM 0 H THR A 87 6.459 13.468 2.020 1.00 0.00 H new ATOM 0 HA THR A 87 6.501 12.812 4.830 1.00 0.00 H new ATOM 0 HB THR A 87 3.979 12.736 4.470 1.00 0.00 H new ATOM 0 HG1 THR A 87 3.649 14.075 2.301 1.00 0.00 H new ATOM 0 HG21 THR A 87 3.781 15.188 4.240 1.00 0.00 H new ATOM 0 HG22 THR A 87 5.122 14.735 5.319 1.00 0.00 H new ATOM 0 HG23 THR A 87 5.460 15.262 3.653 1.00 0.00 H new ATOM 1336 N ALA A 88 6.076 10.513 2.589 1.00 0.00 N ATOM 1337 CA ALA A 88 5.945 9.072 2.401 1.00 0.00 C ATOM 1338 C ALA A 88 7.173 8.346 2.929 1.00 0.00 C ATOM 1339 O ALA A 88 7.060 7.331 3.613 1.00 0.00 O ATOM 1340 CB ALA A 88 5.726 8.731 0.937 1.00 0.00 C ATOM 0 H ALA A 88 6.345 11.029 1.751 1.00 0.00 H new ATOM 0 HA ALA A 88 5.073 8.741 2.966 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.632 7.651 0.825 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.815 9.213 0.583 1.00 0.00 H new ATOM 0 HB3 ALA A 88 6.574 9.084 0.350 1.00 0.00 H new ATOM 1346 N LEU A 89 8.344 8.885 2.625 1.00 0.00 N ATOM 1347 CA LEU A 89 9.599 8.286 3.056 1.00 0.00 C ATOM 1348 C LEU A 89 9.708 8.314 4.575 1.00 0.00 C ATOM 1349 O LEU A 89 10.157 7.349 5.193 1.00 0.00 O ATOM 1350 CB LEU A 89 10.784 9.012 2.412 1.00 0.00 C ATOM 1351 CG LEU A 89 11.193 8.502 1.022 1.00 0.00 C ATOM 1352 CD1 LEU A 89 10.018 8.516 0.058 1.00 0.00 C ATOM 1353 CD2 LEU A 89 12.332 9.338 0.466 1.00 0.00 C ATOM 0 H LEU A 89 8.452 9.740 2.079 1.00 0.00 H new ATOM 0 HA LEU A 89 9.618 7.245 2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.540 10.072 2.334 1.00 0.00 H new ATOM 0 HB3 LEU A 89 11.643 8.931 3.078 1.00 0.00 H new ATOM 0 HG LEU A 89 11.527 7.470 1.132 1.00 0.00 H new ATOM 0 HD11 LEU A 89 10.342 8.149 -0.916 1.00 0.00 H new ATOM 0 HD12 LEU A 89 9.225 7.874 0.442 1.00 0.00 H new ATOM 0 HD13 LEU A 89 9.643 9.534 -0.044 1.00 0.00 H new ATOM 0 HD21 LEU A 89 12.610 8.964 -0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 89 12.014 10.377 0.383 1.00 0.00 H new ATOM 0 HD23 LEU A 89 13.191 9.274 1.134 1.00 0.00 H new ATOM 1365 N SER A 90 9.259 9.409 5.172 1.00 0.00 N ATOM 1366 CA SER A 90 9.265 9.539 6.622 1.00 0.00 C ATOM 1367 C SER A 90 8.187 8.648 7.235 1.00 0.00 C ATOM 1368 O SER A 90 8.385 8.064 8.299 1.00 0.00 O ATOM 1369 CB SER A 90 9.068 11.002 7.026 1.00 0.00 C ATOM 1370 OG SER A 90 8.005 11.596 6.299 1.00 0.00 O ATOM 0 H SER A 90 8.887 10.219 4.676 1.00 0.00 H new ATOM 0 HA SER A 90 10.233 9.212 7.003 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.860 11.062 8.094 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.989 11.558 6.849 1.00 0.00 H new ATOM 0 HG SER A 90 8.363 12.045 5.505 1.00 0.00 H new ATOM 1376 N MET A 91 7.058 8.527 6.538 1.00 0.00 N ATOM 1377 CA MET A 91 5.978 7.635 6.956 1.00 0.00 C ATOM 1378 C MET A 91 6.467 6.189 6.990 1.00 0.00 C ATOM 1379 O MET A 91 6.033 5.397 7.816 1.00 0.00 O ATOM 1380 CB MET A 91 4.783 7.756 5.998 1.00 0.00 C ATOM 1381 CG MET A 91 3.628 6.820 6.325 1.00 0.00 C ATOM 1382 SD MET A 91 2.888 7.155 7.936 1.00 0.00 S ATOM 1383 CE MET A 91 2.254 8.814 7.688 1.00 0.00 C ATOM 0 H MET A 91 6.867 9.039 5.677 1.00 0.00 H new ATOM 0 HA MET A 91 5.661 7.926 7.957 1.00 0.00 H new ATOM 0 HB2 MET A 91 4.420 8.784 6.015 1.00 0.00 H new ATOM 0 HB3 MET A 91 5.123 7.555 4.982 1.00 0.00 H new ATOM 0 HG2 MET A 91 2.863 6.911 5.553 1.00 0.00 H new ATOM 0 HG3 MET A 91 3.984 5.790 6.301 1.00 0.00 H new ATOM 0 HE1 MET A 91 1.522 9.043 8.463 1.00 0.00 H new ATOM 0 HE2 MET A 91 3.075 9.529 7.741 1.00 0.00 H new ATOM 0 HE3 MET A 91 1.779 8.879 6.709 1.00 0.00 H new ATOM 1393 N SER A 92 7.391 5.869 6.101 1.00 0.00 N ATOM 1394 CA SER A 92 7.941 4.538 6.004 1.00 0.00 C ATOM 1395 C SER A 92 9.076 4.388 7.005 1.00 0.00 C ATOM 1396 O SER A 92 9.311 3.306 7.543 1.00 0.00 O ATOM 1397 CB SER A 92 8.434 4.276 4.580 1.00 0.00 C ATOM 1398 OG SER A 92 8.874 2.942 4.425 1.00 0.00 O ATOM 0 H SER A 92 7.778 6.529 5.427 1.00 0.00 H new ATOM 0 HA SER A 92 7.168 3.805 6.235 1.00 0.00 H new ATOM 0 HB2 SER A 92 7.631 4.481 3.872 1.00 0.00 H new ATOM 0 HB3 SER A 92 9.249 4.960 4.344 1.00 0.00 H new ATOM 0 HG SER A 92 8.285 2.474 3.796 1.00 0.00 H new ATOM 1404 N LYS A 93 9.769 5.490 7.275 1.00 0.00 N ATOM 1405 CA LYS A 93 10.796 5.493 8.301 1.00 0.00 C ATOM 1406 C LYS A 93 10.165 5.206 9.654 1.00 0.00 C ATOM 1407 O LYS A 93 10.645 4.357 10.398 1.00 0.00 O ATOM 1408 CB LYS A 93 11.542 6.827 8.335 1.00 0.00 C ATOM 1409 CG LYS A 93 12.601 6.891 9.422 1.00 0.00 C ATOM 1410 CD LYS A 93 13.392 8.179 9.351 1.00 0.00 C ATOM 1411 CE LYS A 93 14.418 8.254 10.465 1.00 0.00 C ATOM 1412 NZ LYS A 93 15.260 9.471 10.356 1.00 0.00 N ATOM 0 H LYS A 93 9.637 6.383 6.800 1.00 0.00 H new ATOM 0 HA LYS A 93 11.521 4.714 8.066 1.00 0.00 H new ATOM 0 HB2 LYS A 93 12.013 6.998 7.367 1.00 0.00 H new ATOM 0 HB3 LYS A 93 10.825 7.634 8.487 1.00 0.00 H new ATOM 0 HG2 LYS A 93 12.126 6.808 10.399 1.00 0.00 H new ATOM 0 HG3 LYS A 93 13.277 6.042 9.323 1.00 0.00 H new ATOM 0 HD2 LYS A 93 13.894 8.248 8.386 1.00 0.00 H new ATOM 0 HD3 LYS A 93 12.714 9.030 9.420 1.00 0.00 H new ATOM 0 HE2 LYS A 93 13.909 8.249 11.429 1.00 0.00 H new ATOM 0 HE3 LYS A 93 15.053 7.369 10.