USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1018 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 47 ASN : amide:sc= -0.443 K(o=-2,f=-2.6) USER MOD Set 1.2: A 75 GLN : amide:sc= -1.57 X(o=-2,f=-2.5) USER MOD Set 2.1: A 49 HIS : no HD1:sc= -0.225 X(o=-0.045,f=-0.046) USER MOD Set 2.2: A 52 SER OG : rot 173:sc= 0.18 USER MOD Set 3.1: A 42 SER OG : rot -104:sc= -0.471! USER MOD Set 3.2: A 71 HIS : no HE2:sc= -1.97! C(o=-2.4!,f=-5.7!) USER MOD Set 4.1: A 8 THR OG1 : rot -130:sc= -0.445 USER MOD Set 4.2: A 41 THR OG1 : rot 180:sc= -0.0159 USER MOD Set 4.3: A 80 HIS : no HD1:sc= -2.09 X(o=-2.6,f=-2.6) USER MOD Set 5.1: A 27 GLN : amide:sc= -0.208 X(o=-0.21,f=-0.55) USER MOD Set 5.2: A 31 HIS : no HD1:sc= 0 X(o=-0.21,f=-0.21) USER MOD Set 6.1: A 28 GLN : amide:sc= -0.128 K(o=-0.22,f=-3.6) USER MOD Set 6.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Set 6.3: A 150 HIS : no HD1:sc= -0.0904 K(o=-0.22,f=-4) USER MOD Set 7.1: A 11 CYS SG : rot -120:sc= -0.287 USER MOD Set 7.2: A 12 THR OG1 : rot 180:sc= 0.0618 USER MOD Set 7.3: A 16 CYS SG : rot 180:sc= -0.0756 USER MOD Set 7.4: A 45 THR OG1 : rot 140:sc= 0.00827 USER MOD Set 7.5: A 93 HIS : no HE2:sc= -4.27 K(o=-4.6,f=-5.7!) USER MOD Single : A 6 HIS : no HE2:sc= -0.131 X(o=-0.13,f=-0.21) USER MOD Single : A 14 ASN : amide:sc= -10.7! C(o=-11!,f=-8.7!) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl -141:sc= -2.27 (180deg=-3.34!) USER MOD Single : A 23 LYS NZ :NH3+ 176:sc= 1.14 (180deg=1.04) USER MOD Single : A 24 MET CE :methyl 171:sc= -1.47 (180deg=-1.59) USER MOD Single : A 53 CYS SG : rot 41:sc= 0.713 USER MOD Single : A 65 HIS : no HD1:sc= -0.369 K(o=-0.37,f=-2.8!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0174 K(o=-0.017,f=-1) USER MOD Single : A 99 GLN : amide:sc= -0.0135 K(o=-0.013,f=-0.79) USER MOD Single : A 109 MET CE :methyl -148:sc= -0.451 (180deg=-3.53!) USER MOD Single : A 112 SER OG : rot -10:sc= 0.755 USER MOD Single : A 144 SER OG : rot -81:sc= 1.19 USER MOD ----------------------------------------------------------------- ATOM 50 N PRO A 4 -6.225 21.155 -17.416 1.00 1.00 N ATOM 51 CA PRO A 4 -5.999 21.729 -16.095 1.00 1.00 C ATOM 52 C PRO A 4 -4.821 22.693 -16.043 1.00 1.00 C ATOM 53 O PRO A 4 -3.970 22.721 -16.936 1.00 1.00 O ATOM 54 CB PRO A 4 -5.696 20.514 -15.215 1.00 1.00 C ATOM 55 CG PRO A 4 -5.281 19.430 -16.149 1.00 1.00 C ATOM 56 CD PRO A 4 -5.911 19.723 -17.471 1.00 1.00 C ATOM 0 HA PRO A 4 -6.862 22.316 -15.781 1.00 1.00 H new ATOM 0 HB2 PRO A 4 -4.905 20.737 -14.499 1.00 1.00 H new ATOM 0 HB3 PRO A 4 -6.573 20.220 -14.639 1.00 1.00 H new ATOM 0 HG2 PRO A 4 -4.195 19.394 -16.239 1.00 1.00 H new ATOM 0 HG3 PRO A 4 -5.602 18.457 -15.777 1.00 1.00 H new ATOM 0 HD2 PRO A 4 -5.233 19.496 -18.293 1.00 1.00 H new ATOM 0 HD3 PRO A 4 -6.809 19.125 -17.624 1.00 1.00 H new ATOM 64 N LEU A 5 -4.789 23.477 -14.973 1.00 1.00 N ATOM 65 CA LEU A 5 -3.700 24.402 -14.706 1.00 1.00 C ATOM 66 C LEU A 5 -2.428 23.612 -14.385 1.00 1.00 C ATOM 67 O LEU A 5 -2.456 22.387 -14.320 1.00 1.00 O ATOM 68 CB LEU A 5 -4.094 25.294 -13.519 1.00 1.00 C ATOM 69 CG LEU A 5 -3.926 26.809 -13.705 1.00 1.00 C ATOM 70 CD1 LEU A 5 -2.461 27.203 -13.747 1.00 1.00 C ATOM 71 CD2 LEU A 5 -4.639 27.275 -14.963 1.00 1.00 C ATOM 0 H LEU A 5 -5.522 23.488 -14.264 1.00 1.00 H new ATOM 0 HA LEU A 5 -3.509 25.027 -15.579 1.00 1.00 H new ATOM 0 HB2 LEU A 5 -5.138 25.095 -13.277 1.00 1.00 H new ATOM 0 HB3 LEU A 5 -3.503 24.990 -12.655 1.00 1.00 H new ATOM 0 HG LEU A 5 -4.379 27.301 -12.844 1.00 1.00 H new ATOM 0 HD11 LEU A 5 -2.378 28.282 -13.880 1.00 1.00 H new ATOM 0 HD12 LEU A 5 -1.980 26.914 -12.813 1.00 1.00 H new ATOM 0 HD13 LEU A 5 -1.972 26.696 -14.579 1.00 1.00 H new ATOM 0 HD21 LEU A 5 -4.509 28.351 -15.078 1.00 1.00 H new ATOM 0 HD22 LEU A 5 -4.219 26.764 -15.830 1.00 1.00 H new ATOM 0 HD23 LEU A 5 -5.702 27.045 -14.886 1.00 1.00 H new ATOM 83 N HIS A 6 -1.333 24.304 -14.128 1.00 1.00 N ATOM 84 CA HIS A 6 -0.072 23.639 -13.828 1.00 1.00 C ATOM 85 C HIS A 6 0.821 24.565 -13.025 1.00 1.00 C ATOM 86 O HIS A 6 1.541 25.376 -13.588 1.00 1.00 O ATOM 87 CB HIS A 6 0.636 23.233 -15.122 1.00 1.00 C ATOM 88 CG HIS A 6 1.380 21.933 -15.046 1.00 1.00 C ATOM 89 ND1 HIS A 6 1.931 21.323 -16.153 1.00 1.00 N ATOM 90 CD2 HIS A 6 1.679 21.134 -13.994 1.00 1.00 C ATOM 91 CE1 HIS A 6 2.534 20.212 -15.787 1.00 1.00 C ATOM 92 NE2 HIS A 6 2.399 20.069 -14.482 1.00 1.00 N ATOM 0 H HIS A 6 -1.288 25.323 -14.120 1.00 1.00 H new ATOM 0 HA HIS A 6 -0.280 22.742 -13.244 1.00 1.00 H new ATOM 0 HB2 HIS A 6 -0.104 23.167 -15.920 1.00 1.00 H new ATOM 0 HB3 HIS A 6 1.336 24.021 -15.400 1.00 1.00 H new ATOM 0 HD1 HIS A 6 1.879 21.678 -17.108 1.00 1.00 H new ATOM 0 HD2 HIS A 6 1.403 21.302 -12.963 1.00 1.00 H new ATOM 0 HE1 HIS A 6 3.053 19.531 -16.445 1.00 1.00 H new ATOM 101 N VAL A 7 0.670 24.531 -11.716 1.00 1.00 N ATOM 102 CA VAL A 7 1.495 25.345 -10.837 1.00 1.00 C ATOM 103 C VAL A 7 2.702 24.538 -10.387 1.00 1.00 C ATOM 104 O VAL A 7 2.558 23.549 -9.677 1.00 1.00 O ATOM 105 CB VAL A 7 0.733 25.813 -9.581 1.00 1.00 C ATOM 106 CG1 VAL A 7 1.379 27.052 -9.001 1.00 1.00 C ATOM 107 CG2 VAL A 7 -0.740 26.052 -9.868 1.00 1.00 C ATOM 0 H VAL A 7 -0.016 23.949 -11.235 1.00 1.00 H new ATOM 0 HA VAL A 7 1.794 26.226 -11.404 1.00 1.00 H new ATOM 0 HB VAL A 7 0.790 25.013 -8.843 1.00 1.00 H new ATOM 0 HG11 VAL A 7 0.828 27.369 -8.115 1.00 1.00 H new ATOM 0 HG12 VAL A 7 2.410 26.830 -8.727 1.00 1.00 H new ATOM 0 HG13 VAL A 7 1.364 27.851 -9.742 1.00 1.00 H new ATOM 0 HG21 VAL A 7 -1.240 26.380 -8.957 1.00 1.00 H new ATOM 0 HG22 VAL A 7 -0.841 26.820 -10.634 1.00 1.00 H new ATOM 0 HG23 VAL A 7 -1.197 25.127 -10.219 1.00 1.00 H new ATOM 117 N THR A 8 3.869 24.892 -10.887 1.00 1.00 N ATOM 118 CA THR A 8 5.090 24.207 -10.513 1.00 1.00 C ATOM 119 C THR A 8 5.983 25.119 -9.667 1.00 1.00 C ATOM 120 O THR A 8 6.486 26.130 -10.146 1.00 1.00 O ATOM 121 CB THR A 8 5.845 23.701 -11.769 1.00 1.00 C ATOM 122 OG1 THR A 8 7.030 22.992 -11.383 1.00 1.00 O ATOM 123 CG2 THR A 8 6.221 24.842 -12.711 1.00 1.00 C ATOM 0 H THR A 8 3.998 25.652 -11.555 1.00 1.00 H new ATOM 0 HA THR A 8 4.824 23.339 -9.910 1.00 1.00 H new ATOM 0 HB THR A 8 5.169 23.033 -12.302 1.00 1.00 H new ATOM 0 HG1 THR A 8 7.796 23.335 -11.890 1.00 1.00 H new ATOM 0 HG21 THR A 8 6.748 24.441 -13.577 1.00 1.00 H new ATOM 0 HG22 THR A 8 5.317 25.354 -13.042 1.00 1.00 H new ATOM 0 HG23 THR A 8 6.867 25.548 -12.188 1.00 1.00 H new ATOM 131 N PHE A 9 6.138 24.789 -8.392 1.00 1.00 N ATOM 132 CA PHE A 9 6.966 25.601 -7.499 1.00 1.00 C ATOM 133 C PHE A 9 8.423 25.226 -7.672 1.00 1.00 C ATOM 134 O PHE A 9 8.760 24.046 -7.724 1.00 1.00 O ATOM 135 CB PHE A 9 6.569 25.407 -6.039 1.00 1.00 C ATOM 136 CG PHE A 9 5.128 25.076 -5.853 1.00 1.00 C ATOM 137 CD1 PHE A 9 4.148 26.039 -6.018 1.00 1.00 C ATOM 138 CD2 PHE A 9 4.759 23.791 -5.526 1.00 1.00 C ATOM 139 CE1 PHE A 9 2.824 25.718 -5.854 1.00 1.00 C ATOM 140 CE2 PHE A 9 3.438 23.464 -5.362 1.00 1.00 C ATOM 141 CZ PHE A 9 2.467 24.428 -5.528 1.00 1.00 C ATOM 0 H PHE A 9 5.708 23.975 -7.953 1.00 1.00 H new ATOM 0 HA PHE A 9 6.813 26.648 -7.761 1.00 1.00 H new ATOM 0 HB2 PHE A 9 7.175 24.610 -5.609 1.00 1.00 H new ATOM 0 HB3 PHE A 9 6.799 26.317 -5.484 1.00 1.00 H new ATOM 0 HD1 PHE A 9 4.427 27.050 -6.277 1.00 1.00 H new ATOM 0 HD2 PHE A 9 5.518 23.033 -5.397 1.00 1.00 H new ATOM 0 HE1 PHE A 9 2.064 26.475 -5.980 1.00 1.00 H new ATOM 0 HE2 PHE A 9 3.159 22.453 -5.103 1.00 1.00 H new ATOM 0 HZ PHE A 9 1.425 24.172 -5.402 1.00 1.00 H new ATOM 151 N VAL A 10 9.288 26.223 -7.727 1.00 1.00 N ATOM 152 CA VAL A 10 10.703 25.995 -7.950 1.00 1.00 C ATOM 153 C VAL A 10 11.548 26.617 -6.847 1.00 1.00 C ATOM 154 O VAL A 10 11.605 27.844 -6.703 1.00 1.00 O ATOM 155 CB VAL A 10 11.137 26.592 -9.296 1.00 1.00 C ATOM 156 CG1 VAL A 10 12.595 26.295 -9.568 1.00 1.00 C ATOM 157 CG2 VAL A 10 10.260 26.074 -10.422 1.00 1.00 C ATOM 0 H VAL A 10 9.032 27.204 -7.619 1.00 1.00 H new ATOM 0 HA VAL A 10 10.859 24.916 -7.952 1.00 1.00 H new ATOM 0 HB VAL A 10 11.016 27.674 -9.244 1.00 1.00 H new ATOM 0 HG11 VAL A 10 12.882 26.727 -10.527 1.00 1.00 H new ATOM 0 HG12 VAL A 10 13.208 26.727 -8.777 1.00 1.00 H new ATOM 0 HG13 VAL A 10 12.747 25.216 -9.596 1.00 1.00 H new ATOM 0 HG21 VAL A 10 10.585 26.510 -11.367 1.00 1.00 H new ATOM 0 HG22 VAL A 10 10.341 24.988 -10.476 1.00 1.00 H new ATOM 0 HG23 VAL A 10 9.223 26.351 -10.232 1.00 1.00 H new ATOM 167 N CYS A 11 12.232 25.771 -6.095 1.00 1.00 N ATOM 168 CA CYS A 11 13.094 26.230 -5.024 1.00 1.00 C ATOM 169 C CYS A 11 14.297 25.307 -4.889 1.00 1.00 C ATOM 170 O CYS A 11 14.225 24.134 -5.255 1.00 1.00 O ATOM 171 CB CYS A 11 12.317 26.274 -3.707 1.00 1.00 C ATOM 172 SG CYS A 11 13.244 26.962 -2.318 1.00 1.00 S ATOM 0 H CYS A 11 12.205 24.758 -6.209 1.00 1.00 H new ATOM 0 HA CYS A 11 13.445 27.234 -5.261 1.00 1.00 H new ATOM 0 HB2 CYS A 11 11.412 26.864 -3.852 1.00 1.00 H new ATOM 0 HB3 CYS A 11 12.000 25.263 -3.452 1.00 1.00 H new ATOM 0 HG CYS A 11 13.337 26.072 -1.375 1.00 1.00 H new ATOM 178 N THR A 12 15.401 25.842 -4.387 1.00 1.00 N ATOM 179 CA THR A 12 16.599 25.056 -4.174 1.00 1.00 C ATOM 180 C THR A 12 16.390 24.096 -3.004 1.00 1.00 C ATOM 181 O THR A 12 16.389 24.505 -1.846 1.00 1.00 O ATOM 182 CB THR A 12 17.808 25.963 -3.909 1.00 1.00 C ATOM 183 OG1 THR A 12 17.360 27.198 -3.336 1.00 1.00 O ATOM 184 CG2 THR A 12 18.572 26.241 -5.194 1.00 1.00 C ATOM 0 H THR A 12 