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 15.949 9.487 11.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 15.765 9.464 9.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 14.657 10.316 10.410 1.00 0.00 H new ATOM 1426 N ILE A 94 9.067 5.896 9.954 1.00 0.00 N ATOM 1427 CA ILE A 94 8.341 5.653 11.194 1.00 0.00 C ATOM 1428 C ILE A 94 7.550 4.351 11.103 1.00 0.00 C ATOM 1429 O ILE A 94 7.237 3.732 12.121 1.00 0.00 O ATOM 1430 CB ILE A 94 7.396 6.820 11.573 1.00 0.00 C ATOM 1431 CG1 ILE A 94 6.341 7.051 10.489 1.00 0.00 C ATOM 1432 CG2 ILE A 94 8.202 8.087 11.821 1.00 0.00 C ATOM 1433 CD1 ILE A 94 5.334 8.131 10.833 1.00 0.00 C ATOM 0 H ILE A 94 8.665 6.621 9.360 1.00 0.00 H new ATOM 0 HA ILE A 94 9.088 5.573 11.983 1.00 0.00 H new ATOM 0 HB ILE A 94 6.873 6.553 12.491 1.00 0.00 H new ATOM 0 HG12 ILE A 94 6.842 7.318 9.559 1.00 0.00 H new ATOM 0 HG13 ILE A 94 5.810 6.117 10.308 1.00 0.00 H new ATOM 0 HG21 ILE A 94 7.528 8.901 12.087 1.00 0.00 H new ATOM 0 HG22 ILE A 94 8.905 7.917 12.637 1.00 0.00 H new ATOM 0 HG23 ILE A 94 8.752 8.351 10.918 1.00 0.00 H new ATOM 0 HD11 ILE A 94 4.620 8.236 10.016 1.00 0.00 H new ATOM 0 HD12 ILE A 94 4.804 7.857 11.745 1.00 0.00 H new ATOM 0 HD13 ILE A 94 5.853 9.077 10.985 1.00 0.00 H new ATOM 1445 N PHE A 95 7.228 3.930 9.878 1.00 0.00 N ATOM 1446 CA PHE A 95 6.609 2.622 9.673 1.00 0.00 C ATOM 1447 C PHE A 95 7.576 1.520 10.096 1.00 0.00 C ATOM 1448 O PHE A 95 7.191 0.543 10.734 1.00 0.00 O ATOM 1449 CB PHE A 95 6.206 2.433 8.207 1.00 0.00 C ATOM 1450 CG PHE A 95 5.608 1.088 7.903 1.00 0.00 C ATOM 1451 CD1 PHE A 95 4.273 0.830 8.166 1.00 0.00 C ATOM 1452 CD2 PHE A 95 6.383 0.082 7.349 1.00 0.00 C ATOM 1453 CE1 PHE A 95 3.724 -0.406 7.881 1.00 0.00 C ATOM 1454 CE2 PHE A 95 5.840 -1.154 7.064 1.00 0.00 C ATOM 1455 CZ PHE A 95 4.509 -1.398 7.330 1.00 0.00 C ATOM 0 H PHE A 95 7.383 4.468 9.025 1.00 0.00 H new ATOM 0 HA PHE A 95 5.708 2.566 10.285 1.00 0.00 H new ATOM 0 HB2 PHE A 95 5.488 3.207 7.936 1.00 0.00 H new ATOM 0 HB3 PHE A 95 7.084 2.579 7.578 1.00 0.00 H new ATOM 0 HD1 PHE A 95 3.654 1.603 8.598 1.00 0.00 H new ATOM 0 HD2 PHE A 95 7.426 0.268 7.137 1.00 0.00 H new ATOM 0 HE1 PHE A 95 2.681 -0.595 8.089 1.00 0.00 H new ATOM 0 HE2 PHE A 95 6.456 -1.929 6.633 1.00 0.00 H new ATOM 0 HZ PHE A 95 4.082 -2.364 7.107 1.00 0.00 H new ATOM 1465 N SER A 96 8.836 1.693 9.734 1.00 0.00 N ATOM 1466 CA SER A 96 9.871 0.737 10.081 1.00 0.00 C ATOM 1467 C SER A 96 10.339 0.943 11.521 1.00 0.00 C ATOM 1468 O SER A 96 10.739 -0.008 12.195 1.00 0.00 O ATOM 1469 CB SER A 96 11.051 0.872 9.114 1.00 0.00 C ATOM 1470 OG SER A 96 12.025 -0.133 9.339 1.00 0.00 O ATOM 0 H SER A 96 9.167 2.494 9.196 1.00 0.00 H new ATOM 0 HA SER A 96 9.457 -0.268 9.999 1.00 0.00 H new ATOM 0 HB2 SER A 96 10.691 0.807 8.087 1.00 0.00 H new ATOM 0 HB3 SER A 96 11.507 1.855 9.230 1.00 0.00 H new ATOM 0 HG SER A 96 12.764 -0.020 8.705 1.00 0.00 H new ATOM 1476 N ASP A 97 10.280 2.187 11.986 1.00 0.00 N ATOM 1477 CA ASP A 97 10.745 2.529 13.326 1.00 0.00 C ATOM 1478 C ASP A 97 9.888 1.869 14.393 1.00 0.00 C ATOM 1479 O ASP A 97 10.419 1.301 15.341 1.00 0.00 O ATOM 1480 CB ASP A 97 10.744 4.044 13.544 1.00 0.00 C ATOM 1481 CG ASP A 97 11.291 4.422 14.909 1.00 0.00 C ATOM 1482 OD1 ASP A 97 10.535 4.357 15.897 1.00 0.00 O ATOM 1483 OD2 ASP A 97 12.488 4.773 15.000 1.00 0.00 O ATOM 0 H ASP A 97 9.914 2.976 11.454 1.00 0.00 H new ATOM 0 HA ASP A 97 11.766 2.158 13.411 1.00 0.00 H new ATOM 0 HB2 ASP A 97 11.342 4.522 12.768 1.00 0.00 H new ATOM 0 HB3 ASP A 97 9.728 4.424 13.443 1.00 0.00 H new ATOM 1670 N LEU A 110 -3.024 4.630 10.456 1.00 0.00 N ATOM 1671 CA LEU A 110 -2.737 3.222 10.669 1.00 0.00 C ATOM 1672 C LEU A 110 -3.965 2.365 10.404 1.00 0.00 C ATOM 1673 O LEU A 110 -3.925 1.153 10.578 1.00 0.00 O ATOM 1674 CB LEU A 110 -2.248 3.000 12.104 1.00 0.00 C ATOM 1675 CG LEU A 110 -0.983 3.771 12.494 1.00 0.00 C ATOM 1676 CD1 LEU A 110 -0.673 3.574 13.970 1.00 0.00 C ATOM 1677 CD2 LEU A 110 0.197 3.329 11.641 1.00 0.00 C ATOM 0 HA LEU A 110 -1.956 2.925 9.968 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -3.048 3.278 12.790 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -2.062 1.935 12.246 1.00 0.00 H new ATOM 0 HG LEU A 110 -1.159 4.832 12.316 1.00 0.00 H new ATOM 0 HD11 LEU A 110 0.229 4.129 14.230 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -1.508 3.938 14.569 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -0.517 2.514 14.171 1.00 0.00 H new ATOM 0 HD21 LEU A 110 1.086 3.888 11.933 1.00 0.00 H new ATOM 0 HD22 LEU A 110 0.373 2.263 11.788 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -0.022 3.519 10.590 1.00 0.00 H new ATOM 1689 N GLY A 111 -5.051 2.996 9.975 1.00 0.00 N ATOM 1690 CA GLY A 111 -6.266 2.259 9.686 1.00 0.00 C ATOM 1691 C GLY A 111 -6.144 1.486 8.392 1.00 0.00 C ATOM 1692 O GLY A 111 -6.617 0.358 8.279 1.00 0.00 O ATOM 0 H GLY A 111 -5.112 4.003 9.822 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.480 1.571 10.504 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -7.107 2.950 9.622 1.00 0.00 H new ATOM 1696 N ASP A 112 -5.496 2.109 7.421 1.00 0.00 N ATOM 1697 CA ASP A 112 -5.212 1.481 6.135 1.00 0.00 C ATOM 1698 C ASP A 112 -4.190 0.358 6.309 1.00 0.00 C ATOM 1699 O ASP A 112 -4.303 -0.714 5.714 1.00 0.00 O ATOM 1700 CB ASP A 112 -4.693 2.550 5.165 1.00 0.00 C ATOM 1701 CG ASP A 112 -4.210 1.990 3.842 1.00 0.00 C ATOM 1702 OD1 ASP A 112 -5.016 1.357 3.127 1.00 0.00 O ATOM 1703 OD2 ASP A 112 -3.026 2.218 3.502 1.00 0.00 O ATOM 0 H ASP A 112 -5.151 3.065 7.500 1.00 0.00 H new ATOM 0 HA ASP A 112 -6.123 1.041 5.728 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.487 3.272 4.975 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -3.876 3.093 5.640 1.00 0.00 H new ATOM 1708 N ILE A 113 -3.226 0.597 7.187 1.00 0.00 N ATOM 1709 CA ILE A 113 -2.149 -0.348 7.440 1.00 0.00 C ATOM 1710 C ILE A 113 -2.612 -1.454 8.389 1.00 0.00 C ATOM 1711 O ILE A 113 -2.016 -2.529 8.446 1.00 0.00 O ATOM 1712 CB ILE A 113 -0.915 0.367 8.041 1.00 0.00 C ATOM 1713 CG1 ILE A 113 -0.503 1.543 7.151 1.00 0.00 C ATOM 1714 CG2 ILE A 113 0.243 -0.607 8.203 1.00 0.00 C ATOM 1715 CD1 ILE A 113 0.631 2.372 7.718 1.00 0.00 C ATOM 0 H ILE A 113 -3.169 1.450 7.743 1.00 0.00 H new ATOM 0 HA ILE A 113 -1.868 -0.792 6.485 1.00 0.00 H new ATOM 0 HB ILE A 113 -1.181 0.749 9.027 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.208 1.161 6.174 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -1.368 2.187 6.993 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.101 -0.085 8.627 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -0.054 -1.418 8.869 1.00 0.00 H new ATOM 0 HG23 ILE A 113 0.512 -1.017 7.230 1.00 0.00 H new ATOM 0 HD11 ILE A 113 0.866 3.185 7.031 1.00 0.00 H new ATOM 0 HD12 ILE A 113 0.333 2.785 8.682 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.511 1.743 7.850 1.00 0.00 H new ATOM 1727 N GLU A 114 -3.685 -1.188 9.125 1.00 0.00 N ATOM 1728 CA GLU A 114 -4.227 -2.157 10.076 1.00 0.00 C ATOM 1729 C GLU A 114 -4.683 -3.416 9.345 1.00 0.00 C ATOM 1730 O GLU A 114 -4.621 -4.523 9.885 1.00 0.00 O ATOM 1731 CB GLU A 114 -5.390 -1.540 10.860 1.00 0.00 C ATOM 1732 CG GLU A 114 -5.832 -2.367 12.055 1.00 0.00 C ATOM 1733 CD GLU A 114 -6.843 -1.644 12.919 1.00 0.00 C ATOM 1734 OE1 GLU A 114 -6.474 -0.625 13.544 1.00 0.00 O ATOM 1735 OE2 GLU A 114 -8.004 -2.098 12.993 1.00 0.00 O ATOM 0 H GLU A 114 -4.199 -0.308 9.083 1.00 0.00 H new ATOM 0 HA GLU A 114 -3.443 -2.431 10.781 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -5.098 -0.548 11.205 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -6.238 -1.407 10.189 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -6.263 -3.305 11.704 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -4.961 -2.623 12.658 1.00 0.00 H new ATOM 1742 N ALA A 115 -5.113 -3.239 8.102 1.00 0.00 N ATOM 1743 CA ALA A 115 -5.521 -4.360 7.267 1.00 0.00 C ATOM 1744 C ALA A 115 -4.306 -5.170 6.822 1.00 0.00 C ATOM 1745 O ALA A 115 -4.418 -6.348 6.490 1.00 0.00 O ATOM 1746 CB ALA A 115 -6.301 -3.858 6.062 1.00 0.00 C ATOM 0 H ALA A 115 -5.188 -2.328 7.650 1.00 0.00 H new ATOM 0 HA ALA A 115 -6.167 -5.013 7.853 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -6.601 -4.705 5.444 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -7.188 -3.323 6.400 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -5.673 -3.186 5.476 1.00 0.00 H new ATOM 1752 N LEU A 116 -3.139 -4.538 6.850 1.00 0.00 N ATOM 1753 CA LEU A 116 -1.903 -5.198 6.431 1.00 0.00 C ATOM 1754 C LEU A 116 -1.256 -5.876 7.626 1.00 0.00 C ATOM 1755 O LEU A 116 -0.708 -6.976 7.529 1.00 0.00 O ATOM 1756 CB LEU A 116 -0.926 -4.189 5.828 1.00 0.00 C ATOM 1757 CG LEU A 116 -1.391 -3.507 4.541 1.00 0.00 C ATOM 1758 CD1 LEU A 116 -0.356 -2.492 4.084 1.00 0.00 C ATOM 1759 CD2 LEU A 116 -1.643 -4.538 3.450 1.00 0.00 C ATOM 0 H LEU A 116 -3.020 -3.573 7.157 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.149 -5.941 5.672 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.721 -3.419 6.572 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.017 -4.698 5.628 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.327 -2.986 4.742 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.697 -2.012 3.167 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.219 -1.738 4.859 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.592 -2.997 3.898 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -1.973 -4.034 2.542 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.722 -5.085 3.247 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -2.414 -5.235 3.779 1.00 0.00 H new ATOM 1771 N GLN A 117 -1.338 -5.192 8.755 1.00 0.00 N ATOM 1772 CA GLN A 117 -0.823 -5.684 10.020 1.00 0.00 C ATOM 1773 C GLN A 117 -1.488 -7.007 10.399 1.00 0.00 C ATOM 1774 O GLN A 117 -0.877 -7.852 11.049 1.00 0.00 O ATOM 1775 CB GLN A 117 -1.031 -4.587 11.082 1.00 0.00 C ATOM 1776 CG GLN A 117 -1.139 -5.049 12.531 1.00 0.00 C ATOM 1777 CD GLN A 117 -2.557 -5.433 12.909 1.00 0.00 C ATOM 1778 OE1 GLN A 117 -2.919 -6.609 12.933 1.00 0.00 O ATOM 1779 NE2 GLN A 117 -3.387 -4.432 13.150 1.00 0.00 N ATOM 0 H GLN A 117 -1.769 -4.270 8.819 1.00 0.00 H new ATOM 0 HA GLN