15.488 26.823 -4.120 1.00 1.00 H new ATOM 0 HA THR A 12 16.800 24.479 -5.077 1.00 1.00 H new ATOM 0 HB THR A 12 18.479 25.455 -3.216 1.00 1.00 H new ATOM 0 HG1 THR A 12 18.131 27.778 -3.165 1.00 1.00 H new ATOM 0 HG21 THR A 12 19.424 26.886 -4.979 1.00 1.00 H new ATOM 0 HG22 THR A 12 18.926 25.301 -5.617 1.00 1.00 H new ATOM 0 HG23 THR A 12 17.914 26.736 -5.909 1.00 1.00 H new ATOM 192 N GLY A 13 16.069 22.855 -3.330 1.00 1.00 N ATOM 193 CA GLY A 13 15.816 21.855 -2.314 1.00 1.00 C ATOM 194 C GLY A 13 14.693 20.938 -2.738 1.00 1.00 C ATOM 195 O GLY A 13 14.771 19.723 -2.551 1.00 1.00 O ATOM 0 H GLY A 13 15.978 22.519 -4.289 1.00 1.00 H new ATOM 0 HA2 GLY A 13 16.720 21.273 -2.136 1.00 1.00 H new ATOM 0 HA3 GLY A 13 15.560 22.342 -1.373 1.00 1.00 H new ATOM 199 N ASN A 14 13.663 21.547 -3.342 1.00 1.00 N ATOM 200 CA ASN A 14 12.474 20.851 -3.880 1.00 1.00 C ATOM 201 C ASN A 14 11.845 19.869 -2.883 1.00 1.00 C ATOM 202 O ASN A 14 11.071 18.985 -3.263 1.00 1.00 O ATOM 203 CB ASN A 14 12.755 20.173 -5.249 1.00 1.00 C ATOM 204 CG ASN A 14 14.128 19.528 -5.385 1.00 1.00 C ATOM 205 OD1 ASN A 14 15.104 20.184 -5.756 1.00 1.00 O ATOM 206 ND2 ASN A 14 14.215 18.239 -5.112 1.00 1.00 N ATOM 0 H ASN A 14 13.627 22.558 -3.476 1.00 1.00 H new ATOM 0 HA ASN A 14 11.733 21.632 -4.050 1.00 1.00 H new ATOM 0 HB2 ASN A 14 11.995 19.411 -5.422 1.00 1.00 H new ATOM 0 HB3 ASN A 14 12.643 20.919 -6.036 1.00 1.00 H new ATOM 0 HD21 ASN A 14 15.109 17.757 -5.206 1.00 1.00 H new ATOM 0 HD22 ASN A 14 13.388 17.725 -4.807 1.00 1.00 H new ATOM 213 N ILE A 15 12.091 20.100 -1.597 1.00 1.00 N ATOM 214 CA ILE A 15 11.525 19.277 -0.529 1.00 1.00 C ATOM 215 C ILE A 15 11.118 20.143 0.650 1.00 1.00 C ATOM 216 O ILE A 15 10.676 19.644 1.676 1.00 1.00 O ATOM 217 CB ILE A 15 12.529 18.221 -0.024 1.00 1.00 C ATOM 218 CG1 ILE A 15 13.854 18.893 0.348 1.00 1.00 C ATOM 219 CG2 ILE A 15 12.756 17.156 -1.080 1.00 1.00 C ATOM 220 CD1 ILE A 15 14.628 18.179 1.437 1.00 1.00 C ATOM 0 H ILE A 15 12.686 20.859 -1.265 1.00 1.00 H new ATOM 0 HA ILE A 15 10.656 18.771 -0.950 1.00 1.00 H new ATOM 0 HB ILE A 15 12.116 17.742 0.863 1.00 1.00 H new ATOM 0 HG12 ILE A 15 14.478 18.958 -0.543 1.00 1.00 H new ATOM 0 HG13 ILE A 15 13.652 19.914 0.671 1.00 1.00 H new ATOM 0 HG21 ILE A 15 13.467 16.419 -0.707 1.00 1.00 H new ATOM 0 HG22 ILE A 15 11.811 16.664 -1.310 1.00 1.00 H new ATOM 0 HG23 ILE A 15 13.153 17.618 -1.984 1.00 1.00 H new ATOM 0 HD11 ILE A 15 15.553 18.719 1.640 1.00 1.00 H new ATOM 0 HD12 ILE A 15 14.025 18.137 2.344 1.00 1.00 H new ATOM 0 HD13 ILE A 15 14.864 17.166 1.111 1.00 1.00 H new ATOM 232 N CYS A 16 11.154 21.446 0.443 1.00 1.00 N ATOM 233 CA CYS A 16 10.860 22.387 1.508 1.00 1.00 C ATOM 234 C CYS A 16 9.705 23.317 1.140 1.00 1.00 C ATOM 235 O CYS A 16 8.548 22.965 1.324 1.00 1.00 O ATOM 236 CB CYS A 16 12.118 23.186 1.831 1.00 1.00 C ATOM 237 SG CYS A 16 12.975 23.829 0.369 1.00 1.00 S ATOM 0 H CYS A 16 11.384 21.877 -0.452 1.00 1.00 H new ATOM 0 HA CYS A 16 10.546 21.828 2.389 1.00 1.00 H new ATOM 0 HB2 CYS A 16 11.850 24.020 2.479 1.00 1.00 H new ATOM 0 HB3 CYS A 16 12.804 22.553 2.393 1.00 1.00 H new ATOM 0 HG CYS A 16 14.028 24.495 0.741 1.00 1.00 H new ATOM 243 N ARG A 17 10.017 24.427 0.484 1.00 1.00 N ATOM 244 CA ARG A 17 9.014 25.442 0.166 1.00 1.00 C ATOM 245 C ARG A 17 7.998 24.918 -0.846 1.00 1.00 C ATOM 246 O ARG A 17 6.780 25.031 -0.648 1.00 1.00 O ATOM 247 CB ARG A 17 9.700 26.689 -0.393 1.00 1.00 C ATOM 248 CG ARG A 17 11.012 27.033 0.296 1.00 1.00 C ATOM 249 CD ARG A 17 10.826 27.362 1.767 1.00 1.00 C ATOM 250 NE ARG A 17 10.209 28.674 1.969 1.00 1.00 N ATOM 251 CZ ARG A 17 10.807 29.683 2.609 1.00 1.00 C ATOM 252 NH1 ARG A 17 12.032 29.535 3.087 1.00 1.00 N ATOM 253 NH2 ARG A 17 10.176 30.837 2.784 1.00 1.00 N ATOM 0 H ARG A 17 10.958 24.650 0.160 1.00 1.00 H new ATOM 0 HA ARG A 17 8.483 25.693 1.084 1.00 1.00 H new ATOM 0 HB2 ARG A 17 9.887 26.542 -1.457 1.00 1.00 H new ATOM 0 HB3 ARG A 17 9.021 27.537 -0.303 1.00 1.00 H new ATOM 0 HG2 ARG A 17 11.701 26.194 0.199 1.00 1.00 H new ATOM 0 HG3 ARG A 17 11.472 27.883 -0.208 1.00 1.00 H new ATOM 0 HD2 ARG A 17 10.206 26.596 2.233 1.00 1.00 H new ATOM 0 HD3 ARG A 17 11.794 27.337 2.268 1.00 1.00 H new ATOM 0 HE ARG A 17 9.270 28.826 1.601 1.00 1.00 H new ATOM 0 HH11 ARG A 17 12.523 28.649 2.967 1.00 1.00 H new ATOM 0 HH12 ARG A 17 12.486 30.307 3.575 1.00 1.00 H new ATOM 0 HH21 ARG A 17 9.228 30.959 2.429 1.00 1.00 H new ATOM 0 HH22 ARG A 17 10.639 31.602 3.274 1.00 1.00 H new ATOM 267 N SER A 18 8.522 24.327 -1.916 1.00 1.00 N ATOM 268 CA SER A 18 7.710 23.777 -2.998 1.00 1.00 C ATOM 269 C SER A 18 6.627 22.807 -2.485 1.00 1.00 C ATOM 270 O SER A 18 5.437 23.071 -2.664 1.00 1.00 O ATOM 271 CB SER A 18 8.624 23.086 -4.021 1.00 1.00 C ATOM 272 OG SER A 18 9.701 23.930 -4.397 1.00 1.00 O ATOM 0 H SER A 18 9.526 24.215 -2.058 1.00 1.00 H new ATOM 0 HA SER A 18 7.183 24.602 -3.477 1.00 1.00 H new ATOM 0 HB2 SER A 18 9.014 22.160 -3.598 1.00 1.00 H new ATOM 0 HB3 SER A 18 8.046 22.814 -4.904 1.00 1.00 H new ATOM 0 HG SER A 18 10.269 23.466 -5.047 1.00 1.00 H new ATOM 278 N PRO A 19 7.000 21.715 -1.774 1.00 1.00 N ATOM 279 CA PRO A 19 6.019 20.732 -1.290 1.00 1.00 C ATOM 280 C PRO A 19 5.090 21.297 -0.224 1.00 1.00 C ATOM 281 O PRO A 19 3.974 20.817 -0.072 1.00 1.00 O ATOM 282 CB PRO A 19 6.884 19.615 -0.713 1.00 1.00 C ATOM 283 CG PRO A 19 8.146 20.282 -0.329 1.00 1.00 C ATOM 284 CD PRO A 19 8.366 21.377 -1.330 1.00 1.00 C ATOM 0 HA PRO A 19 5.354 20.404 -2.089 1.00 1.00 H new ATOM 0 HB2 PRO A 19 6.405 19.147 0.147 1.00 1.00 H new ATOM 0 HB3 PRO A 19 7.059 18.829 -1.448 1.00 1.00 H new ATOM 0 HG2 PRO A 19 8.080 20.686 0.681 1.00 1.00 H new ATOM 0 HG3 PRO A 19 8.977 19.576 -0.336 1.00 1.00 H new ATOM 0 HD2 PRO A 19 8.867 22.236 -0.883 1.00 1.00 H new ATOM 0 HD3 PRO A 19 8.987 21.043 -2.161 1.00 1.00 H new ATOM 292 N MET A 20 5.527 22.344 0.469 1.00 1.00 N ATOM 293 CA MET A 20 4.696 22.974 1.491 1.00 1.00 C ATOM 294 C MET A 20 3.406 23.480 0.869 1.00 1.00 C ATOM 295 O MET A 20 2.324 22.969 1.155 1.00 1.00 O ATOM 296 CB MET A 20 5.433 24.140 2.143 1.00 1.00 C ATOM 297 CG MET A 20 6.494 23.729 3.148 1.00 1.00 C ATOM 298 SD MET A 20 5.817 23.305 4.753 1.00 1.00 S ATOM 299 CE MET A 20 5.060 24.860 5.203 1.00 1.00 C ATOM 0 H MET A 20 6.444 22.772 0.344 1.00 1.00 H new ATOM 0 HA MET A 20 4.469 22.229 2.254 1.00 1.00 H new ATOM 0 HB2 MET A 20 5.902 24.739 1.363 1.00 1.00 H new ATOM 0 HB3 MET A 20 4.706 24.780 2.642 1.00 1.00 H new ATOM 0 HG2 MET A 20 7.046 22.875 2.756 1.00 1.00 H new ATOM 0 HG3 MET A 20 7.209 24.543 3.266 1.00 1.00 H new ATOM 0 HE1 MET A 20 5.212 25.045 6.266 1.00 1.00 H new ATOM 0 HE2 MET A 20 5.514 25.666 4.626 1.00 1.00 H new ATOM 0 HE3 MET A 20 3.992 24.819 4.991 1.00 1.00 H new ATOM 309 N ALA A 21 3.551 24.334 -0.133 1.00 1.00 N ATOM 310 CA ALA A 21 2.376 24.899 -0.794 1.00 1.00 C ATOM 311 C ALA A 21 1.705 23.860 -1.672 1.00 1.00 C ATOM 312 O ALA A 21 0.487 23.893 -1.859 1.00 1.00 O ATOM 313 CB ALA A 21 2.726 26.118 -1.620 1.00 1.00 C ATOM 0 H ALA A 21 4.448 24.648 -0.503 1.00 1.00 H new ATOM 0 HA ALA A 21 1.685 25.209 -0.010 1.00 1.00 H new ATOM 0 HB1 ALA A 21 1.825 26.507 -2.094 1.00 1.00 H new ATOM 0 HB2 ALA A 21 3.156 26.884 -0.974 1.00 1.00 H new ATOM 0 HB3 ALA A 21 3.450 25.842 -2.387 1.00 1.00 H new ATOM 319 N GLU A 22 2.502 22.906 -2.143 1.00 1.00 N ATOM 320 CA GLU A 22 2.019 21.844 -3.013 1.00 1.00 C ATOM 321 C GLU A 22 0.819 21.156 -2.376 1.00 1.00 C ATOM 322 O GLU A 22 -0.285 21.242 -2.876 1.00 1.00 O ATOM 323 CB GLU A 22 3.141 20.827 -3.269 1.00 1.00 C ATOM 324 CG GLU A 22 3.027 20.091 -4.595 1.00 1.00 C ATOM 325 CD GLU A 22 4.037 18.968 -4.721 1.00 1.00 C ATOM 326 OE1 GLU A 22 3.954 17.994 -3.956 1.00 1.00 O ATOM 327 OE2 GLU A 22 4.908 19.043 -5.609 1.00 1.00 O ATOM 0 H GLU A 22 3.498 22.849 -1.932 1.00 1.00 H new ATOM 0 HA GLU A 22 1.711 22.275 -3.966 1.00 1.00 H new ATOM 0 HB2 GLU A 22 4.100 21.345 -3.235 1.00 1.00 H new ATOM 0 HB3 GLU A 22 3.145 20.096 -2.460 1.00 1.00 H new ATOM 0 HG2 GLU A 22 2.021 19.684 -4.696 1.00 1.00 H new ATOM 0 HG3 GLU A 22 3.169 20.797 -5.413 1.00 1.00 H new ATOM 334 N LYS A 23 0.993 20.722 -1.144 1.00 1.00 N ATOM 335 CA LYS A 23 -0.064 19.984 -0.474 1.00 1.00 C ATOM 336 C LYS A 23 -1.051 20.930 0.175 1.00 1.00 C ATOM 337 O LYS A 23 -2.212 20.595 0.332 1.00 1.00 O ATOM 338 CB LYS A 23 0.487 19.018 0.571 1.00 1.00 C ATOM 339 CG LYS A 23 1.997 18.941 0.610 1.00 1.00 C ATOM 340 CD LYS A 23 2.513 17.568 0.240 1.00 1.00 C ATOM 341 CE LYS A 23 3.068 17.549 -1.168 1.00 1.00 C ATOM 342 NZ LYS A 23 2.006 17.537 -2.211 1.00 1.00 N ATOM 0 H LYS A 23 1.839 20.863 -0.593 1.00 1.00 H new ATOM 0 HA LYS A 23 -0.575 19.398 -1.238 1.00 1.00 H new ATOM 0 HB2 LYS A 23 0.124 19.318 1.554 1.00 1.00 H new ATOM 0 HB3 LYS A 23 0.089 18.023 0.375 1.00 1.00 H new ATOM 0 HG2 LYS A 23 2.414 19.680 -0.075 1.00 1.00 H new ATOM 0 HG3 LYS A 23 2.346 19.200 1.610 1.00 1.00 H new ATOM 0 HD2 LYS A 23 3.290 17.268 0.943 1.00 1.00 H new ATOM 0 HD3 LYS A 23 1.707 16.839 0.325 1.00 1.00 H new ATOM 0 HE2 LYS A 23 3.703 18.423 -1.314 1.00 1.00 H new ATOM 0 HE3 LYS A 23 3.701 16.670 -1.291 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 2.444 17.593 -3.153 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 1.456 16.658 -2.136 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 1.375 18.352 -2.074 1.00 1.00 H new ATOM 356 N MET A 24 -0.597 22.125 0.511 1.00 1.00 N ATOM 357 CA MET A 24 -1.445 23.099 1.181 1.00 1.00 C ATOM 358 C MET A 24 -2.630 23.532 0.323 1.00 1.00 C ATOM 359 O MET A 24 -3.768 23.102 0.545 1.00 1.00 O ATOM 360 CB MET A 24 -0.619 24.302 1.621 1.00 1.00 C ATOM 361 CG MET A 24 0.208 24.016 2.875 1.00 1.00 C ATOM 362 SD MET A 24 1.405 25.304 3.274 1.00 1.00 S ATOM 363 CE MET A 24 0.324 26.656 3.711 1.00 1.00 C ATOM 0 H MET A 24 0.355 22.445 0.331 1.00 1.00 H new ATOM 0 HA MET A 24 -1.863 22.614 2.063 1.00 1.00 H new ATOM 0 HB2 MET A 24 0.047 24.598 0.810 1.00 1.00 H new ATOM 0 HB3 MET A 24 -1.283 25.145 1.812 1.00 1.00 H new ATOM 0 HG2 MET A 24 -0.467 23.887 3.721 1.00 1.00 H new ATOM 0 HG3 MET A 24 0.736 23.072 2.742 1.00 1.00 H new ATOM 0 HE1 MET A 24 0.913 27.471 4.133 1.00 1.00 H new ATOM 0 HE2 MET A 24 -0.197 27.008 2.820 1.00 1.00 H new ATOM 0 HE3 MET A 24 -0.405 26.316 4.447 1.00 1.00 H new ATOM 373 N PHE A 25 -2.379 24.354 -0.679 1.00 1.00 N ATOM 374 CA PHE A 25 -3.473 24.868 -1.474 1.00 1.00 C ATOM 375 C PHE A 25 -3.992 23.830 -2.453 1.00 1.00 C ATOM 376 O PHE A 25 -5.174 23.848 -2.790 1.00 1.00 O ATOM 377 CB PHE A 25 -3.087 26.162 -2.196 1.00 1.00 C ATOM 378 CG PHE A 25 -2.225 25.994 -3.407 1.00 1.00 C ATOM 379 CD1 PHE A 25 -2.778 25.719 -4.653 1.00 1.00 C ATOM 380 CD2 PHE A 25 -0.859 26.136 -3.302 1.00 1.00 C ATOM 381 CE1 PHE A 25 -1.970 25.587 -5.763 1.00 1.00 C ATOM 382 CE2 PHE A 25 -0.056 26.014 -4.405 1.00 1.00 C ATOM 383 CZ PHE A 25 -0.607 25.736 -5.635 1.00 1.00 C ATOM 0 H PHE A 25 -1.450 24.673 -0.956 1.00 1.00 H new ATOM 0 HA PHE A 25 -4.284 25.104 -0.785 1.00 1.00 H new ATOM 0 HB2 PHE A 25 -4.000 26.679 -2.491 1.00 1.00 H new ATOM 0 HB3 PHE A 25 -2.568 26.810 -1.490 1.00 1.00 H new ATOM 0 HD1 PHE A 25 -3.848 25.608 -4.752 1.00 1.00 H new ATOM 0 HD2 PHE A 25 -0.416 26.346 -2.340 1.00 1.00 H new ATOM 0 HE1 PHE A 25 -2.404 25.368 -6.727 1.00 1.00 H new ATOM 0 HE2 PHE A 25 1.013 26.136 -4.309 1.00 1.00 H new ATOM 0 HZ PHE A 25 0.030 25.635 -6.501 1.00 1.00 H new ATOM 393 N ALA A 26 -3.126 22.936 -2.928 1.00 1.00 N ATOM 394 CA ALA A 26 -3.591 21.922 -3.873 1.00 1.00 C ATOM 395 C ALA A 26 -4.603 20.987 -3.223 1.00 1.00 C ATOM 396 O ALA A 26 -5.561 20.553 -3.871 1.00 1.00 O ATOM 397 CB ALA A 26 -2.454 21.138 -4.478 1.00 1.00 C ATOM 0 H ALA A 26 -2.136 22.891 -2.686 1.00 1.00 H new ATOM 0 HA ALA A 26 -4.085 22.455 -4.686 1.00 1.00 H new ATOM 0 HB1 ALA A 26 -2.851 20.398 -5.173 1.00 1.00 H new ATOM 0 HB2 ALA A 26 -1.788 21.816 -5.012 1.00 1.00 H new ATOM 0 HB3 ALA A 26 -1.899 20.633 -3.687 1.00 1.00 H new ATOM 403 N GLN A 27 -4.380 20.659 -1.947 1.00 1.00 N ATOM 404 CA GLN A 27 -5.329 19.834 -1.215 1.00 1.00 C ATOM 405 C GLN A 27 -6.645 20.589 -1.118 1.00 1.00 C ATOM 406 O GLN A 27 -7.720 20.011 -1.278 1.00 1.00 O ATOM 407 CB GLN A 27 -4.795 19.450 0.160 1.00 1.00 C ATOM 408 CG GLN A 27 -5.139 20.411 1.277 1.00 1.00 C ATOM 409 CD GLN A 27 -6.214 19.859 2.172 1.00 1.00 C ATOM 410 OE1 GLN A 27 -7.390 20.197 2.051 1.00 1.00 O ATOM 411 NE2 GLN A 27 -5.811 18.937 3.012 1.00 1.00 N ATOM 0 H GLN A 27 -3.562 20.950 -1.411 1.00 1.00 H new ATOM 0 HA GLN A 27 -5.487 18.897 -1.749 1.00 1.00 H new ATOM 0 HB2 GLN A 27 -5.181 18.464 0.419 1.00 1.00 H new ATOM 0 HB3 GLN A 27 -3.710 19.362 0.099 1.00 1.00 H new ATOM 0 HG2 GLN A 27 -4.246 20.619 1.866 1.00 1.00 H new ATOM 0 HG3 GLN A 27 -5.469 21.359 0.853 1.00 1.00 H new ATOM 0 HE21 GLN A 27 -4.821 18.697 3.070 1.00 1.00 H new ATOM 0 HE22 GLN A 27 -6.487 18.459 3.608 1.00 1.00 H new ATOM 420 N GLN A 28 -6.541 21.903 -0.905 1.00 1.00 N ATOM 421 CA GLN A 28 -7.705 22.774 -0.877 1.00 1.00 C ATOM 422 C GLN A 28 -8.442 22.708 -2.207 1.00 1.00 C ATOM 423 O GLN A 28 -9.666 22.639 -2.246 1.00 1.00 O ATOM 424 CB GLN A 28 -7.284 24.213 -0.584 1.00 1.00 C ATOM 425 CG GLN A 28 -6.633 24.396 0.775 1.00 1.00 C ATOM 426 CD GLN A 28 -6.219 25.832 1.028 1.00 1.00 C ATOM 427 OE1 GLN A 28 -6.808 26.761 0.482 1.00 1.00 O ATOM 428 NE2 GLN A 28 -5.209 26.022 1.861 1.00 1.00 N ATOM 0 H GLN A 28 -5.655 22.383 -0.749 1.00 1.00 H new ATOM 0 HA GLN A 28 -8.373 22.436 -0.085 1.00 1.00 H new ATOM 0 HB2 GLN A 28 -6.590 24.543 -1.357 1.00 1.00 H new ATOM 0 HB3 GLN A 28 -8.160 24.858 -0.647 1.00 1.00 H new ATOM 0 HG2 GLN A 28 -7.327 24.078 1.553 1.00 1.00 H new ATOM 0 HG3 GLN A 28 -5.758 23.750 0.846 1.00 1.00 H new ATOM 0 HE21 GLN A 28 -4.747 25.222 2.293 1.00 1.00 H new ATOM 0 HE22 GLN A 28 -4.892 26.969 2.071 1.00 1.00 H new ATOM 437 N LEU A 29 -7.679 22.716 -3.296 1.00 1.00 N ATOM 438 CA LEU A 29 -8.246 22.656 -4.634 1.00 1.00 C ATOM 439 C LEU A 29 -9.127 21.424 -4.791 1.00 1.00 C ATOM 440 O LEU A 29 -10.312 21.535 -5.083 1.00 1.00 O ATOM 441 CB LEU A 29 -7.141 22.645 -5.689 1.00 1.00 C ATOM 442 CG LEU A 29 -6.216 23.863 -5.673 1.00 1.00 C ATOM 443 CD1 LEU A 29 -5.140 23.728 -6.739 1.00 1.00 C ATOM 444 CD2 LEU A 29 -7.016 25.146 -5.875 1.00 1.00 C ATOM 0 H LEU A 29 -6.660 22.764 -3.274 1.00 1.00 H new ATOM 0 HA LEU A 29 -8.859 23.545 -4.779 1.00 1.00 H new ATOM 0 HB2 LEU A 29 -6.537 21.748 -5.551 1.00 1.00 H new ATOM 0 HB3 LEU A 29 -7.601 22.571 -6.674 1.00 1.00 H new ATOM 0 HG LEU A 29 -5.729 23.914 -4.699 1.00 1.00 H new ATOM 0 HD11 LEU A 29 -4.491 24.603 -6.714 1.00 1.00 H new ATOM 0 HD12 LEU A 29 -4.549 22.832 -6.548 1.00 1.00 H new ATOM 0 HD13 LEU A 29 -5.608 23.652 -7.721 1.00 1.00 H new ATOM 0 HD21 LEU A 29 -6.341 26.002 -5.861 1.00 1.00 H new ATOM 0 HD22 LEU A 29 -7.531 25.106 -6.835 1.00 1.00 H new ATOM 0 HD23 LEU A 29 -7.748 25.248 -5.074 1.00 1.00 H new ATOM 456 N ARG A 30 -8.544 20.249 -4.637 1.00 1.00 N ATOM 457 CA ARG A 30 -9.315 19.013 -4.740 1.00 1.00 C ATOM 458 C ARG A 30 -10.446 18.975 -3.714 1.00 1.00 C ATOM 459 O ARG A 30 -11.532 18.480 -4.007 1.00 1.00 O ATOM 460 CB ARG A 30 -8.413 17.782 -4.637 1.00 1.00 C ATOM 461 CG ARG A 30 -7.370 17.860 -3.541 1.00 1.00 C ATOM 462 CD ARG A 30 -6.009 17.415 -4.058 1.00 1.00 C ATOM 463 NE ARG A 30 -6.037 16.039 -4.571 1.00 1.00 N ATOM 464 CZ ARG A 30 -5.638 15.681 -5.795 1.00 1.00 C ATOM 465 NH1 ARG A 30 -5.155 16.592 -6.636 1.00 1.00 N ATOM 466 NH2 ARG A 30 -5.715 14.411 -6.175 1.00 1.00 N ATOM 0 H ARG A 30 -7.551 20.119 -4.442 1.00 1.00 H new ATOM 0 HA ARG A 30 -9.775 18.993 -5.728 1.00 1.00 H new ATOM 0 HB2 ARG A 30 -9.036 16.904 -4.467 1.00 1.00 H new ATOM 0 HB3 ARG A 30 -7.909 17.635 -5.592 1.00 1.00 H new ATOM 0 HG2 ARG A 30 -7.305 18.881 -3.166 1.00 1.00 H new ATOM 0 HG3 ARG A 30 -7.669 17.231 -2.703 1.00 1.00 H new ATOM 0 HD2 ARG A 30 -5.684 18.090 -4.849 1.00 1.00 H new ATOM 0 HD3 ARG A 30 -5.275 17.488 -3.255 1.00 1.00 H new ATOM 0 HE ARG A 30 -6.384 15.307 -3.951 1.00 1.00 H new ATOM 0 HH11 ARG A 30 -5.088 17.568 -6.347 1.00 1.00 H new ATOM 0 HH12 ARG A 30 -4.852 16.314 -7.569 1.00 1.00 H new ATOM 0 HH21 ARG A 30 -6.079 13.708 -5.532 1.00 1.00 H new ATOM 0 HH22 ARG A 30 -5.410 14.139 -7.110 1.00 1.00 H new ATOM 480 N HIS A 31 -10.198 19.523 -2.527 1.00 1.00 N ATOM 481 CA HIS A 31 -11.225 19.603 -1.483 1.00 1.00 C ATOM 482 C HIS A 31 -12.413 20.475 -1.903 1.00 1.00 C ATOM 483 O HIS A 31 -13.515 20.319 -1.377 1.00 1.00 O ATOM 484 CB HIS A 31 -10.637 20.124 -0.167 1.00 1.00 C ATOM 485 CG HIS A 31 -10.135 19.035 0.733 1.00 1.00 C ATOM 486 ND1 HIS A 31 -10.379 19.002 2.092 1.00 1.00 N ATOM 487 CD2 HIS A 31 -9.407 17.928 0.458 1.00 1.00 C ATOM 488 CE1 HIS A 31 -9.827 17.921 2.609 1.00 1.00 C ATOM 489 NE2 HIS A 31 -9.230 17.251 1.641 1.00 1.00 N ATOM 0 H HIS A 31 -9.296 19.919 -2.261 1.00 1.00 H new ATOM 0 HA HIS A 31 -11.592 18.588 -1.332 1.00 1.00 H new ATOM 0 HB2 HIS A 31 -9.818 20.808 -0.389 1.00 1.00 H new ATOM 0 HB3 HIS A 31 -11.398 20.699 0.360 1.00 1.00 H new ATOM 0 HD2 HIS A 31 -9.034 17.631 -0.511 1.00 1.00 H new ATOM 0 HE1 HIS A 31 -9.858 17.633 3.649 1.00 1.00 H new ATOM 0 HE2 HIS A 31 -8.721 16.374 1.753 1.00 1.00 H new ATOM 498 N ARG A 32 -12.181 21.407 -2.825 1.00 1.00 N ATOM 499 CA ARG A 32 -13.267 22.269 -3.285 1.00 1.00 C ATOM 500 C ARG A 32 -13.807 21.772 -4.616 1.00 1.00 C ATOM 501 O ARG A 32 -14.915 22.111 -5.025 1.00 1.00 O ATOM 502 CB ARG A 32 -12.835 23.734 -3.354 1.00 1.00 C ATOM 503 CG ARG A 32 -11.678 24.029 -4.284 1.00 1.00 C ATOM 504 CD ARG A 32 -10.843 25.193 -3.767 1.00 1.00 C ATOM 505 NE ARG A 32 -11.642 26.388 -3.494 1.00 1.00 N ATOM 506 CZ ARG A 32 -11.819 26.907 -2.275 1.00 1.00 C ATOM 507 NH1 ARG A 32 -11.340 26.284 -1.202 1.00 1.00 N ATOM 508 NH2 ARG A 32 -12.498 28.038 -2.126 1.00 1.00 N ATOM 0 H ARG A 32 -11.275 21.582 -3.259 1.00 1.00 H new ATOM 0 HA ARG A 32 -14.075 22.219 -2.555 1.00 1.00 H new ATOM 0 HB2 ARG A 32 -13.691 24.333 -3.666 1.00 1.00 H new ATOM 0 HB3 ARG A 32 -12.565 24.063 -2.350 1.00 1.00 H new ATOM 0 HG2 ARG A 32 -11.051 23.143 -4.382 1.00 1.00 H new ATOM 0 HG3 ARG A 32 -12.057 24.263 -5.279 1.00 1.00 H new ATOM 0 HD2 ARG A 32 -10.330 24.889 -2.855 1.00 1.00 H new ATOM 0 HD3 ARG A 32 -10.074 25.436 -4.500 1.00 1.00 H new ATOM 0 HE ARG A 32 -12.092 26.854 -4.282 1.00 1.00 H new ATOM 0 HH11 ARG A 32 -10.834 25.405 -1.306 1.00 1.00 H new ATOM 0 HH12 ARG A 32 -11.479 26.686 -0.275 1.00 1.00 H new ATOM 0 HH21 ARG A 32 -12.885 28.512 -2.942 1.00 1.00 H new ATOM 0 HH22 ARG A 32 -12.633 28.433 -1.195 1.00 1.00 H new ATOM 522 N GLY A 33 -12.994 20.985 -5.293 1.00 1.00 N ATOM 523 CA GLY A 33 -13.406 20.390 -6.545 1.00 1.00 C ATOM 524 C GLY A 33 -12.661 20.963 -7.722 1.00 1.00 C ATOM 525 O GLY A 33 -13.216 21.093 -8.808 1.00 1.00 O ATOM 0 H GLY A 33 -12.048 20.744 -4.997 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -13.243 