A 117 0.243 -5.898 9.944 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -0.202 -3.882 11.010 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -1.939 -4.038 10.831 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.480 -5.903 12.688 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -0.792 -4.253 13.190 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -3.048 -3.470 13.121 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -4.366 -4.622 13.365 1.00 0.00 H new ATOM 1788 N GLY A 118 -2.729 -7.192 9.965 1.00 0.00 N ATOM 1789 CA GLY A 118 -3.444 -8.416 10.271 1.00 0.00 C ATOM 1790 C GLY A 118 -2.879 -9.627 9.548 1.00 0.00 C ATOM 1791 O GLY A 118 -2.538 -10.627 10.178 1.00 0.00 O ATOM 0 H GLY A 118 -3.252 -6.517 9.407 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -3.409 -8.592 11.346 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -4.493 -8.295 10.002 1.00 0.00 H new ATOM 1795 N VAL A 119 -2.751 -9.520 8.230 1.00 0.00 N ATOM 1796 CA VAL A 119 -2.356 -10.654 7.394 1.00 0.00 C ATOM 1797 C VAL A 119 -0.866 -10.995 7.554 1.00 0.00 C ATOM 1798 O VAL A 119 -0.443 -12.110 7.252 1.00 0.00 O ATOM 1799 CB VAL A 119 -2.683 -10.381 5.905 1.00 0.00 C ATOM 1800 CG1 VAL A 119 -1.859 -9.222 5.365 1.00 0.00 C ATOM 1801 CG2 VAL A 119 -2.481 -11.633 5.061 1.00 0.00 C ATOM 0 H VAL A 119 -2.915 -8.656 7.713 1.00 0.00 H new ATOM 0 HA VAL A 119 -2.933 -11.515 7.732 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.734 -10.101 5.843 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -2.110 -9.054 4.318 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.077 -8.322 5.940 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -0.798 -9.459 5.450 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.718 -11.412 4.020 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.444 -11.959 5.136 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.137 -12.425 5.422 1.00 0.00 H new ATOM 1811 N SER A 120 -0.095 -10.036 8.058 1.00 0.00 N ATOM 1812 CA SER A 120 1.363 -10.163 8.205 1.00 0.00 C ATOM 1813 C SER A 120 1.790 -11.391 9.029 1.00 0.00 C ATOM 1814 O SER A 120 2.959 -11.787 9.002 1.00 0.00 O ATOM 1815 CB SER A 120 1.935 -8.894 8.840 1.00 0.00 C ATOM 1816 OG SER A 120 1.465 -8.728 10.167 1.00 0.00 O ATOM 0 H SER A 120 -0.461 -9.140 8.380 1.00 0.00 H new ATOM 0 HA SER A 120 1.764 -10.302 7.201 1.00 0.00 H new ATOM 0 HB2 SER A 120 3.024 -8.944 8.841 1.00 0.00 H new ATOM 0 HB3 SER A 120 1.656 -8.027 8.241 1.00 0.00 H new ATOM 0 HG SER A 120 0.494 -8.599 10.156 1.00 0.00 H new ATOM 1822 N LYS A 121 0.855 -11.985 9.751 1.00 0.00 N ATOM 1823 CA LYS A 121 1.177 -12.996 10.751 1.00 0.00 C ATOM 1824 C LYS A 121 0.559 -14.346 10.371 1.00 0.00 C ATOM 1825 O LYS A 121 0.162 -15.131 11.232 1.00 0.00 O ATOM 1826 CB LYS A 121 0.660 -12.513 12.112 1.00 0.00 C ATOM 1827 CG LYS A 121 1.174 -13.300 13.308 1.00 0.00 C ATOM 1828 CD LYS A 121 0.740 -12.654 14.617 1.00 0.00 C ATOM 1829 CE LYS A 121 -0.777 -12.547 14.725 1.00 0.00 C ATOM 1830 NZ LYS A 121 -1.195 -11.753 15.914 1.00 0.00 N ATOM 0 H LYS A 121 -0.141 -11.784 9.664 1.00 0.00 H new ATOM 0 HA LYS A 121 2.256 -13.139 10.803 1.00 0.00 H new ATOM 0 HB2 LYS A 121 0.936 -11.466 12.239 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -0.429 -12.557 12.107 1.00 0.00 H new ATOM 0 HG2 LYS A 121 0.800 -14.323 13.262 1.00 0.00 H new ATOM 0 HG3 LYS A 121 2.262 -13.356 13.270 1.00 0.00 H new ATOM 0 HD2 LYS A 121 1.123 -13.238 15.454 1.00 0.00 H new ATOM 0 HD3 LYS A 121 1.180 -11.660 14.694 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -1.173 -12.084 13.822 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -1.208 -13.546 14.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -2.233 -11.704 15.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -0.839 -12.209 16.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -0.805 -10.791 15.844 1.00 0.00 H new ATOM 1844 N PHE A 122 0.507 -14.627 9.075 1.00 0.00 N ATOM 1845 CA PHE A 122 -0.130 -15.848 8.586 1.00 0.00 C ATOM 1846 C PHE A 122 0.778 -16.560 7.591 1.00 0.00 C ATOM 1847 O PHE A 122 1.851 -16.070 7.283 1.00 0.00 O ATOM 1848 CB PHE A 122 -1.458 -15.498 7.903 1.00 0.00 C ATOM 1849 CG PHE A 122 -2.557 -15.120 8.849 1.00 0.00 C ATOM 1850 CD1 PHE A 122 -3.356 -16.091 9.423 1.00 0.00 C ATOM 1851 CD2 PHE A 122 -2.795 -13.793 9.156 1.00 0.00 C ATOM 1852 CE1 PHE A 122 -4.374 -15.748 10.289 1.00 0.00 C ATOM 1853 CE2 PHE A 122 -3.811 -13.440 10.019 1.00 0.00 C ATOM 1854 CZ PHE A 122 -4.603 -14.419 10.588 1.00 0.00 C ATOM 0 H PHE A 122 0.896 -14.030 8.345 1.00 0.00 H new ATOM 0 HA PHE A 122 -0.314 -16.509 9.433 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -1.291 -14.673 7.211 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -1.784 -16.352 7.309 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -3.181 -17.131 9.191 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -2.178 -13.024 8.715 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -4.990 -16.517 10.732 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -3.987 -12.400 10.250 1.00 0.00 H new ATOM 0 HZ PHE A 122 -5.399 -14.146 11.265 