19.313 -6.504 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -14.476 20.546 -6.684 1.00 1.00 H new ATOM 529 N LEU A 34 -11.391 21.296 -7.525 1.00 1.00 N ATOM 530 CA LEU A 34 -10.583 21.871 -8.588 1.00 1.00 C ATOM 531 C LEU A 34 -9.283 21.092 -8.729 1.00 1.00 C ATOM 532 O LEU A 34 -8.411 21.458 -9.507 1.00 1.00 O ATOM 533 CB LEU A 34 -10.258 23.327 -8.252 1.00 1.00 C ATOM 534 CG LEU A 34 -11.449 24.182 -7.821 1.00 1.00 C ATOM 535 CD1 LEU A 34 -10.967 25.509 -7.266 1.00 1.00 C ATOM 536 CD2 LEU A 34 -12.411 24.392 -8.978 1.00 1.00 C ATOM 0 H LEU A 34 -10.901 21.177 -6.639 1.00 1.00 H new ATOM 0 HA LEU A 34 -11.140 21.822 -9.524 1.00 1.00 H new ATOM 0 HB2 LEU A 34 -9.515 23.341 -7.455 1.00 1.00 H new ATOM 0 HB3 LEU A 34 -9.797 23.789 -9.125 1.00 1.00 H new ATOM 0 HG LEU A 34 -11.988 23.655 -7.034 1.00 1.00 H new ATOM 0 HD11 LEU A 34 -11.825 26.109 -6.962 1.00 1.00 H new ATOM 0 HD12 LEU A 34 -10.325 25.331 -6.403 1.00 1.00 H new ATOM 0 HD13 LEU A 34 -10.405 26.041 -8.033 1.00 1.00 H new ATOM 0 HD21 LEU A 34 -13.250 25.003 -8.647 1.00 1.00 H new ATOM 0 HD22 LEU A 34 -11.894 24.897 -9.794 1.00 1.00 H new ATOM 0 HD23 LEU A 34 -12.780 23.427 -9.324 1.00 1.00 H new ATOM 548 N GLY A 35 -9.162 20.025 -7.949 1.00 1.00 N ATOM 549 CA GLY A 35 -7.953 19.217 -7.960 1.00 1.00 C ATOM 550 C GLY A 35 -7.634 18.629 -9.322 1.00 1.00 C ATOM 551 O GLY A 35 -6.471 18.403 -9.647 1.00 1.00 O ATOM 0 H GLY A 35 -9.883 19.702 -7.304 1.00 1.00 H new ATOM 0 HA2 GLY A 35 -7.113 19.829 -7.631 1.00 1.00 H new ATOM 0 HA3 GLY A 35 -8.060 18.407 -7.239 1.00 1.00 H new ATOM 555 N ASP A 36 -8.665 18.340 -10.101 1.00 1.00 N ATOM 556 CA ASP A 36 -8.468 17.825 -11.451 1.00 1.00 C ATOM 557 C ASP A 36 -8.318 18.980 -12.400 1.00 1.00 C ATOM 558 O ASP A 36 -7.710 18.866 -13.460 1.00 1.00 O ATOM 559 CB ASP A 36 -9.669 17.019 -11.909 1.00 1.00 C ATOM 560 CG ASP A 36 -9.284 15.797 -12.717 1.00 1.00 C ATOM 561 OD1 ASP A 36 -8.107 15.381 -12.646 1.00 1.00 O ATOM 562 OD2 ASP A 36 -10.152 15.239 -13.423 1.00 1.00 O ATOM 0 H ASP A 36 -9.641 18.452 -9.826 1.00 1.00 H new ATOM 0 HA ASP A 36 -7.581 17.191 -11.443 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -10.244 16.706 -11.038 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -10.320 17.655 -12.509 1.00 1.00 H new ATOM 567 N ALA A 37 -8.902 20.096 -12.003 1.00 1.00 N ATOM 568 CA ALA A 37 -8.930 21.260 -12.841 1.00 1.00 C ATOM 569 C ALA A 37 -7.599 21.997 -12.787 1.00 1.00 C ATOM 570 O ALA A 37 -7.285 22.801 -13.664 1.00 1.00 O ATOM 571 CB ALA A 37 -10.074 22.176 -12.438 1.00 1.00 C ATOM 0 H ALA A 37 -9.362 20.212 -11.100 1.00 1.00 H new ATOM 0 HA ALA A 37 -9.094 20.940 -13.870 1.00 1.00 H new ATOM 0 HB1 ALA A 37 -10.081 23.054 -13.083 1.00 1.00 H new ATOM 0 HB2 ALA A 37 -11.020 21.643 -12.539 1.00 1.00 H new ATOM 0 HB3 ALA A 37 -9.943 22.488 -11.402 1.00 1.00 H new ATOM 577 N VAL A 38 -6.832 21.753 -11.732 1.00 1.00 N ATOM 578 CA VAL A 38 -5.546 22.393 -11.568 1.00 1.00 C ATOM 579 C VAL A 38 -4.498 21.370 -11.181 1.00 1.00 C ATOM 580 O VAL A 38 -4.647 20.671 -10.180 1.00 1.00 O ATOM 581 CB VAL A 38 -5.588 23.440 -10.434 1.00 1.00 C ATOM 582 CG1 VAL A 38 -4.279 24.205 -10.353 1.00 1.00 C ATOM 583 CG2 VAL A 38 -6.759 24.389 -10.584 1.00 1.00 C ATOM 0 H VAL A 38 -7.085 21.114 -10.979 1.00 1.00 H new ATOM 0 HA VAL A 38 -5.302 22.870 -12.518 1.00 1.00 H new ATOM 0 HB VAL A 38 -5.727 22.898 -9.499 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -4.334 24.936 -9.547 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -3.463 23.510 -10.157 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -4.099 24.719 -11.297 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -6.751 25.109 -9.766 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -6.679 24.918 -11.534 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -7.691 23.824 -10.561 1.00 1.00 H new ATOM 593 N ARG A 39 -3.448 21.271 -11.970 1.00 1.00 N ATOM 594 CA ARG A 39 -2.348 20.391 -11.645 1.00 1.00 C ATOM 595 C ARG A 39 -1.350 21.174 -10.813 1.00 1.00 C ATOM 596 O ARG A 39 -1.000 22.303 -11.161 1.00 1.00 O ATOM 597 CB ARG A 39 -1.681 19.863 -12.915 1.00 1.00 C ATOM 598 CG ARG A 39 -2.645 19.169 -13.862 1.00 1.00 C ATOM 599 CD ARG A 39 -3.335 17.994 -13.193 1.00 1.00 C ATOM 600 NE ARG A 39 -3.707 16.951 -14.147 1.00 1.00 N ATOM 601 CZ ARG A 39 -4.869 16.297 -14.123 1.00 1.00 C ATOM 602 NH1 ARG A 39 -5.789 16.605 -13.219 1.00 1.00 N ATOM 603 NH2 ARG A 39 -5.109 15.341 -15.008 1.00 1.00 N ATOM 0 H ARG A 39 -3.334 21.790 -12.841 1.00 1.00 H new ATOM 0 HA ARG A 39 -2.716 19.531 -11.085 1.00 1.00 H new ATOM 0 HB2 ARG A 39 -1.205 20.693 -13.438 1.00 1.00 H new ATOM 0 HB3 ARG A 39 -0.891 19.165 -12.638 1.00 1.00 H new ATOM 0 HG2 ARG A 39 -3.393 19.882 -14.208 1.00 1.00 H new ATOM 0 HG3 ARG A 39 -2.105 18.821 -14.742 1.00 1.00 H new ATOM 0 HD2 ARG A 39 -2.675 17.571 -12.436 1.00 1.00 H new ATOM 0 HD3 ARG A 39 -4.228 18.346 -12.677 1.00 1.00 H new ATOM 0 HE ARG A 39 -3.036 16.708 -14.876 1.00 1.00 H new ATOM 0 HH11 ARG A 39 -5.609 17.344 -12.539 1.00 1.00 H new ATOM 0 HH12 ARG A 39 -6.677 16.103 -13.203 1.00 1.00 H new ATOM 0 HH21 ARG A 39 -4.405 15.105 -15.708 1.00 1.00 H new ATOM 0 HH22 ARG A 39 -5.998 14.841 -14.990 1.00 1.00 H new ATOM 617 N VAL A 40 -0.891 20.592 -9.731 1.00 1.00 N ATOM 618 CA VAL A 40 0.032 21.281 -8.854 1.00 1.00 C ATOM 619 C VAL A 40 1.261 20.417 -8.610 1.00 1.00 C ATOM 620 O VAL A 40 1.171 19.310 -8.080 1.00 1.00 O ATOM 621 CB VAL A 40 -0.650 21.696 -7.532 1.00 1.00 C ATOM 622 CG1 VAL A 40 0.368 22.145 -6.505 1.00 1.00 C ATOM 623 CG2 VAL A 40 -1.669 22.799 -7.793 1.00 1.00 C ATOM 0 H VAL A 40 -1.138 19.648 -9.436 1.00 1.00 H new ATOM 0 HA VAL A 40 0.355 22.201 -9.341 1.00 1.00 H new ATOM 0 HB VAL A 40 -1.166 20.825 -7.128 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -0.144 22.430 -5.586 1.00 1.00 H new ATOM 0 HG12 VAL A 40 1.059 21.328 -6.297 1.00 1.00 H new ATOM 0 HG13 VAL A 40 0.922 23.000 -6.892 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -2.144 23.085 -6.855 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -1.166 23.665 -8.223 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -2.427 22.437 -8.488 1.00 1.00 H new ATOM 633 N THR A 41 2.387 20.923 -9.079 1.00 1.00 N ATOM 634 CA THR A 41 3.648 20.204 -9.035 1.00 1.00 C ATOM 635 C THR A 41 4.745 21.089 -8.455 1.00 1.00 C ATOM 636 O THR A 41 4.503 22.246 -8.120 1.00 1.00 O ATOM 637 CB THR A 41 4.064 19.764 -10.456 1.00 1.00 C ATOM 638 OG1 THR A 41 4.205 20.919 -11.298 1.00 1.00 O ATOM 639 CG2 THR A 41 3.035 18.828 -11.071 1.00 1.00 C ATOM 0 H THR A 41 2.453 21.848 -9.503 1.00 1.00 H new ATOM 0 HA THR A 41 3.514 19.326 -8.403 1.00 1.00 H new ATOM 0 HB THR A 41 5.013 19.234 -10.377 1.00 1.00 H new ATOM 0 HG1 THR A 41 4.471 20.637 -12.198 1.00 1.00 H new ATOM 0 HG21 THR A 41 3.359 18.538 -12.071 1.00 1.00 H new ATOM 0 HG22 THR A 41 2.935 17.938 -10.449 1.00 1.00 H new ATOM 0 HG23 THR A 41 2.073 19.336 -11.135 1.00 1.00 H new ATOM 647 N SER A 42 5.965 20.586 -8.444 1.00 1.00 N ATOM 648 CA SER A 42 7.085 21.354 -7.937 1.00 1.00 C ATOM 649 C SER A 42 8.389 20.788 -8.474 1.00 1.00 C ATOM 650 O SER A 42 8.411 19.688 -9.043 1.00 1.00 O ATOM 651 CB SER A 42 7.089 21.333 -6.410 1.00 1.00 C ATOM 652 OG SER A 42 7.225 20.017 -5.918 1.00 1.00 O ATOM 0 H SER A 42 6.205 19.653 -8.779 1.00 1.00 H new ATOM 0 HA SER A 42 6.986 22.387 -8.272 1.00 1.00 H new ATOM 0 HB2 SER A 42 7.907 21.950 -6.037 1.00 1.00 H new ATOM 0 HB3 SER A 42 6.164 21.770 -6.035 1.00 1.00 H new ATOM 0 HG SER A 42 6.357 19.697 -5.596 1.00 1.00 H new ATOM 658 N ALA A 43 9.459 21.557 -8.349 1.00 1.00 N ATOM 659 CA ALA A 43 10.755 21.139 -8.829 1.00 1.00 C ATOM 660 C ALA A 43 11.857 22.009 -8.237 1.00 1.00 C ATOM 661 O ALA A 43 11.589 23.062 -7.653 1.00 1.00 O ATOM 662 CB ALA A 43 10.794 21.229 -10.342 1.00 1.00 C ATOM 0 H ALA A 43 9.449 22.480 -7.915 1.00 1.00 H new ATOM 0 HA ALA A 43 10.922 20.108 -8.518 1.00 1.00 H new ATOM 0 HB1 ALA A 43 11.774 20.913 -10.700 1.00 1.00 H new ATOM 0 HB2 ALA A 43 10.026 20.581 -10.765 1.00 1.00 H new ATOM 0 HB3 ALA A 43 10.610 22.258 -10.650 1.00 1.00 H new ATOM 668 N GLY A 44 13.090 21.554 -8.389 1.00 1.00 N ATOM 669 CA GLY A 44 14.231 22.306 -7.918 1.00 1.00 C ATOM 670 C GLY A 44 15.239 22.523 -9.024 1.00 1.00 C ATOM 671 O GLY A 44 15.495 21.620 -9.820 1.00 1.00 O ATOM 0 H GLY A 44 13.322 20.667 -8.836 1.00 1.00 H new ATOM 0 HA2 GLY A 44 13.900 23.269 -7.531 1.00 1.00 H new ATOM 0 HA3 GLY A 44 14.703 21.775 -7.091 1.00 1.00 H new ATOM 675 N THR A 45 15.803 23.719 -9.087 1.00 1.00 N ATOM 676 CA THR A 45 16.759 24.059 -10.129 1.00 1.00 C ATOM 677 C THR A 45 18.104 23.365 -9.899 1.00 1.00 C ATOM 678 O THR A 45 18.833 23.076 -10.848 1.00 1.00 O ATOM 679 CB THR A 45 16.960 25.585 -10.186 1.00 1.00 C ATOM 680 OG1 THR A 45 17.202 26.085 -8.865 1.00 1.00 O ATOM 681 CG2 THR A 45 15.736 26.271 -10.768 1.00 1.00 C ATOM 0 H THR A 45 15.614 24.473 -8.426 1.00 1.00 H new ATOM 0 HA THR A 45 16.356 23.711 -11.080 1.00 1.00 H new ATOM 0 HB THR A 45 17.815 25.797 -10.828 1.00 1.00 H new ATOM 0 HG1 THR A 45 17.897 26.775 -8.899 1.00 1.00 H new ATOM 0 HG21 THR A 45 15.902 27.348 -10.798 1.00 1.00 H new ATOM 0 HG22 THR A 45 15.559 25.903 -11.779 1.00 1.00 H new ATOM 0 HG23 THR A 45 14.868 26.055 -10.146 1.00 1.00 H new ATOM 689 N GLY A 46 18.391 23.032 -8.643 1.00 1.00 N ATOM 690 CA GLY A 46 19.662 22.415 -8.305 1.00 1.00 C ATOM 691 C GLY A 46 19.541 20.942 -7.951 1.00 1.00 C ATOM 692 O GLY A 46 20.487 20.363 -7.422 1.00 1.00 O ATOM 0 H GLY A 46 17.764 23.179 -7.852 1.00 1.00 H new ATOM 0 HA2 GLY A 46 20.346 22.524 -9.147 1.00 1.00 H new ATOM 0 HA3 GLY A 46 20.104 22.948 -7.464 1.00 1.00 H new ATOM 696 N ASN A 47 18.353 20.369 -8.183 1.00 1.00 N ATOM 697 CA ASN A 47 18.074 18.932 -7.960 1.00 1.00 C ATOM 698 C ASN A 47 18.607 18.399 -6.619 1.00 1.00 C ATOM 699 O ASN A 47 18.955 17.225 -6.521 1.00 1.00 O ATOM 700 CB ASN A 47 18.611 18.066 -9.125 1.00 1.00 C ATOM 701 CG ASN A 47 20.128 18.082 -9.289 1.00 1.00 C ATOM 702 OD1 ASN A 47 20.673 18.894 -10.039 1.00 1.00 O ATOM 703 ND2 ASN A 47 20.814 17.183 -8.598 1.00 1.00 N ATOM 0 H ASN A 47 17.548 20.888 -8.534 1.00 1.00 H new ATOM 0 HA ASN A 47 16.988 18.853 -7.921 1.00 1.00 H new ATOM 0 HB2 ASN A 47 18.287 17.036 -8.973 1.00 1.00 H new ATOM 0 HB3 ASN A 47 18.156 18.409 -10.054 1.00 1.00 H new ATOM 0 HD21 ASN A 47 21.830 17.146 -8.677 1.00 1.00 H new ATOM 0 HD22 ASN A 47 20.326 16.528 -7.988 1.00 1.00 H new ATOM 710 N TRP A 48 18.547 19.234 -5.575 1.00 1.00 N ATOM 711 CA TRP A 48 19.015 18.869 -4.227 1.00 1.00 C ATOM 712 C TRP A 48 18.558 17.470 -3.811 1.00 1.00 C ATOM 713 O TRP A 48 19.330 16.512 -3.815 1.00 1.00 O ATOM 714 CB TRP A 48 18.477 19.881 -3.206 1.00 1.00 C ATOM 715 CG TRP A 48 19.485 20.861 -2.684 1.00 1.00 C ATOM 716 CD1 TRP A 48 19.941 20.955 -1.400 1.00 1.00 C ATOM 717 CD2 TRP A 48 20.146 21.897 -3.419 1.00 1.00 C ATOM 718 NE1 TRP A 48 20.835 21.990 -1.290 1.00 1.00 N ATOM 719 CE2 TRP A 48 20.987 22.579 -2.518 1.00 1.00 C ATOM 720 CE3 TRP A 48 20.113 22.312 -4.752 1.00 1.00 C ATOM 721 CZ2 TRP A 48 21.781 23.656 -2.908 1.00 1.00 C ATOM 722 CZ3 TRP A 48 20.904 23.378 -5.139 1.00 1.00 C ATOM 723 CH2 TRP A 48 21.729 24.038 -4.221 1.00 1.00 C ATOM 0 H TRP A 48 18.174 20.181 -5.638 1.00 1.00 H new ATOM 0 HA TRP A 48 20.105 18.878 -4.252 1.00 1.00 H new ATOM 0 HB2 TRP A 48 17.659 20.436 -3.665 1.00 1.00 H new ATOM 0 HB3 TRP A 48 18.057 19.333 -2.363 1.00 1.00 H new ATOM 0 HD1 TRP A 48 19.641 20.308 -0.589 1.00 1.00 H new ATOM 0 HE1 TRP A 48 21.310 22.275 -0.433 1.00 1.00 H new ATOM 0 HE3 TRP A 48 19.480 21.809 -5.468 1.00 1.00 H new ATOM 0 HZ2 TRP A 48 22.414 24.170 -2.200 1.00 1.00 H new ATOM 0 HZ3 TRP A 48 20.885 23.707 -6.167 1.00 1.00 H new ATOM 0 HH2 TRP A 48 22.337 24.866 -4.556 1.00 1.00 H new ATOM 734 N HIS A 49 17.307 17.390 -3.400 1.00 1.00 N ATOM 735 CA HIS A 49 16.723 16.127 -2.972 1.00 1.00 C ATOM 736 C HIS A 49 15.783 15.570 -4.023 1.00 1.00 C ATOM 737 O HIS A 49 14.720 15.052 -3.695 1.00 1.00 O ATOM 738 CB HIS A 49 15.979 16.277 -1.645 1.00 1.00 C ATOM 739 CG HIS A 49 16.849 16.133 -0.432 1.00 1.00 C ATOM 740 ND1 HIS A 49 16.746 15.064 0.436 1.00 1.00 N ATOM 741 CD2 HIS A 49 17.825 16.928 0.068 1.00 1.00 C ATOM 742 CE1 HIS A 49 17.619 15.213 1.417 1.00 1.00 C ATOM 743 NE2 HIS A 49 18.284 16.333 1.215 1.00 1.00 N ATOM 0 H HIS A 49 16.671 18.186 -3.352 1.00 1.00 H new ATOM 0 HA HIS A 49 17.548 15.428 -2.833 1.00 1.00 H new ATOM 0 HB2 HIS A 49 15.498 17.255 -1.619 1.00 1.00 H new ATOM 0 HB3 HIS A 49 15.186 15.531 -1.600 1.00 1.00 H new ATOM 0 HD2 HIS A 49 18.176 17.857 -0.357 1.00 1.00 H new ATOM 0 HE1 HIS A 49 17.763 14.533 2.243 1.00 1.00 H new ATOM 0 HE2 HIS A 49 19.022 16.699 1.816 1.00 1.00 H new ATOM 752 N VAL A 50 16.177 15.671 -5.281 1.00 1.00 N ATOM 753 CA VAL A 50 15.360 15.154 -6.372 1.00 1.00 C ATOM 754 C VAL A 50 15.134 13.643 -6.205 1.00 1.00 C ATOM 755 O VAL A 50 16.075 12.894 -5.950 1.00 1.00 O ATOM 756 CB VAL A 50 15.995 15.460 -7.750 1.00 1.00 C ATOM 757 CG1 VAL A 50 17.343 14.775 -7.917 1.00 1.00 C ATOM 758 CG2 VAL A 50 15.054 15.063 -8.871 1.00 1.00 C ATOM 0 H VAL A 50 17.053 16.104 -5.574 1.00 1.00 H new ATOM 0 HA VAL A 50 14.395 15.659 -6.333 1.00 1.00 H new ATOM 0 HB VAL A 50 16.166 16.535 -7.799 1.00 1.00 H new ATOM 0 HG11 VAL A 50 17.754 15.016 -8.897 1.00 1.00 H new ATOM 0 HG12 VAL A 50 18.026 15.122 -7.142 1.00 1.00 H new ATOM 0 HG13 VAL A 50 17.216 13.696 -7.832 1.00 1.00 H new ATOM 0 HG21 VAL A 50 15.518 15.286 -9.832 1.00 1.00 H new ATOM 0 HG22 VAL A 50 14.844 13.995 -8.809 1.00 1.00 H new ATOM 0 HG23 VAL A 50 14.123 15.622 -8.780 1.00 1.00 H new ATOM 768 N GLY A 51 13.872 13.219 -6.257 1.00 1.00 N ATOM 769 CA GLY A 51 13.544 11.817 -6.068 1.00 1.00 C ATOM 770 C GLY A 51 13.221 11.495 -4.626 1.00 1.00 C ATOM 771 O GLY A 51 12.722 10.415 -4.322 1.00 1.00 O ATOM 0 H GLY A 51 13.069 13.825 -6.427 1.00 1.00 H new ATOM 0 HA2 GLY A 51 12.692 11.557 -6.696 1.00 1.00 H new ATOM 0 HA3 GLY A 51 14.382 11.202 -6.397 1.00 1.00 H new ATOM 775 N SER A 52 13.544 12.418 -3.731 1.00 1.00 N ATOM 776 CA SER A 52 13.274 12.234 -2.314 1.00 1.00 C ATOM 777 C SER A 52 11.815 12.565 -2.013 1.00 1.00 C ATOM 778 O SER A 52 10.987 12.698 -2.919 1.00 1.00 O ATOM 779 CB SER A 52 14.194 13.119 -1.480 1.00 1.00 C ATOM 780 OG SER A 52 14.371 12.618 -0.162 1.00 1.00 O ATOM 0 H SER A 52 13.994 13.303 -3.963 1.00 1.00 H new ATOM 0 HA SER A 52 13.462 11.192 -2.054 1.00 1.00 H new ATOM 0 HB2 SER A 52 15.164 13.196 -1.971 1.00 1.00 H new ATOM 0 HB3 SER A 52 13.780 14.126 -1.431 1.00 1.00 H new ATOM 0 HG SER A 52 15.047 13.153 0.303 1.00 1.00 H new ATOM 786 N CYS A 53 11.533 12.801 -0.749 1.00 1.00 N ATOM 787 CA CYS A 53 10.196 13.126 -0.310 1.00 1.00 C ATOM 788 C CYS A 53 10.246 14.461 0.401 1.00 1.00 C ATOM 789 O CYS A 53 11.324 15.041 0.539 1.00 1.00 O ATOM 790 CB CYS A 53 9.677 12.031 0.623 1.00 1.00 C ATOM 791 SG CYS A 53 7.908 12.125 0.996 1.00 1.00 S ATOM 0 H CYS A 53 12.224 12.773 0.001 1.00 1.00 H new ATOM 0 HA CYS A 53 9.517 13.191 -1.160 1.00 1.00 H new ATOM 0 HB2 CYS A 53 9.888 11.061 0.174 1.00 1.00 H new ATOM 0 HB3 CYS A 53 10.234 12.077 1.559 1.00 1.00 H new ATOM 0 HG CYS A 53 7.252 12.429 -0.085 1.00 1.00 H new ATOM 797 N ALA A 54 9.096 14.965 0.812 1.00 1.00 N ATOM 798 CA ALA A 54 9.037 16.244 1.506 1.00 1.00 C ATOM 799 C ALA A 54 9.872 16.200 2.783 1.00 1.00 C ATOM 800 O ALA A 54 9.888 15.190 3.492 1.00 1.00 O ATOM 801 CB ALA A 54 7.597 16.622 1.808 1.00 1.00 C ATOM 0 H ALA A 54 8.192 14.512 0.679 1.00 1.00 H new ATOM 0 HA ALA A 54 9.457 17.011 0.855 1.00 1.00 H new ATOM 0 HB1 ALA A 54 7.574 17.580 2.327 1.00 1.00 H new ATOM 0 HB2 ALA A 54 7.038 16.700 0.875 1.00 1.00 H new ATOM 0 HB3 ALA A 54 7.145 15.857 2.439 1.00 1.00 H new ATOM 807 N ASP A 55 10.567 17.298 3.059 1.00 1.00 N ATOM 808 CA ASP A 55 11.468 17.385 4.203 1.00 1.00 C ATOM 809 C ASP A 55 10.723 17.139 5.506 1.00 1.00 C ATOM 810 O ASP A 55 9.579 17.571 5.671 1.00 1.00 O ATOM 811 CB ASP A 55 12.142 18.761 4.243 1.00 1.00 C ATOM 812 CG ASP A 55 13.262 18.847 5.267 1.00 1.00 C ATOM 813 OD1 ASP A 55 12.995 18.669 6.474 1.00 1.00 O ATOM 814 OD2 ASP A 55 14.412 19.112 4.866 1.00 1.00 O ATOM 0 H ASP A 55 10.522 18.149 2.499 1.00 1.00 H new ATOM 0 HA ASP A 55 12.230 16.613 4.091 1.00 1.00 H new ATOM 0 HB2 ASP A 55 12.542 18.992 3.256 1.00 1.00 H new ATOM 0 HB3 ASP A 55 11.393 19.520 4.469 1.00 1.00 H new ATOM 819 N GLU A 56 11.372 16.413 6.406 1.00 1.00 N ATOM 820 CA GLU A 56 10.820 16.090 7.715 1.00 1.00 C ATOM 821 C GLU A 56 10.228 17.308 8.428 1.00 1.00 C ATOM 822 O GLU A 56 9.199 17.192 9.100 1.00 1.00 O ATOM 823 CB GLU A 56 11.912 15.464 8.586 1.00 1.00 C ATOM 824 CG GLU A 56 13.141 16.345 8.759 1.00 1.00 C ATOM 825 CD GLU A 56 14.183 15.721 9.663 1.00 1.00 C ATOM 826 OE1 GLU A 56 14.101 15.916 10.895 1.00 1.00 O ATOM 827 OE2 GLU A 56 15.089 15.040 9.142 1.00 1.00 O ATOM 0 H GLU A 56 12.303 16.029 6.247 1.00 1.00 H new ATOM 0 HA GLU A 56 10.003 15.386 7.557 1.00 1.00 H new ATOM 0 HB2 GLU A 56 11.496 15.240 9.568 1.00 1.00 H new ATOM 0 HB3 GLU A 56 12.216 14.515 8.145 1.00 1.00 H new ATOM 0 HG2 GLU A 56 13.583 16.541 7.782 1.00 1.00 H new ATOM 0 HG3 GLU A 56 12.838 17.308 9.171 1.00 1.00 H new ATOM 834 N ARG A 57 10.852 18.478 8.285 1.00 1.00 N ATOM 835 CA ARG A 57 10.385 19.669 8.984 1.00 1.00 C ATOM 836 C ARG A 57 9.103 20.212 8.353 1.00 1.00 C ATOM 837 O ARG A 57 8.175 20.620 9.060 1.00 1.00 O ATOM 838 CB ARG A 57 11.490 20.738 9.007 1.00 1.00 C ATOM 839 CG ARG A 57 11.936 21.217 7.633 1.00 1.00 C ATOM 840 CD ARG A 57 13.387 21.682 7.647 1.00 1.00 C ATOM 841 NE ARG A 57 14.305 20.546 7.720 1.00 1.00 N ATOM 842 CZ ARG A 57 15.493 20.549 8.322 1.00 1.00 C ATOM 843 NH1 ARG A 57 15.970 21.657 8.878 1.00 1.00 N ATOM 844 NH2 ARG A 57 16.218 19.435 8.348 1.00 1.00 N ATOM 0 H ARG A 57 11.673 18.623 7.697 1.00 1.00 H new ATOM 0 HA ARG A 57 10.150 19.395 10.013 1.00 1.00 H new ATOM 0 HB2 ARG A 57 11.136 21.596 9.579 1.00 1.00 H new ATOM 0 HB3 ARG A 57 12.355 20.337 9.536 1.00 1.00 H new ATOM 0 HG2 ARG A 57 11.818 20.410 6.910 1.00 1.00 H new ATOM 0 HG3 ARG A 57 11.294 22.035 7.306 1.00 1.00 H new ATOM 0 HD2 ARG A 57 13.594 22.263 6.749 1.00 1.00 H new ATOM 0 HD3 ARG A 57 13.552 22.342 8.499 1.00 1.00 H new ATOM 0 HE ARG A 57 14.011 19.678 7.272 1.00 1.00 H new ATOM 0 HH11 ARG A 57 15.425 22.519 8.847 1.00 1.00 H new ATOM 0 HH12 ARG A 57 16.881 21.646 9.336 1.00 1.00 H new ATOM 0 HH21 ARG A 57 15.864 18.585 7.909 1.00 1.00 H new ATOM 0 HH22 ARG A 57 17.129 19.430 8.807 1.00 1.00 H new ATOM 858 N ALA A 58 9.041 20.176 7.027 1.00 1.00 N ATOM 859 CA ALA A 58 7.861 20.632 6.301 1.00 1.00 C ATOM 860 C ALA A 58 6.713 19.654 6.504 1.00 1.00 C ATOM 861 O ALA A 58 5.560 20.049 6.655 1.00 1.00 O ATOM 862 CB ALA A 58 8.179 20.789 4.822 1.00 1.00 C ATOM 0 H ALA A 58 9.796 19.835 6.431 1.00 1.00 H new ATOM 0 HA ALA A 58 7.560 21.605 6.691 1.00 1.00 H new ATOM 0 HB1 ALA A 58 7.289 21.130 4.293 1.00 1.00 H new ATOM 0 HB2 ALA A 58 8.978 21.520 4.697 1.00 1.00 H new ATOM 0 HB3 ALA A 58 8.498 19.830 4.415 1.00 1.00 H new ATOM 868 N ALA A 59 7.051 18.371 6.547 1.00 1.00 N ATOM 869 CA ALA A 59 6.069 17.326 6.783 1.00 1.00 C ATOM 870 C ALA A 59 5.465 17.497 8.165 1.00 1.00 C ATOM 871 O ALA A 59 4.255 17.362 8.346 1.00 1.00 O ATOM 872 CB ALA A 59 6.705 15.948 6.640 1.00 1.00 C ATOM 0 H ALA A 59 8.004 18.030 6.420 1.00 1.00 H new ATOM 0 HA ALA A 59 5.278 17.408 6.038 1.00 1.00 H new ATOM 0 HB1 ALA A 59 5.953 15.180 6.821 1.00 1.00 H new ATOM 0 HB2 ALA A 59 7.105 15.835 5.632 1.00 1.00 H new ATOM 0 HB3 ALA A 59 7.512 15.843 7.365 1.00 1.00 H new ATOM 878 N GLY A 60 6.318 17.819 9.130 1.00 1.00 N ATOM 879 CA GLY A 60 5.860 18.047 10.481 1.00 1.00 C ATOM 880 C GLY A 60 4.805 19.131 10.565 1.00 1.00 C ATOM 881 O GLY A 60 3.758 18.922 11.173 1.00 1.00 O ATOM 0 H GLY A 60 7.324 17.926 8.996 1.00 1.00 H new ATOM 0 HA2 GLY A 60 5.455 17.119 10.884 1.00 1.00 H new ATOM 0 HA3 GLY A 60 6.709 18.323 11.107 1.00 1.00 H new ATOM 885 N VAL A 61 5.048 20.275 9.929 1.00 1.00 N ATOM 886 CA VAL A 61 4.091 21.372 10.000 1.00 1.00 C ATOM 887 C VAL A 61 2.836 21.077 9.183 1.00 1.00 C ATOM 888 O VAL A 61 1.729 21.404 9.611 1.00 1.00 O ATOM 889 CB VAL A 61 4.695 22.735 9.583 1.00 1.00 C ATOM 890 CG1 VAL A 61 5.896 23.084 10.442 1.00 1.00 C ATOM 891 CG2 VAL A 61 5.060 22.774 8.115 1.00 1.00 C ATOM 0 H VAL A 61 5.881 20.463 9.371 1.00 1.00 H new ATOM 0 HA VAL A 61 3.814 21.453 11.051 1.00 1.00 H new ATOM 0 HB VAL A 61 3.922 23.486 9.745 1.00 1.00 H new ATOM 0 HG11 VAL A 61 6.301 24.046 10.128 1.00 1.00 H new ATOM 0 HG12 VAL A 61 5.591 23.142 11.487 1.00 1.00 H new ATOM 0 HG13 VAL A 61 6.660 22.315 10.329 1.00 1.00 H new ATOM 0 HG21 VAL A 61 5.480 23.750 7.870 1.00 1.00 H new ATOM 0 HG22 VAL A 61 5.796 21.999 7.902 1.00 1.00 H new ATOM 0 HG23 VAL A 61 4.168 22.602 7.513 1.00 1.00 H new ATOM 901 N LEU A 62 2.987 20.428 8.033 1.00 1.00 N ATOM 902 CA LEU A 62 1.834 20.074 7.218 1.00 1.00 C ATOM 903 C LEU A 62 0.921 19.130 7.983 1.00 1.00 C ATOM 904 O LEU A 62 -0.245 19.442 8.225 1.00 1.00 O ATOM 905 CB LEU A 62 2.281 19.439 5.899 1.00 1.00 C ATOM 906 CG LEU A 62 2.403 20.394 4.705 1.00 1.00 C ATOM 907 CD1 LEU A 62 2.909 21.757 5.144 1.00 1.00 C ATOM 908 CD2 LEU A 62 3.342 19.812 3.664 1.00 1.00 C ATOM 0 H LEU A 62 3.887 20.140 7.649 1.00 1.00 H new ATOM 0 HA LEU A 62 1.279 20.983 6.987 1.00 1.00 H new ATOM 0 HB2 LEU A 62 3.247 18.960 6.057 1.00 1.00 H new ATOM 0 HB3 LEU A 62 1.574 18.651 5.639 1.00 1.00 H new ATOM 0 HG LEU A 62 1.411 20.518 4.271 1.00 1.00 H new ATOM 0 HD11 LEU A 62 2.986 22.413 4.277 1.00 1.00 H new ATOM 0 HD12 LEU A 62 2.214 22.188 5.865 1.00 1.00 H new ATOM 0 HD13 LEU A 62 3.891 21.649 5.605 1.00 1.00 H new ATOM 0 HD21 LEU A 62 3.421 20.498 2.821 1.00 1.00 H new ATOM 0 HD22 LEU A 62 4.328 19.664 4.105 1.00 1.00 H new ATOM 0 HD23 LEU A 62 2.953 18.855 3.317 1.00 1.00 H new ATOM 920 N ARG A 63 1.490 18.028 8.451 1.00 1.00 N ATOM 921 CA ARG A 63 0.735 17.026 9.194 1.00 1.00 C ATOM 922 C ARG A 63 0.131 17.628 10.463 1.00 1.00 C ATOM 923 O ARG A 63 -0.969 17.255 10.869 1.00 1.00 O ATOM 924 CB ARG A 63 1.622 15.827 9.552 1.00 1.00 C ATOM 925 CG ARG A 63 2.513 16.060 10.760 1.00 1.00 C ATOM 926 CD ARG A 63 3.318 14.822 11.111 1.00 1.00 C ATOM 927 NE ARG A 63 2.467 13.749 11.628 1.00 1.00 N ATOM 928 CZ ARG A 63 2.903 12.746 12.394 1.00 1.00 C ATOM 929 NH1 ARG A 63 4.192 12.628 12.683 1.00 1.00 N ATOM 930 NH2 ARG A 63 2.049 11.853 12.876 1.00 1.00 N ATOM 0 H ARG A 63 2.477 17.804 8.329 1.00 1.00 H new ATOM 0 HA ARG A 63 -0.076 16.680 8.553 1.00 1.00 H new ATOM 0 HB2 ARG A 63 0.987 14.962 9.743 1.00 1.00 H new ATOM 0 HB3 ARG A 63 2.247 15.581 8.694 1.00 1.00 H new ATOM 0 HG2 ARG A 63 3.191 16.889 10.558 1.00 1.00 H new ATOM 0 HG3 ARG A 63 1.900 16.350 11.614 1.00 1.00 H new ATOM 0 HD2 ARG A 63 3.849 14.471 10.226 1.00 1.00 H new ATOM 0 HD3 ARG A 63 4.073 15.078 11.855 1.00 1.00 H new ATOM 0 HE ARG A 63 1.476 13.769 11.387 1.00 1.00 H new ATOM 0 HH11 ARG A 63 4.860 13.307 12.319 1.00 1.00 H new ATOM 0 HH12 ARG A 63 4.515 11.858 13.269 1.00 1.00 H new ATOM 0 HH21 ARG A 63 1.055 11.931 12.662 1.00 1.00 H new ATOM 0 HH22 ARG A 63 2.386 11.088 13.461 1.00 1.00 H new ATOM 944 N ALA A 64 0.830 18.594 11.061 1.00 1.00 N ATOM 945 CA ALA A 64 0.355 19.237 12.280 1.00 1.00 C ATOM 946 C ALA A 64 -0.894 20.063 12.015 1.00 1.00 C ATOM 947 O ALA A 64 -1.765 20.194 12.875 1.00 1.00 O ATOM 948 CB ALA A 64 1.437 20.123 12.882 1.00 1.00 C ATOM 0 H ALA A 64 1.725 18.945 10.719 1.00 1.00 H new ATOM 0 HA ALA A 64 0.107 18.448 12.990 1.00 1.00 H new ATOM 0 HB1 ALA A 64 1.059 20.592 13.791 1.00 1.00 H new ATOM 0 HB2 ALA A 64 2.311 19.518 13.122 1.00 1.00 H new ATOM 0 HB3 ALA A 64 1.716 20.895 12.165 1.00 1.00 H new ATOM 954 N HIS A 65 -0.977 20.620 10.817 1.00 1.00 N ATOM 955 CA HIS A 65 -2.105 21.461 10.447 1.00 1.00 C ATOM 956 C HIS A 65 -3.149 20.679 9.642 1.00 1.00 C ATOM 957 O HIS A 65 -4.117 21.249 9.145 1.00 1.00 O ATOM 958 CB HIS A 65 -1.606 22.698 9.694 1.00 1.00 C ATOM 959 CG HIS A 65 -0.780 23.613 10.561 1.00 1.00 C ATOM 960 ND1 HIS A 65 -1.334 24.434 11.518 1.00 1.00 N ATOM 961 CD2 HIS A 65 0.569 23.800 10.650 1.00 1.00 C ATOM 962 CE1 HIS A 65 -0.374 25.078 12.155 1.00 1.00 C ATOM 963 NE2 HIS A 65 0.790 24.714 11.655 1.00 1.00 N ATOM 0 H HIS A 65 -0.277 20.505 10.084 1.00 1.00 H new ATOM 0 HA HIS A 65 -2.606 21.795 11.356 1.00 1.00 H new ATOM 0 HB2 HIS A 65 -1.011 22.381 8.837 1.00 1.00 H new ATOM 0 HB3 HIS A 65 -2.461 23.249 9.302 1.00 1.00 H new ATOM 0 HD2 HIS A 65 1.323 23.320 10.044 1.00 1.00 H new ATOM 0 HE1 HIS A 65 -0.519 25.788 12.956 1.00 1.00 H new ATOM 0 HE2 HIS A 65 1.702 25.053 11.962 1.00 1.00 H new ATOM 972 N GLY A 66 -2.930 19.369 9.518 1.00 1.00 N ATOM 973 CA GLY A 66 -3.898 18.498 8.862 1.00 1.00 C ATOM 974 C GLY A 66 -3.659 18.345 7.372 1.00 1.00 C ATOM 975 O GLY A 66 -4.509 17.825 6.646 1.00 1.00 O ATOM 0 H GLY A 66 -2.096 18.893 9.862 1.00 1.00 H new ATOM 0 HA2 GLY A 66 -3.866 17.514 9.330 1.00 1.00 H new ATOM 0 HA3 GLY A 66 -4.900 18.895 9.023 1.00 1.00 H new ATOM 979 N TYR A 67 -2.505 18.796 6.918 1.00 1.00 N ATOM 980 CA TYR A 67 -2.153 18.720 5.512 1.00 1.00 C ATOM 981 C TYR A 67 -1.380 17.447 5.208 1.00 1.00 C ATOM 982 O TYR A 67 -0.708 16.896 6.083 1.00 1.00 O ATOM 983 CB TYR A 67 -1.331 19.946 5.106 1.00 1.00 C ATOM 984 CG TYR A 67 -2.159 21.203 4.974 1.00 1.00 C ATOM 985 CD1 TYR A 67 -3.036 21.364 3.912 1.00 1.00 C ATOM 986 CD2 TYR A 67 -2.074 22.218 5.915 1.00 1.00 C ATOM 987 CE1 TYR A 67 -3.804 22.505 3.787 1.00 1.00 C ATOM 988 CE2 TYR A 67 -2.840 23.363 5.798 1.00 1.00 C ATOM 989 CZ TYR A 67 -3.704 23.500 4.733 1.00 1.00 C ATOM 990 OH TYR A 67 -4.467 24.641 4.611 1.00 1.00 O ATOM 0 H TYR A 67 -1.790 19.222 7.508 1.00 1.00 H new ATOM 0 HA TYR A 67 -3.076 18.702 4.933 1.00 1.00 H new ATOM 0 HB2 TYR A 67 -0.548 20.111 5.846 1.00 1.00 H new ATOM 0 HB3 TYR A 67 -0.835 19.744 4.156 1.00 1.00 H new ATOM 0 HD1 TYR A 67 -3.120 20.584 3.170 1.00 1.00 H new ATOM 0 HD2 TYR A 67 -1.399 22.113 6.752 1.00 1.00 H new ATOM 0 HE1 TYR A 67 -4.479 22.616 2.952 1.00 1.00 H new ATOM 0 HE2 TYR A 67 -2.762 24.146 6.538 1.00 1.00 H new ATOM 0 HH TYR A 67 -4.278 25.243 5.361 1.00 1.00 H new ATOM 1000 N PRO A 68 -1.496 16.935 3.975 1.00 1.00 N ATOM 1001 CA PRO A 68 -0.729 15.774 3.541 1.00 1.00 C ATOM 1002 C PRO A 68 0.734 16.131 3.389 1.00 1.00 C ATOM 1003 O PRO A 68 1.081 17.298 3.220 1.00 1.00 O ATOM 1004 CB PRO A 68 -1.335 15.418 2.186 1.00 1.00 C ATOM 1005 CG PRO A 68 -1.932 16.689 1.693 1.00 1.00 C ATOM 1006 CD PRO A 68 -2.382 17.442 2.913 1.00 1.00 C ATOM 0 HA PRO A 68 -0.774 14.950 4.253 1.00 1.00 H new ATOM 0 HB2 PRO A 68 -0.576 15.044 1.499 1.00 1.00 H new ATOM 0 HB3 PRO A 68 -2.090 14.637 2.283 1.00 1.00 H new ATOM 0 HG2 PRO A 68 -1.203 17.267 1.126 1.00 1.00 H new ATOM 0 HG3 PRO A 68 -2.771 16.492 1.026 1.00 1.00 H new ATOM 0 HD2 PRO A 68 -2.276 18.519 2.782 1.00 1.00 H new ATOM 0 HD3 PRO A 68 -3.431 17.250 3.139 1.00 1.00 H new ATOM 1014 N THR A 69 1.590 15.133 3.426 1.00 1.00 N ATOM 1015 CA THR A 69 3.013 15.379 3.336 1.00 1.00 C ATOM 1016 C THR A 69 3.627 14.476 2.275 1.00 1.00 C ATOM 1017 O THR A 69 4.841 14.442 2.078 1.00 1.00 O ATOM 1018 CB THR A 69 3.690 15.161 4.708 1.00 1.00 C ATOM 1019 OG1 THR A 69 3.691 13.769 5.048 1.00 1.00 O ATOM 1020 CG2 THR A 69 2.956 15.934 5.793 1.00 1.00 C ATOM 0 H THR A 69 1.329 14.151 3.517 1.00 1.00 H new ATOM 0 HA THR A 69 3.176 16.417 3.045 1.00 1.00 H new ATOM 0 HB THR A 69 4.717 15.521 4.638 1.00 1.00 H new ATOM 0 HG1 THR A 69 4.124 13.645 5.918 1.00 1.00 H new ATOM 0 HG21 THR A 69 3.446 15.769 6.752 1.00 1.00 H new ATOM 0 HG22 THR A 69 2.972 16.998 5.556 1.00 1.00 H new ATOM 0 HG23 THR A 69 1.923 15.590 5.849 1.00 1.00 H new ATOM 1028 N ASP A 70 2.748 13.802 1.546 1.00 1.00 N ATOM 1029 CA ASP A 70 3.136 12.900 0.473 1.00 1.00 C ATOM 1030 C ASP A 70 3.623 13.698 -0.731 1.00 1.00 C ATOM 1031 O ASP A 70 2.879 14.510 -1.291 1.00 1.00 O ATOM 1032 CB ASP A 70 1.946 12.024 0.085 1.00 1.00 C ATOM 1033 CG ASP A 70 1.635 10.973 1.127 1.00 1.00 C ATOM 1034 OD1 ASP A 70 0.934 11.293 2.110 1.00 1.00 O ATOM 1035 OD2 ASP A 70 2.091 9.819 0.973 1.00 1.00 O ATOM 0 H ASP A 70 1.740 13.867 1.684 1.00 1.00 H new ATOM 0 HA ASP A 70 3.950 12.261 0.816 1.00 1.00 H new ATOM 0 HB2 ASP A 70 1.069 12.654 -0.064 1.00 1.00 H new ATOM 0 