1.00 0.00 H new ATOM 1864 N PRO A 123 0.379 -17.733 7.077 1.00 0.00 N ATOM 1865 CA PRO A 123 1.028 -18.311 5.898 1.00 0.00 C ATOM 1866 C PRO A 123 0.618 -17.549 4.638 1.00 0.00 C ATOM 1867 O PRO A 123 1.095 -17.814 3.535 1.00 0.00 O ATOM 1868 CB PRO A 123 0.496 -19.747 5.864 1.00 0.00 C ATOM 1869 CG PRO A 123 -0.821 -19.676 6.557 1.00 0.00 C ATOM 1870 CD PRO A 123 -0.673 -18.620 7.620 1.00 0.00 C ATOM 0 HA PRO A 123 2.116 -18.265 5.941 1.00 0.00 H new ATOM 0 HB2 PRO A 123 0.387 -20.105 4.840 1.00 0.00 H new ATOM 0 HB3 PRO A 123 1.174 -20.433 6.371 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -1.616 -19.417 5.858 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -1.083 -20.638 6.997 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -1.607 -18.082 7.785 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -0.380 -19.051 8.577 1.00 0.00 H new ATOM 1878 N ALA A 124 -0.268 -16.576 4.833 1.00 0.00 N ATOM 1879 CA ALA A 124 -0.848 -15.821 3.737 1.00 0.00 C ATOM 1880 C ALA A 124 -0.154 -14.475 3.521 1.00 0.00 C ATOM 1881 O ALA A 124 -0.294 -13.878 2.451 1.00 0.00 O ATOM 1882 CB ALA A 124 -2.331 -15.612 3.997 1.00 0.00 C ATOM 0 H ALA A 124 -0.601 -16.293 5.755 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.706 -16.399 2.824 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -2.768 -15.045 3.175 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -2.827 -16.580 4.075 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.463 -15.061 4.928 1.00 0.00 H new ATOM 1888 N ARG A 125 0.579 -13.987 4.529 1.00 0.00 N ATOM 1889 CA ARG A 125 1.262 -12.696 4.410 1.00 0.00 C ATOM 1890 C ARG A 125 2.173 -12.664 3.212 1.00 0.00 C ATOM 1891 O ARG A 125 1.948 -11.878 2.310 1.00 0.00 O ATOM 1892 CB ARG A 125 2.053 -12.312 5.666 1.00 0.00 C ATOM 1893 CG ARG A 125 2.553 -13.476 6.494 1.00 0.00 C ATOM 1894 CD ARG A 125 4.006 -13.843 6.224 1.00 0.00 C ATOM 1895 NE ARG A 125 4.415 -14.941 7.101 1.00 0.00 N ATOM 1896 CZ ARG A 125 5.509 -15.685 6.953 1.00 0.00 C ATOM 1897 NH1 ARG A 125 6.393 -15.421 6.000 1.00 0.00 N ATOM 1898 NH2 ARG A 125 5.728 -16.689 7.794 1.00 0.00 N ATOM 0 H ARG A 125 0.713 -14.459 5.423 1.00 0.00 H new ATOM 0 HA ARG A 125 0.469 -11.959 4.283 1.00 0.00 H new ATOM 0 HB2 ARG A 125 2.908 -11.706 5.366 1.00 0.00 H new ATOM 0 HB3 ARG A 125 1.422 -11.684 6.295 1.00 0.00 H new ATOM 0 HG2 ARG A 125 2.440 -13.233 7.551 1.00 0.00 H new ATOM 0 HG3 ARG A 125 1.926 -14.346 6.297 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.128 -14.135 5.181 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.646 -12.976 6.390 1.00 0.00 H new ATOM 0 HE ARG A 125 3.810 -15.155 7.894 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.240 -14.637 5.366 1.00 0.00 H new ATOM 0 HH12 ARG A 125 7.226 -16.002 5.902 1.00 0.00 H new ATOM 0 HH21 ARG A 125 5.062 -16.882 8.542 1.00 0.00 H new ATOM 0 HH22 ARG A 125 6.562 -17.267 7.692 1.00 0.00 H new ATOM 1912 N ILE A 126 3.146 -13.565 3.170 1.00 0.00 N ATOM 1913 CA ILE A 126 4.156 -13.553 2.117 1.00 0.00 C ATOM 1914 C ILE A 126 3.501 -13.406 0.748 1.00 0.00 C ATOM 1915 O ILE A 126 4.019 -12.731 -0.133 1.00 0.00 O ATOM 1916 CB ILE A 126 5.035 -14.830 2.151 1.00 0.00 C ATOM 1917 CG1 ILE A 126 6.011 -14.835 0.969 1.00 0.00 C ATOM 1918 CG2 ILE A 126 4.173 -16.087 2.154 1.00 0.00 C ATOM 1919 CD1 ILE A 126 6.947 -16.020 0.949 1.00 0.00 C ATOM 0 H ILE A 126 3.258 -14.314 3.853 1.00 0.00 H new ATOM 0 HA ILE A 126 4.804 -12.695 2.297 1.00 0.00 H new ATOM 0 HB ILE A 126 5.614 -14.825 3.075 1.00 0.00 H new ATOM 0 HG12 ILE A 126 5.441 -14.820 0.040 1.00 0.00 H new ATOM 0 HG13 ILE A 126 6.602 -13.919 0.995 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.814 -16.968 2.178 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.528 -16.084 3.033 1.00 0.00 H new ATOM 0 HG23 ILE A 126 3.559 -16.109 1.253 1.00 0.00 H new ATOM 0 HD11 ILE A 126 7.605 -15.950 0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 126 7.546 -16.026 1.860 1.00 0.00 H new ATOM 0 HD13 ILE A 126 6.367 -16.941 0.890 1.00 0.00 H new ATOM 1931 N LYS A 127 2.309 -13.958 0.623 1.00 0.00 N ATOM 1932 CA LYS A 127 1.603 -13.950 -0.639 1.00 0.00 C ATOM 1933 C LYS A 127 0.875 -12.622 -0.871 1.00 0.00 C ATOM 1934 O LYS A 127 1.156 -11.899 -1.832 1.00 0.00 O ATOM 1935 CB LYS A 127 0.638 -15.132 -0.676 1.00 0.00 C ATOM 1936 CG LYS A 127 1.353 -16.476 -0.666 1.00 0.00 C ATOM 1937 CD LYS A 127 0.402 -17.629 -0.401 1.00 0.00 C ATOM 1938 CE LYS A 127 1.071 -18.972 -0.653 1.00 0.00 C ATOM 1939 NZ LYS A 127 2.304 -19.157 0.159 1.00 0.00 N ATOM 0 H LYS A 127 1.810 -14.418 1.384 1.00 0.00 H new ATOM 0 HA LYS A 127 2.324 -14.051 -1.450 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -0.032 -15.075 0.182 1.00 0.00 H new ATOM 0 HB3 LYS A 127 0.018 -15.062 -1.570 1.00 0.00 H new ATOM 0 HG2 LYS A 127 1.849 -16.629 -1.625 1.00 0.00 H new ATOM 0 HG3 LYS A 127 2.131 -16.466 0.097 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.052 -17.584 0.630 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -0.476 -17.533 -1.040 1.00 0.00 H new ATOM 0 HE2 LYS A 127 0.367 -19.773 -0.426 1.00 0.00 H new ATOM 0 HE3 LYS A 127 1.320 -19.057 -1.