HB3 ASP A 70 2.154 11.536 -0.867 1.00 1.00 H new ATOM 1040 N HIS A 71 4.869 13.471 -1.125 1.00 1.00 N ATOM 1041 CA HIS A 71 5.489 14.238 -2.198 1.00 1.00 C ATOM 1042 C HIS A 71 6.748 13.545 -2.692 1.00 1.00 C ATOM 1043 O HIS A 71 7.425 12.867 -1.928 1.00 1.00 O ATOM 1044 CB HIS A 71 5.814 15.649 -1.673 1.00 1.00 C ATOM 1045 CG HIS A 71 6.826 16.426 -2.461 1.00 1.00 C ATOM 1046 ND1 HIS A 71 6.506 17.232 -3.529 1.00 1.00 N ATOM 1047 CD2 HIS A 71 8.162 16.547 -2.289 1.00 1.00 C ATOM 1048 CE1 HIS A 71 7.602 17.814 -3.978 1.00 1.00 C ATOM 1049 NE2 HIS A 71 8.625 17.422 -3.239 1.00 1.00 N ATOM 0 H HIS A 71 5.473 12.758 -0.715 1.00 1.00 H new ATOM 0 HA HIS A 71 4.801 14.312 -3.040 1.00 1.00 H new ATOM 0 HB2 HIS A 71 4.889 16.225 -1.639 1.00 1.00 H new ATOM 0 HB3 HIS A 71 6.172 15.560 -0.647 1.00 1.00 H new ATOM 0 HD1 HIS A 71 5.570 17.360 -3.913 1.00 1.00 H new ATOM 0 HD2 HIS A 71 8.757 16.046 -1.540 1.00 1.00 H new ATOM 0 HE1 HIS A 71 7.654 18.498 -4.812 1.00 1.00 H new ATOM 1058 N ARG A 72 7.073 13.746 -3.958 1.00 1.00 N ATOM 1059 CA ARG A 72 8.295 13.211 -4.519 1.00 1.00 C ATOM 1060 C ARG A 72 8.994 14.314 -5.288 1.00 1.00 C ATOM 1061 O ARG A 72 8.477 14.827 -6.280 1.00 1.00 O ATOM 1062 CB ARG A 72 8.018 12.029 -5.438 1.00 1.00 C ATOM 1063 CG ARG A 72 9.144 11.014 -5.448 1.00 1.00 C ATOM 1064 CD ARG A 72 9.145 10.214 -4.157 1.00 1.00 C ATOM 1065 NE ARG A 72 10.139 9.143 -4.156 1.00 1.00 N ATOM 1066 CZ ARG A 72 10.191 8.178 -3.240 1.00 1.00 C ATOM 1067 NH1 ARG A 72 9.316 8.159 -2.236 1.00 1.00 N ATOM 1068 NH2 ARG A 72 11.118 7.234 -3.325 1.00 1.00 N ATOM 0 H ARG A 72 6.503 14.278 -4.616 1.00 1.00 H new ATOM 0 HA ARG A 72 8.928 12.851 -3.708 1.00 1.00 H new ATOM 0 HB2 ARG A 72 7.096 11.539 -5.124 1.00 1.00 H new ATOM 0 HB3 ARG A 72 7.855 12.394 -6.452 1.00 1.00 H new ATOM 0 HG2 ARG A 72 9.030 10.343 -6.299 1.00 1.00 H new ATOM 0 HG3 ARG A 72 10.100 11.523 -5.569 1.00 1.00 H new ATOM 0 HD2 ARG A 72 9.339 10.884 -3.320 1.00 1.00 H new ATOM 0 HD3 ARG A 72 8.155 9.785 -4.000 1.00 1.00 H new ATOM 0 HE ARG A 72 10.835 9.134 -4.902 1.00 1.00 H new ATOM 0 HH11 ARG A 72 8.603 8.885 -2.167 1.00 1.00 H new ATOM 0 HH12 ARG A 72 9.359 7.418 -1.536 1.00 1.00 H new ATOM 0 HH21 ARG A 72 11.791 7.247 -4.092 1.00 1.00 H new ATOM 0 HH22 ARG A 72 11.159 6.494 -2.624 1.00 1.00 H new ATOM 1082 N ALA A 73 10.118 14.740 -4.758 1.00 1.00 N ATOM 1083 CA ALA A 73 10.861 15.853 -5.321 1.00 1.00 C ATOM 1084 C ALA A 73 11.290 15.602 -6.762 1.00 1.00 C ATOM 1085 O ALA A 73 11.667 14.493 -7.128 1.00 1.00 O ATOM 1086 CB ALA A 73 12.058 16.142 -4.452 1.00 1.00 C ATOM 0 H ALA A 73 10.545 14.329 -3.928 1.00 1.00 H new ATOM 0 HA ALA A 73 10.200 16.720 -5.343 1.00 1.00 H new ATOM 0 HB1 ALA A 73 12.619 16.977 -4.871 1.00 1.00 H new ATOM 0 HB2 ALA A 73 11.724 16.397 -3.446 1.00 1.00 H new ATOM 0 HB3 ALA A 73 12.698 15.261 -4.409 1.00 1.00 H new ATOM 1092 N ALA A 74 11.227 16.644 -7.570 1.00 1.00 N ATOM 1093 CA ALA A 74 11.646 16.565 -8.958 1.00 1.00 C ATOM 1094 C ALA A 74 12.504 17.769 -9.307 1.00 1.00 C ATOM 1095 O ALA A 74 12.583 18.727 -8.539 1.00 1.00 O ATOM 1096 CB ALA A 74 10.430 16.493 -9.872 1.00 1.00 C ATOM 0 H ALA A 74 10.887 17.563 -7.286 1.00 1.00 H new ATOM 0 HA ALA A 74 12.237 15.660 -9.101 1.00 1.00 H new ATOM 0 HB1 ALA A 74 10.758 16.434 -10.910 1.00 1.00 H new ATOM 0 HB2 ALA A 74 9.842 15.609 -9.626 1.00 1.00 H new ATOM 0 HB3 ALA A 74 9.818 17.385 -9.735 1.00 1.00 H new ATOM 1102 N GLN A 75 13.192 17.693 -10.431 1.00 1.00 N ATOM 1103 CA GLN A 75 14.047 18.777 -10.879 1.00 1.00 C ATOM 1104 C GLN A 75 13.327 19.564 -11.974 1.00 1.00 C ATOM 1105 O GLN A 75 12.326 19.093 -12.515 1.00 1.00 O ATOM 1106 CB GLN A 75 15.389 18.208 -11.368 1.00 1.00 C ATOM 1107 CG GLN A 75 16.281 19.210 -12.089 1.00 1.00 C ATOM 1108 CD GLN A 75 17.638 18.634 -12.450 1.00 1.00 C ATOM 1109 OE1 GLN A 75 17.772 17.434 -12.702 1.00 1.00 O ATOM 1110 NE2 GLN A 75 18.656 19.479 -12.467 1.00 1.00 N ATOM 0 H GLN A 75 13.175 16.886 -11.054 1.00 1.00 H new ATOM 0 HA GLN A 75 14.259 19.460 -10.056 1.00 1.00 H new ATOM 0 HB2 GLN A 75 15.932 17.809 -10.512 1.00 1.00 H new ATOM 0 HB3 GLN A 75 15.191 17.371 -12.038 1.00 1.00 H new ATOM 0 HG2 GLN A 75 15.781 19.547 -12.997 1.00 1.00 H new ATOM 0 HG3 GLN A 75 16.420 20.087 -11.457 1.00 1.00 H new ATOM 0 HE21 GLN A 75 18.504 20.465 -12.253 1.00 1.00 H new ATOM 0 HE22 GLN A 75 19.592 19.145 -12.694 1.00 1.00 H new ATOM 1119 N VAL A 76 13.765 20.789 -12.224 1.00 1.00 N ATOM 1120 CA VAL A 76 13.160 21.618 -13.254 1.00 1.00 C ATOM 1121 C VAL A 76 13.386 21.016 -14.640 1.00 1.00 C ATOM 1122 O VAL A 76 14.497 21.032 -15.165 1.00 1.00 O ATOM 1123 CB VAL A 76 13.719 23.055 -13.222 1.00 1.00 C ATOM 1124 CG1 VAL A 76 13.138 23.893 -14.331 1.00 1.00 C ATOM 1125 CG2 VAL A 76 13.460 23.703 -11.876 1.00 1.00 C ATOM 0 H VAL A 76 14.538 21.231 -11.727 1.00 1.00 H new ATOM 0 HA VAL A 76 12.090 21.655 -13.048 1.00 1.00 H new ATOM 0 HB VAL A 76 14.796 22.994 -13.375 1.00 1.00 H new ATOM 0 HG11 VAL A 76 13.552 24.900 -14.281 1.00 1.00 H new ATOM 0 HG12 VAL A 76 13.387 23.446 -15.293 1.00 1.00 H new ATOM 0 HG13 VAL A 76 12.054 23.940 -14.222 1.00 1.00 H new ATOM 0 HG21 VAL A 76 13.863 24.716 -11.876 1.00 1.00 H new ATOM 0 HG22 VAL A 76 12.387 23.739 -11.690 1.00 1.00 H new ATOM 0 HG23 VAL A 76 13.944 23.120 -11.092 1.00 1.00 H new ATOM 1135 N GLY A 77 12.329 20.451 -15.196 1.00 1.00 N ATOM 1136 CA GLY A 77 12.400 19.845 -16.507 1.00 1.00 C ATOM 1137 C GLY A 77 11.433 20.489 -17.476 1.00 1.00 C ATOM 1138 O GLY A 77 10.697 21.404 -17.104 1.00 1.00 O ATOM 0 H GLY A 77 11.410 20.401 -14.756 1.00 1.00 H new ATOM 0 HA2 GLY A 77 13.415 19.933 -16.894 1.00 1.00 H new ATOM 0 HA3 GLY A 77 12.180 18.780 -16.428 1.00 1.00 H new ATOM 1142 N THR A 78 11.356 19.931 -18.676 1.00 1.00 N ATOM 1143 CA THR A 78 10.502 20.452 -19.733 1.00 1.00 C ATOM 1144 C THR A 78 9.043 20.526 -19.298 1.00 1.00 C ATOM 1145 O THR A 78 8.403 21.566 -19.425 1.00 1.00 O ATOM 1146 CB THR A 78 10.608 19.574 -20.984 1.00 1.00 C ATOM 1147 OG1 THR A 78 11.949 19.607 -21.493 1.00 1.00 O ATOM 1148 CG2 THR A 78 9.626 20.027 -22.055 1.00 1.00 C ATOM 0 H THR A 78 11.886 19.102 -18.944 1.00 1.00 H new ATOM 0 HA THR A 78 10.847 21.462 -19.956 1.00 1.00 H new ATOM 0 HB THR A 78 10.356 18.550 -20.707 1.00 1.00 H new ATOM 0 HG1 THR A 78 12.010 19.042 -22.292 1.00 1.00 H new ATOM 0 HG21 THR A 78 9.723 19.387 -22.932 1.00 1.00 H new ATOM 0 HG22 THR A 78 8.609 19.961 -21.668 1.00 1.00 H new ATOM 0 HG23 THR A 78 9.842 21.058 -22.334 1.00 1.00 H new ATOM 1156 N GLU A 79 8.542 19.432 -18.744 1.00 1.00 N ATOM 1157 CA GLU A 79 7.162 19.347 -18.286 1.00 1.00 C ATOM 1158 C GLU A 79 6.857 20.434 -17.259 1.00 1.00 C ATOM 1159 O GLU A 79 5.725 20.902 -17.146 1.00 1.00 O ATOM 1160 CB GLU A 79 6.913 17.979 -17.659 1.00 1.00 C ATOM 1161 CG GLU A 79 7.864 17.675 -16.513 1.00 1.00 C ATOM 1162 CD GLU A 79 9.118 16.946 -16.946 1.00 1.00 C ATOM 1163 OE1 GLU A 79 9.958 17.562 -17.628 1.00 1.00 O ATOM 1164 OE2 GLU A 79 9.286 15.769 -16.583 1.00 1.00 O ATOM 0 H GLU A 79 9.080 18.578 -18.599 1.00 1.00 H new ATOM 0 HA GLU A 79 6.508 19.488 -19.147 1.00 1.00 H new ATOM 0 HB2 GLU A 79 5.886 17.932 -17.295 1.00 1.00 H new ATOM 0 HB3 GLU A 79 7.015 17.209 -18.424 1.00 1.00 H new ATOM 0 HG2 GLU A 79 8.146 18.609 -16.028 1.00 1.00 H new ATOM 0 HG3 GLU A 79 7.342 17.074 -15.768 1.00 1.00 H new ATOM 1171 N HIS A 80 7.876 20.812 -16.495 1.00 1.00 N ATOM 1172 CA HIS A 80 7.724 21.859 -15.498 1.00 1.00 C ATOM 1173 C HIS A 80 7.695 23.220 -16.179 1.00 1.00 C ATOM 1174 O HIS A 80 6.871 24.061 -15.851 1.00 1.00 O ATOM 1175 CB HIS A 80 8.841 21.799 -14.453 1.00 1.00 C ATOM 1176 CG HIS A 80 8.816 20.545 -13.632 1.00 1.00 C ATOM 1177 ND1 HIS A 80 9.446 19.377 -14.010 1.00 1.00 N ATOM 1178 CD2 HIS A 80 8.219 20.278 -12.448 1.00 1.00 C ATOM 1179 CE1 HIS A 80 9.236 18.450 -13.096 1.00 1.00 C ATOM 1180 NE2 HIS A 80 8.494 18.970 -12.135 1.00 1.00 N ATOM 0 H HIS A 80 8.812 20.409 -16.548 1.00 1.00 H new ATOM 0 HA HIS A 80 6.780 21.703 -14.976 1.00 1.00 H new ATOM 0 HB2 HIS A 80 9.805 21.877 -14.956 1.00 1.00 H new ATOM 0 HB3 HIS A 80 8.757 22.661 -13.791 1.00 1.00 H new ATOM 0 HD2 HIS A 80 7.634 20.967 -11.857 1.00 1.00 H new ATOM 0 HE1 HIS A 80 9.608 17.437 -13.128 1.00 1.00 H new ATOM 0 HE2 HIS A 80 8.177 18.480 -11.298 1.00 1.00 H new ATOM 1189 N LEU A 81 8.562 23.400 -17.168 1.00 1.00 N ATOM 1190 CA LEU A 81 8.633 24.650 -17.929 1.00 1.00 C ATOM 1191 C LEU A 81 7.357 24.865 -18.742 1.00 1.00 C ATOM 1192 O LEU A 81 7.059 25.980 -19.164 1.00 1.00 O ATOM 1193 CB LEU A 81 9.836 24.623 -18.878 1.00 1.00 C ATOM 1194 CG LEU A 81 11.184 24.313 -18.227 1.00 1.00 C ATOM 1195 CD1 LEU A 81 12.250 24.082 -19.286 1.00 1.00 C ATOM 1196 CD2 LEU A 81 11.600 25.436 -17.293 1.00 1.00 C ATOM 0 H LEU A 81 9.233 22.692 -17.467 1.00 1.00 H new ATOM 0 HA LEU A 81 8.744 25.470 -17.219 1.00 1.00 H new ATOM 0 HB2 LEU A 81 9.648 23.880 -19.653 1.00 1.00 H new ATOM 0 HB3 LEU A 81 9.906 25.591 -19.374 1.00 1.00 H new ATOM 0 HG LEU A 81 11.076 23.400 -17.641 1.00 1.00 H new ATOM 0 HD11 LEU A 81 13.202 23.863 -18.802 1.00 1.00 H new ATOM 0 HD12 LEU A 81 11.961 23.241 -19.916 1.00 1.00 H new ATOM 0 HD13 LEU A 81 12.353 24.977 -19.900 1.00 1.00 H new ATOM 0 HD21 LEU A 81 12.562 25.195 -16.840 1.00 1.00 H new ATOM 0 HD22 LEU A 81 11.687 26.365 -17.857 1.00 1.00 H new ATOM 0 HD23 LEU A 81 10.850 25.555 -16.511 1.00 1.00 H new ATOM 1208 N ALA A 82 6.621 23.788 -18.966 1.00 1.00 