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 2.645 -20.134 0.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 3.038 -18.497 -0.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 2.092 -18.970 1.160 1.00 0.00 H new ATOM 1953 N CYS A 128 -0.014 -12.274 0.038 1.00 0.00 N ATOM 1954 CA CYS A 128 -0.896 -11.135 -0.168 1.00 0.00 C ATOM 1955 C CYS A 128 -0.239 -9.835 0.292 1.00 0.00 C ATOM 1956 O CYS A 128 -0.617 -8.742 -0.141 1.00 0.00 O ATOM 1957 CB CYS A 128 -2.232 -11.374 0.542 1.00 0.00 C ATOM 1958 SG CYS A 128 -3.146 -12.810 -0.093 1.00 0.00 S ATOM 0 H CYS A 128 -0.147 -12.760 0.925 1.00 0.00 H new ATOM 0 HA CYS A 128 -1.089 -11.032 -1.236 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -2.048 -11.513 1.607 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -2.853 -10.484 0.439 1.00 0.00 H new ATOM 0 HG CYS A 128 -2.821 -13.017 -1.334 1.00 0.00 H new ATOM 1964 N ALA A 129 0.750 -9.958 1.162 1.00 0.00 N ATOM 1965 CA ALA A 129 1.479 -8.804 1.660 1.00 0.00 C ATOM 1966 C ALA A 129 2.622 -8.432 0.727 1.00 0.00 C ATOM 1967 O ALA A 129 2.947 -7.255 0.610 1.00 0.00 O ATOM 1968 CB ALA A 129 1.993 -9.040 3.073 1.00 0.00 C ATOM 0 H ALA A 129 1.067 -10.851 1.539 1.00 0.00 H new ATOM 0 HA ALA A 129 0.782 -7.967 1.693 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.534 -8.158 3.416 1.00 0.00 H new ATOM 0 HB2 ALA A 129 1.152 -9.231 3.739 1.00 0.00 H new ATOM 0 HB3 ALA A 129 2.662 -9.900 3.078 1.00 0.00 H new ATOM 1974 N THR A 130 3.248 -9.409 0.056 1.00 0.00 N ATOM 1975 CA THR A 130 4.252 -9.057 -0.941 1.00 0.00 C ATOM 1976 C THR A 130 3.574 -8.266 -2.051 1.00 0.00 C ATOM 1977 O THR A 130 4.148 -7.328 -2.591 1.00 0.00 O ATOM 1978 CB THR A 130 5.005 -10.281 -1.531 1.00 0.00 C ATOM 1979 OG1 THR A 130 6.221 -9.850 -2.164 1.00 0.00 O ATOM 1980 CG2 THR A 130 4.164 -11.027 -2.556 1.00 0.00 C ATOM 0 H THR A 130 3.083 -10.408 0.181 1.00 0.00 H new ATOM 0 HA THR A 130 5.014 -8.459 -0.442 1.00 0.00 H new ATOM 0 HB THR A 130 5.221 -10.955 -0.702 1.00 0.00 H new ATOM 0 HG1 THR A 130 6.691 -10.627 -2.532 1.00 0.00 H new ATOM 0 HG21 THR A 130 4.729 -11.875 -2.943 1.00 0.00 H new ATOM 0 HG22 THR A 130 3.249 -11.385 -2.084 1.00 0.00 H new ATOM 0 HG23 THR A 130 3.910 -10.356 -3.376 1.00 0.00 H new ATOM 1988 N LEU A 131 2.332 -8.636 -2.353 1.00 0.00 N ATOM 1989 CA LEU A 131 1.528 -7.898 -3.310 1.00 0.00 C ATOM 1990 C LEU A 131 1.320 -6.460 -2.821 1.00 0.00 C ATOM 1991 O LEU A 131 1.871 -5.514 -3.385 1.00 0.00 O ATOM 1992 CB LEU A 131 0.186 -8.629 -3.508 1.00 0.00 C ATOM 1993 CG LEU A 131 -0.760 -8.067 -4.581 1.00 0.00 C ATOM 1994 CD1 LEU A 131 -1.711 -9.153 -5.055 1.00 0.00 C ATOM 1995 CD2 LEU A 131 -1.568 -6.897 -4.043 1.00 0.00 C ATOM 0 H LEU A 131 1.864 -9.445 -1.945 1.00 0.00 H new ATOM 0 HA LEU A 131 2.040 -7.847 -4.271 1.00 0.00 H new ATOM 0 HB2 LEU A 131 0.399 -9.669 -3.755 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -0.344 -8.630 -2.555 1.00 0.00 H new ATOM 0 HG LEU A 131 -0.150 -7.717 -5.414 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -2.378 -8.746 -5.815 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -1.139 -9.978 -5.478 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -2.300 -9.515 -4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.228 -6.521 -4.825 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.164 -7.227 -3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -0.892 -6.103 -3.726 1.00 0.00 H new ATOM 2007 N SER A 132 0.569 -6.319 -1.738 1.00 0.00 N ATOM 2008 CA SER A 132 0.147 -5.011 -1.251 1.00 0.00 C ATOM 2009 C SER A 132 1.328 -4.162 -0.767 1.00 0.00 C ATOM 2010 O SER A 132 1.534 -3.041 -1.235 1.00 0.00 O ATOM 2011 CB SER A 132 -0.867 -5.196 -0.121 1.00 0.00 C ATOM 2012 OG SER A 132 -1.868 -6.137 -0.487 1.00 0.00 O ATOM 0 H SER A 132 0.236 -7.101 -1.175 1.00 0.00 H new ATOM 0 HA SER A 132 -0.311 -4.475 -2.083 1.00 0.00 H new ATOM 0 HB2 SER A 132 -0.356 -5.535 0.780 1.00 0.00 H new ATOM 0 HB3 SER A 132 -1.331 -4.239 0.117 1.00 0.00 H new ATOM 0 HG SER A 132 -1.534 -7.046 -0.335 1.00 0.00 H new ATOM 2018 N TRP A 133 2.112 -4.709 0.152 1.00 0.00 N ATOM 2019 CA TRP A 133 3.153 -3.942 0.822 1.00 0.00 C ATOM 2020 C TRP A 133 4.325 -3.640 -0.108 1.00 0.00 C ATOM 2021 O TRP A 133 4.756 -2.491 -0.211 1.00 0.00 O ATOM 2022 CB TRP A 133 3.651 -4.687 2.068 1.00 0.00 C ATOM 2023 CG TRP A 133 4.760 -3.979 2.787 1.00 0.00 C ATOM 2024 CD1 TRP A 133 4.638 -2.939 3.663 1.00 0.00 C ATOM 2025 CD2 TRP A 133 6.162 -4.264 2.694 1.00 0.00 C ATOM 2026 NE1 TRP A 133 5.878 -2.556 4.116 1.00 0.00 N ATOM 2027 CE2 TRP A 133 6.828 -3.355 3.537 1.00 0.00 C ATOM 2028 CE3 TRP A 133 6.918 -5.200 1.982 1.00 0.00 C ATOM 2029 CZ2 TRP A 133 8.214 -3.352 3.682 1.00 0.00 C ATOM 2030 CZ3 TRP A 133 8.292 -5.195 2.128 1.00 0.00 C ATOM 2031 CH2 TRP A 133 8.927 -4.279 2.973 1.00 0.00 C ATOM 0 H TRP A 133 2.047 -5.682 0.451 1.00 0.00 H new ATOM 0 HA TRP A 133 2.712 -2.991 1.123 1.00 0.00 H new ATOM 0 HB2 TRP A 133 2.816 -4.828 2.754 1.00 0.00 H new ATOM 0 HB3 TRP A 133 3.994 -5.679 1.775 1.00 0.00 H new ATOM 0 HD1 TRP A 133 3.704 -2.484 3.957 1.00 0.00 H new ATOM 0 HE1 TRP A 133 6.061 -1.800 4.776 1.00 0.00 H new ATOM 0 HE3 TRP A 133 6.437 -5.914 1.330 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.707 -2.643 4.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.886 -5.911 1.580 1.00 0.00 H new ATOM 0 HH2 TRP A 133 10.003 -4.304 3.068 1.00 0.00 H new ATOM 2042 N LYS A 134 4.823 -4.658 -0.802 1.00 0.00 N ATOM 2043 CA LYS A 134 6.044 -4.498 -1.583 1.00 0.00 C ATOM 2044 C LYS A 134 5.814 -3.585 -2.783 1.00 0.00 C ATOM 2045 O LYS A 134 6.741 -2.943 -3.260 1.00 0.00 O ATOM 2046 CB LYS A 134 6.590 -5.860 -2.029 1.00 0.00 C ATOM 2047 CG LYS A 134 7.890 -5.778 -2.819 1.00 0.00 C ATOM 2048 CD LYS A 134 9.000 -5.123 -2.012 1.00 0.00 C ATOM 2049 CE LYS A 134 10.278 -5.010 -2.826 1.00 0.00 C ATOM 2050 NZ LYS A 134 10.814 -6.339 -3.214 1.00 0.00 N ATOM 0 H LYS A 134 4.408 -5.589 -0.840 1.00 0.00 H new ATOM 0 HA LYS A 134 6.790 -4.027 -0.943 1.00 0.00 H new ATOM 0 HB2 LYS A 134 6.751 -6.482 -1.148 1.00 0.00 H new ATOM 0 HB3 LYS A 134 5.837 -6.360 -2.639 1.00 0.00 H new ATOM 0 HG2 LYS A 134 8.199 -6.780 -3.116 1.00 0.00 H new ATOM 0 HG3 LYS A 134 7.724 -5.211 -3.735 1.00 0.00 H new ATOM 0 HD2 LYS A 134 8.682 -4.131 -1.690 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.190 -5.706 -1.111 1.00 0.00 H new ATOM 0 HE2 LYS A 134 10.085 -4.422 -3.723 1.00 0.00 H new ATOM 0 HE3 LYS A 134 11.029 -4.472 -2.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 11.773 -6.227 -3.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.848 -6.957 -2.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 10.197 -6.765 -3.935 1.00 0.00 H new ATOM 2064 N ALA A 135 4.580 -3.502 -3.252 1.00 0.00 N ATOM 2065 CA ALA A 135 4.273 -2.642 -4.385 1.00 0.00 C ATOM 2066 C ALA A 135 4.172 -1.184 -3.951 1.00 0.00 C ATOM 2067 O ALA A 135 4.606 -0.280 -4.666 1.00 0.00 O ATOM 2068 CB ALA A 135 2.988 -3.086 -5.061 1.00 0.00 C ATOM 0 H ALA A 135 3.783 -4.012 -2.872 1.00 0.00 H new ATOM 0 HA ALA A 135 5.088 -2.727 -5.103 1.00 0.00 H new ATOM 0 HB1 ALA A 135 2.776 -2.430 -5.906 1.00 0.00 H new ATOM 0 HB2 ALA A 135 3.099 -4.111 -5.416 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.166 -3.036 -4.347 1.00 0.00 H new ATOM 2074 N LEU A 136 3.637 -0.959 -2.760 1.00 0.00 N ATOM 2075 CA LEU A 136 3.370 0.393 -2.300 1.00 0.00 C ATOM 2076 C LEU A 136 4.649 1.025 -1.770 1.00 0.00 C ATOM 2077 O LEU A 136 5.000 2.148 -2.136 1.00 0.00 O ATOM 2078 CB LEU A 136 2.302 0.386 -1.202 1.00 0.00 C ATOM 2079 CG LEU A 136 1.406 1.627 -1.151 1.00 0.00 C ATOM 2080 CD1 LEU A 136 0.262 1.498 -2.151 1.00 0.00 C ATOM 2081 CD2 LEU A 136 0.869 1.843 0.254 1.00 0.00 C ATOM 0 H LEU A 136 3.381 -1.692 -2.099 1.00 0.00 H new ATOM 0 HA LEU A 136 3.002 0.978 -3.143 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.671 -0.492 -1.338 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.797 0.276 -0.237 1.00 0.00 H new ATOM 0 HG LEU A 136 2.005 2.496 -1.423 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -0.366 2.388 -2.103 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.668 1.395 -3.157 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -0.335 0.619 -1.909 1.00 0.00 H new ATOM 0 HD21 LEU A 136 0.235 2.729 0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 136 0.285 0.974 0.558 1.00 0.00 H new ATOM 0 HD23 LEU A 136 1.701 1.981 0.944 1.00 0.00 H new ATOM 2093 N GLU A 137 5.360 0.273 -0.939 1.00 0.00 N ATOM 2094 CA GLU A 137 6.560 0.777 -0.282 1.00 0.00 C ATOM 2095 C GLU A 137 7.738 0.840 -1.246 1.00 0.00 C ATOM 2096 O GLU A 137 8.712 1.552 -1.005 1.00 0.00 O ATOM 2097 CB GLU A 137 6.907 -0.089 0.926 1.00 0.00 C ATOM 2098 CG GLU A 137 5.913 0.040 2.068 1.00 0.00 C ATOM 2099 CD GLU A 137 5.922 1.420 2.696 1.00 0.00 C ATOM 2100 OE1 GLU A 137 6.780 1.667 3.569 1.00 0.00 O ATOM 2101 OE2 GLU A 137 5.070 2.255 2.320 1.00 0.00 O ATOM 0 H GLU A 137 5.125 -0.691 -0.703 1.00 0.00 H new ATOM 0 HA GLU A 137 6.353 1.792 0.058 1.00 0.00 H new ATOM 0 HB2 GLU A 137 6.956 -1.132 0.613 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.899 0.183 1.286 1.00 0.00 H new ATOM 0 HG2 GLU A 137 4.911 -0.181 1.699 1.00 0.00 H new ATOM 0 HG3 GLU A 137 6.143 -0.704 2.831 1.00 0.00 H new ATOM 2108 N LYS A 138 7.661 0.098 -2.342 1.00 0.00 N ATOM 2109 CA LYS A 138 8.712 0.162 -3.350 1.00 0.00 C ATOM 2110 C LYS A 138 8.406 1.278 -4.343 1.00 0.00 C ATOM 2111 O LYS A 138 9.293 1.762 -5.045 1.00 0.00 O ATOM 2112 CB LYS A 138 8.866 -1.180 -4.076 1.00 0.00 C ATOM 2113 CG LYS A 138 9.987 -1.206 -5.107 1.00 0.00 C ATOM 2114 CD LYS A 138 11.338 -0.901 -4.478 1.00 0.00 C ATOM 2115 CE LYS A 138 12.458 -0.927 -5.510 1.00 0.00 C ATOM 2116 NZ LYS A 138 12.253 0.074 -6.594 1.00 0.00 N ATOM 0 H LYS A 138 6.898 -0.544 -2.555 1.00 0.00 H new ATOM 0 HA LYS A 138 9.657 0.377 -2.852 1.00 0.00 H new ATOM 0 HB2 LYS A 138 9.048 -1.961 -3.338 1.00 0.00 H new ATOM 0 HB3 LYS A 138 7.926 -1.422 -4.571 1.00 0.00 H new ATOM 0 HG2 LYS A 138 10.020 -2.186 -5.583 1.00 0.00 H new ATOM 0 HG3 LYS A 138 9.778 -0.478 -5.890 1.00 0.00 H new ATOM 0 HD2 LYS A 138 11.305 0.079 -4.001 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.548 -1.629 -3.695 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.409 -0.733 -5.015 1.00 0.00 H new ATOM 0 HE3 LYS A 138 12.523 -1.924 -5.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 13.125 0.163 -7.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 11.476 -0.237 -7.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 12.015 0.996 -6.175 1.00 0.00 H new ATOM 2130 N GLY A 139 7.149 1.696 -4.375 1.00 0.00 N ATOM 2131 CA GLY A 139 6.745 2.752 -5.276 1.00 0.00 C ATOM 2132 C GLY A 139 7.396 4.075 -4.938 1.00 0.00 C ATOM 2133 O GLY A 139 8.048 4.688 -5.781 1.00 0.00 O ATOM 0 H GLY A 139 6.401 1.321 -3.791 1.00 0.00 H new ATOM 0 HA2 GLY A 139 7.003 2.473 -6.298 1.00 0.00 H new ATOM 0 HA3 GLY A 139 5.661 2.863 -5.240 1.00 0.00 H new ATOM 2137 N VAL A 140 7.242 4.504 -3.694 1.00 0.00 N ATOM 2138 CA VAL A 140 7.787 5.783 -3.257 1.00 0.00 C ATOM 2139 C VAL A 140 9.174 5.619 -2.651 1.00 0.00 C ATOM 2140 O VAL A 140 9.799 6.598 -2.259 1.00 0.00 O ATOM 2141 CB VAL A 140 6.860 6.469 -2.233 1.00 0.00 C ATOM 2142 CG1 VAL A 140 5.544 6.868 -2.882 1.00 0.00 C ATOM 2143 CG2 VAL A 140 6.613 5.558 -1.039 1.00 0.00 C ATOM 0 H VAL A 140 6.745 3.987 -2.969 1.00 0.00 H new ATOM 0 HA VAL A 140 7.862 6.412 -4.144 1.00 0.00 H new ATOM 0 HB VAL A 140 7.354 7.373 -1.878 1.00 0.00 H new ATOM 0 HG11 VAL A 140 4.905 7.350 -2.142 1.00 0.00 H new ATOM 0 HG12 VAL A 140 5.738 7.561 -3.701 1.00 0.00 H new ATOM 0 HG13 VAL A 140 5.045 5.979 -3.269 1.00 0.00 H new ATOM 0 HG21 VAL A 140 5.957 6.060 -0.328 1.00 0.00 H new ATOM 0 HG22 VAL A 140 6.143 4.634 -1.377 1.00 0.00 H new ATOM 0 HG23 VAL A 140 7.562 5.326 -0.556 1.00 0.00 H new ATOM 2153 N ALA A 141 9.641 4.370 -2.596 1.00 0.00 N ATOM 2154 CA ALA A 141 10.945 4.032 -2.019 1.00 0.00 C ATOM 2155 C ALA A 141 10.947 4.223 -0.503 1.00 0.00 C ATOM 2156 O ALA A 141 11.171 5.323 0.002 1.00 0.00 O ATOM 2157 CB ALA A 141 12.070 4.829 -2.672 1.00 0.00 C ATOM 0 H ALA A 141 9.126 3.564 -2.950 1.00 0.00 H new ATOM 0 HA ALA A 141 11.127 2.977 -2.224 1.00 0.00 H new ATOM 0 HB1 ALA A 141 13.022 4.552 -2.219 1.00 0.00 H new ATOM 0 HB2 ALA A 141 12.099 4.610 -3.739 1.00 0.00 H new ATOM 0 HB3 ALA A 141 11.894 5.895 -2.525 1.00 0.00 H new ATOM 2163 N LYS A 142 10.675 3.129 0.203 1.00 0.00 N ATOM 2164 CA LYS A 142 10.621 3.110 1.665 1.00 0.00 C ATOM 2165 C LYS A 142 11.871 3.741 2.290 1.00 0.00 C ATOM 2166 O LYS A 142 12.980 3.603 1.754 1.00 0.00 O ATOM 2167 CB LYS A 142 10.465 1.661 2.167 1.00 0.00 C ATOM 2168 CG LYS A 142 11.753 0.838 2.148 1.00 0.00 C ATOM 2169 CD LYS A 142 12.264 0.592 0.736 1.00 0.00 C ATOM 2170 CE LYS A 142 13.719 0.148 0.743 1.00 0.00 C ATOM 2171 NZ LYS A 142 14.608 1.190 1.326 1.00 0.00 N ATOM 0 H LYS A 142 10.484 2.223 -0.225 1.00 0.00 H new ATOM 0 HA LYS A 142 9.758 3.702 1.971 1.00 0.00 H new ATOM 0 HB2 LYS A 142 10.079 1.683 3.186 1.00 0.00 H new ATOM 0 HB3 LYS A 142 9.718 1.157 1.554 1.00 0.00 H new ATOM 0 HG2 LYS A 142 12.520 1.356 2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 142 11.577 -0.119 2.639 1.00 0.00 H new ATOM 0 HD2 LYS A 142 11.652 -0.170 0.253 1.00 0.00 H new ATOM 0 HD3 LYS A 142 12.163 1.503 0.147 1.00 0.00 H new ATOM 0 HE2 LYS A 142 13.815 -0.775 1.315 1.00 0.00 H new ATOM 0 HE3 LYS A 142 14.037 -0.074 -0.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 15.391 1.385 0.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 14.064 2.062 1.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 14.991 0.852 2.232 1.00 0.00 H new ATOM 2185 N GLU A 143 11.674 4.425 3.422 1.00 0.00 N ATOM 2186 CA GLU A 143 12.765 5.055 4.174 1.00 0.00 C ATOM 2187 C GLU A 143 13.336 6.260 3.422 1.00 0.00 C ATOM 2188 O GLU A 143 13.066 7.406 3.777 1.00 0.00 O ATOM 2189 CB GLU A 143 13.874 4.035 4.468 1.00 0.00 C ATOM 2190 CG GLU A 143 15.137 4.636 5.062 1.00 0.00 C ATOM 2191 CD GLU A 143 16.306 3.678 5.007 1.00 0.00 C ATOM 2192 OE1 GLU A 143 16.459 2.977 3.982 1.00 0.00 O ATOM 2193 OE2 GLU A 143 17.089 3.626 5.976 1.00 0.00 O ATOM 0 H GLU A 143 10.754 4.558 3.843 1.00 0.00 H new ATOM 0 HA GLU A 143 12.356 5.412 5.119 1.00 0.00 H new ATOM 0 HB2 GLU A 143 13.486 3.283 5.155 1.00 0.00 H new ATOM 0 HB3 GLU A 143 14.132 3.520 3.543 1.00 0.00 H new ATOM 0 HG2 GLU A 143 15.392 5.548 4.523 1.00 0.00 H new ATOM 0 HG3 GLU A 143 14.950 4.919 6.098 1.00 0.00 H new ATOM 2200 N GLU A 144 14.118 5.980 2.387 1.00 0.00 N ATOM 2201 CA GLU A 144 14.738 7.006 1.563 1.00 0.00 C ATOM 2202 C GLU A 144 15.522 6.343 0.442 1.00 0.00 C ATOM 2203 O GLU A 144 16.665 5.920 0.635 1.00 0.00 O ATOM 2204 CB GLU A 144 15.669 7.910 2.380 1.00 0.00 C ATOM 2205 CG GLU A 144 16.222 9.086 1.586 1.00 0.00 C ATOM 2206 CD GLU A 144 17.188 9.930 2.388 1.00 0.00 C ATOM 2207 OE1 GLU A 144 16.732 10.737 3.220 1.00 0.00 O ATOM 2208 OE2 GLU A 144 18.414 9.799 2.179 1.00 0.00 O ATOM 0 H GLU A 144 14.340 5.028 2.095 1.00 0.00 H new ATOM 0 HA GLU A 144 13.947 7.633 1.152 1.00 0.00 H new ATOM 0 HB2 GLU A 144 15.127 8.289 3.246 1.00 0.00 H new ATOM 0 HB3 GLU A 144 16.500 7.315 2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 144 16.726 8.712 0.695 1.00 0.00 H new ATOM 0 HG3 GLU A 144 15.396 9.711 1.247 1.00 0.00 H new