N ATOM 1209 CA ALA A 82 5.393 23.846 -19.753 1.00 1.00 C ATOM 1210 C ALA A 82 4.206 24.234 -18.881 1.00 1.00 C ATOM 1211 O ALA A 82 3.086 24.411 -19.369 1.00 1.00 O ATOM 1212 CB ALA A 82 5.135 22.507 -20.417 1.00 1.00 C ATOM 0 H ALA A 82 6.851 22.859 -18.614 1.00 1.00 H new ATOM 0 HA ALA A 82 5.516 24.608 -20.522 1.00 1.00 H new ATOM 0 HB1 ALA A 82 4.217 22.562 -21.001 1.00 1.00 H new ATOM 0 HB2 ALA A 82 5.969 22.260 -21.074 1.00 1.00 H new ATOM 0 HB3 ALA A 82 5.034 21.736 -19.653 1.00 1.00 H new ATOM 1218 N ALA A 83 4.458 24.318 -17.582 1.00 1.00 N ATOM 1219 CA ALA A 83 3.433 24.683 -16.615 1.00 1.00 C ATOM 1220 C ALA A 83 2.863 26.069 -16.892 1.00 1.00 C ATOM 1221 O ALA A 83 3.569 26.961 -17.366 1.00 1.00 O ATOM 1222 CB ALA A 83 3.997 24.623 -15.210 1.00 1.00 C ATOM 0 H ALA A 83 5.374 24.136 -17.171 1.00 1.00 H new ATOM 0 HA ALA A 83 2.618 23.965 -16.709 1.00 1.00 H new ATOM 0 HB1 ALA A 83 3.222 24.898 -14.495 1.00 1.00 H new ATOM 0 HB2 ALA A 83 4.343 23.611 -15.000 1.00 1.00 H new ATOM 0 HB3 ALA A 83 4.833 25.317 -15.124 1.00 1.00 H new ATOM 1228 N ASP A 84 1.589 26.249 -16.561 1.00 1.00 N ATOM 1229 CA ASP A 84 0.926 27.531 -16.764 1.00 1.00 C ATOM 1230 C ASP A 84 1.397 28.531 -15.720 1.00 1.00 C ATOM 1231 O ASP A 84 1.261 29.738 -15.901 1.00 1.00 O ATOM 1232 CB ASP A 84 -0.602 27.376 -16.695 1.00 1.00 C ATOM 1233 CG ASP A 84 -1.334 28.522 -17.379 1.00 1.00 C ATOM 1234 OD1 ASP A 84 -0.966 28.872 -18.526 1.00 1.00 O ATOM 1235 OD2 ASP A 84 -2.297 29.058 -16.792 1.00 1.00 O ATOM 0 H ASP A 84 0.997 25.526 -16.152 1.00 1.00 H new ATOM 0 HA ASP A 84 1.187 27.899 -17.756 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -0.890 26.434 -17.162 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -0.912 27.322 -15.651 1.00 1.00 H new ATOM 1240 N LEU A 85 2.064 28.018 -14.690 1.00 1.00 N ATOM 1241 CA LEU A 85 2.550 28.844 -13.597 1.00 1.00 C ATOM 1242 C LEU A 85 3.751 28.184 -12.933 1.00 1.00 C ATOM 1243 O LEU A 85 3.677 27.036 -12.500 1.00 1.00 O ATOM 1244 CB LEU A 85 1.446 29.018 -12.545 1.00 1.00 C ATOM 1245 CG LEU A 85 1.555 30.238 -11.615 1.00 1.00 C ATOM 1246 CD1 LEU A 85 0.541 30.120 -10.508 1.00 1.00 C ATOM 1247 CD2 LEU A 85 2.930 30.377 -11.010 1.00 1.00 C ATOM 0 H LEU A 85 2.280 27.026 -14.593 1.00 1.00 H new ATOM 0 HA LEU A 85 2.839 29.814 -14.001 1.00 1.00 H new ATOM 0 HB2 LEU A 85 0.489 29.072 -13.064 1.00 1.00 H new ATOM 0 HB3 LEU A 85 1.423 28.121 -11.926 1.00 1.00 H new ATOM 0 HG LEU A 85 1.365 31.125 -12.220 1.00 1.00 H new ATOM 0 HD11 LEU A 85 0.619 30.985 -9.849 1.00 1.00 H new ATOM 0 HD12 LEU A 85 -0.461 30.078 -10.935 1.00 1.00 H new ATOM 0 HD13 LEU A 85 0.730 29.211 -9.937 1.00 1.00 H new ATOM 0 HD21 LEU A 85 2.955 31.253 -10.362 1.00 1.00 H new ATOM 0 HD22 LEU A 85 3.162 29.486 -10.426 1.00 1.00 H new ATOM 0 HD23 LEU A 85 3.667 30.492 -11.805 1.00 1.00 H new ATOM 1259 N LEU A 86 4.864 28.899 -12.898 1.00 1.00 N ATOM 1260 CA LEU A 86 6.045 28.438 -12.197 1.00 1.00 C ATOM 1261 C LEU A 86 6.230 29.275 -10.939 1.00 1.00 C ATOM 1262 O LEU A 86 6.646 30.425 -11.013 1.00 1.00 O ATOM 1263 CB LEU A 86 7.262 28.558 -13.103 1.00 1.00 C ATOM 1264 CG LEU A 86 6.969 28.272 -14.567 1.00 1.00 C ATOM 1265 CD1 LEU A 86 7.693 29.263 -15.438 1.00 1.00 C ATOM 1266 CD2 LEU A 86 7.373 26.880 -14.956 1.00 1.00 C ATOM 0 H LEU A 86 4.971 29.807 -13.351 1.00 1.00 H new ATOM 0 HA LEU A 86 5.928 27.391 -11.917 1.00 1.00 H new ATOM 0 HB2 LEU A 86 7.671 29.564 -13.014 1.00 1.00 H new ATOM 0 HB3 LEU A 86 8.032 27.869 -12.755 1.00 1.00 H new ATOM 0 HG LEU A 86 5.892 28.364 -14.710 1.00 1.00 H new ATOM 0 HD11 LEU A 86 7.478 29.052 -16.486 1.00 1.00 H new ATOM 0 HD12 LEU A 86 7.360 30.272 -15.196 1.00 1.00 H new ATOM 0 HD13 LEU A 86 8.766 29.184 -15.265 1.00 1.00 H new ATOM 0 HD21 LEU A 86 7.147 26.716 -16.010 1.00 1.00 H new ATOM 0 HD22 LEU A 86 8.443 26.752 -14.791 1.00 1.00 H new ATOM 0 HD23 LEU A 86 6.823 26.159 -14.351 1.00 1.00 H new ATOM 1278 N VAL A 87 5.914 28.696 -9.796 1.00 1.00 N ATOM 1279 CA VAL A 87 6.019 29.416 -8.533 1.00 1.00 C ATOM 1280 C VAL A 87 7.440 29.351 -7.990 1.00 1.00 C ATOM 1281 O VAL A 87 7.831 28.399 -7.318 1.00 1.00 O ATOM 1282 CB VAL A 87 5.027 28.887 -7.474 1.00 1.00 C ATOM 1283 CG1 VAL A 87 5.320 29.484 -6.116 1.00 1.00 C ATOM 1284 CG2 VAL A 87 3.603 29.212 -7.869 1.00 1.00 C ATOM 0 H VAL A 87 5.584 27.735 -9.712 1.00 1.00 H new ATOM 0 HA VAL A 87 5.760 30.454 -8.741 1.00 1.00 H new ATOM 0 HB VAL A 87 5.146 27.805 -7.419 1.00 1.00 H new ATOM 0 HG11 VAL A 87 4.608 29.096 -5.387 1.00 1.00 H new ATOM 0 HG12 VAL A 87 6.332 29.217 -5.812 1.00 1.00 H new ATOM 0 HG13 VAL A 87 5.231 30.569 -6.169 1.00 1.00 H new ATOM 0 HG21 VAL A 87 2.919 28.831 -7.110 1.00 1.00 H new ATOM 0 HG22 VAL A 87 3.486 30.292 -7.953 1.00 1.00 H new ATOM 0 HG23 VAL A 87 3.376 28.747 -8.828 1.00 1.00 H new ATOM 1294 N ALA A 88 8.230 30.335 -8.357 1.00 1.00 N ATOM 1295 CA ALA A 88 9.602 30.394 -7.912 1.00 1.00 C ATOM 1296 C ALA A 88 9.700 30.963 -6.506 1.00 1.00 C ATOM 1297 O ALA A 88 8.899 31.807 -6.101 1.00 1.00 O ATOM 1298 CB ALA A 88 10.449 31.192 -8.882 1.00 1.00 C ATOM 0 H ALA A 88 7.945 31.105 -8.962 1.00 1.00 H new ATOM 0 HA ALA A 88 9.989 29.375 -7.884 1.00 1.00 H new ATOM 0 HB1 ALA A 88 11.479 31.223 -8.526 1.00 1.00 H new ATOM 0 HB2 ALA A 88 10.419 30.721 -9.864 1.00 1.00 H new ATOM 0 HB3 ALA A 88 10.060 32.208 -8.955 1.00 1.00 H new ATOM 1304 N LEU A 89 10.676 30.477 -5.762 1.00 1.00 N ATOM 1305 CA LEU A 89 10.917 30.944 -4.407 1.00 1.00 C ATOM 1306 C LEU A 89 12.080 31.928 -4.406 1.00 1.00 C ATOM 1307 O LEU A 89 12.384 32.560 -3.403 1.00 1.00 O ATOM 1308 CB LEU A 89 11.218 29.757 -3.477 1.00 1.00 C ATOM 1309 CG LEU A 89 9.995 29.006 -2.931 1.00 1.00 C ATOM 1310 CD1 LEU A 89 9.062 29.963 -2.206 1.00 1.00 C ATOM 1311 CD2 LEU A 89 9.253 28.282 -4.045 1.00 1.00 C ATOM 0 H LEU A 89 11.321 29.752 -6.076 1.00 1.00 H new ATOM 0 HA LEU A 89 10.023 31.448 -4.039 1.00 1.00 H new ATOM 0 HB2 LEU A 89 11.845 29.047 -4.017 1.00 1.00 H new ATOM 0 HB3 LEU A 89 11.803 30.121 -2.633 1.00 1.00 H new ATOM 0 HG LEU A 89 10.349 28.259 -2.221 1.00 1.00 H new ATOM 0 HD11 LEU A 89 8.201 29.413 -1.826 1.00 1.00 H new ATOM 0 HD12 LEU A 89 9.592 30.428 -1.375 1.00 1.00 H new ATOM 0 HD13 LEU A 89 8.723 30.735 -2.897 1.00 1.00 H new ATOM 0 HD21 LEU A 89 8.392 27.759 -3.629 1.00 1.00 H new ATOM 0 HD22 LEU A 89 8.914 29.005 -4.787 1.00 1.00 H new ATOM 0 HD23 LEU A 89 9.920 27.562 -4.519 1.00 1.00 H new ATOM 1323 N ASP A 90 12.696 32.070 -5.570 1.00 1.00 N ATOM 1324 CA ASP A 90 13.849 32.949 -5.732 1.00 1.00 C ATOM 1325 C ASP A 90 13.871 33.537 -7.136 1.00 1.00 C ATOM 1326 O ASP A 90 13.501 32.861 -8.101 1.00 1.00 O ATOM 1327 CB ASP A 90 15.132 32.146 -5.479 1.00 1.00 C ATOM 1328 CG ASP A 90 16.396 32.979 -5.383 1.00 1.00 C ATOM 1329 OD1 ASP A 90 16.684 33.747 -6.314 1.00 1.00 O ATOM 1330 OD2 ASP A 90 17.124 32.831 -4.385 1.00 1.00 O ATOM 0 H ASP A 90 12.416 31.585 -6.423 1.00 1.00 H new ATOM 0 HA ASP A 90 13.782 33.768 -5.016 1.00 1.00 H new ATOM 0 HB2 ASP A 90 15.014 31.582 -4.554 1.00 1.00 H new ATOM 0 HB3 ASP A 90 15.253 31.419 -6.282 1.00 1.00 H new ATOM 1335 N ARG A 91 14.329 34.780 -7.237 1.00 1.00 N ATOM 1336 CA ARG A 91 14.473 35.487 -8.515 1.00 1.00 C ATOM 1337 C ARG A 91 15.342 34.695 -9.489 1.00 1.00 C ATOM 1338 O ARG A 91 15.171 34.779 -10.703 1.00 1.00 O ATOM 1339 CB ARG A 91 15.129 36.846 -8.274 1.00 1.00 C ATOM 1340 CG ARG A 91 16.360 36.731 -7.391 1.00 1.00 C ATOM 1341 CD ARG A 91 17.194 37.996 -7.354 1.00 1.00 C ATOM 1342 NE ARG A 91 18.381 37.801 -6.520 1.00 1.00 N ATOM 1343 CZ ARG A 91 19.608 38.217 -6.834 1.00 1.00 C ATOM 1344 NH1 ARG A 91 19.816 38.969 -7.907 1.00 1.00 N ATOM 1345 NH2 ARG A 91 20.632 37.901 -6.054 1.00 1.00 N ATOM 0 H ARG A 91 14.615 35.334 -6.430 1.00 1.00 H new ATOM 0 HA ARG A 91 13.479 35.610 -8.946 1.00 1.00 H new ATOM 0 HB2 ARG A 91 15.408 37.289 -9.230 1.00 1.00 H new ATOM 0 HB3 ARG A 91 14.409 37.519 -7.808 1.00 1.00 H new ATOM 0 HG2 ARG A 91 16.049 36.480 -6.377 1.00 1.00 H new ATOM 0 HG3 ARG A 91 16.978 35.907 -7.748 1.00 1.00 H new ATOM 0 HD2 ARG A 91 17.494 38.271 -8.365 1.00 1.00 H new ATOM 0 HD3 ARG A 91 16.598 38.821 -6.962 1.00 1.00 H new ATOM 0 HE ARG A 91 18.261 37.311 -5.634 1.00 1.00 H new ATOM 0 HH11 ARG A 91 19.032 39.235 -8.503 1.00 1.00 H new ATOM 0 HH12 ARG A 91 20.760 39.281 -8.136 1.00 1.00 H new ATOM 0 HH21 ARG A 91 20.480 37.341 -5.215 1.00 1.00 H new ATOM 0 HH22 ARG A 91 21.572 38.218 -6.292 1.00 1.00 H new ATOM 1359 N ASN A 92 16.224 33.873 -8.936 1.00 1.00 N ATOM 1360 CA ASN A 92 17.140 33.090 -9.746 1.00 1.00 C ATOM 1361 C ASN A 92 16.401 31.932 -10.388 1.00 1.00 C ATOM 1362 O ASN A 92 16.468 31.735 -11.596 1.00 1.00 O ATOM 1363 CB ASN A 92 18.284 32.557 -8.887 1.00 1.00 C ATOM 1364 CG ASN A 92 19.328 33.605 -8.565 1.00 1.00 C ATOM 1365 OD1 ASN A 92 19.588 34.513 -9.357 1.00 1.00 O ATOM 1366 ND2 ASN A 92 19.940 33.483 -7.400 1.00 1.00 N ATOM 0 H ASN A 92 16.322 33.733 -7.930 1.00 1.00 H new ATOM 0 HA ASN A 92 17.552 33.731 -10.525 1.00 1.00 H new ATOM 0 HB2 ASN A 92 17.877 32.161 -7.956 1.00 1.00 H new ATOM 0 HB3 ASN A 92 18.761 31.725 -9.405 1.00 1.00 H new ATOM 0 HD21 ASN A 92 20.657 34.155 -7.128 1.00 1.00 H new ATOM 0 HD22 ASN A 92 19.695 32.717 -6.773 1.00 1.00 H new ATOM 1373 N HIS A 93 15.645 31.199 -9.568 1.00 1.00 N ATOM 1374 CA HIS A 93 14.867 30.062 -10.056 1.00 1.00 C ATOM 1375 C HIS A 93 13.906 30.535 -11.139 1.00 1.00 C ATOM 1376 O HIS A 93 13.783 29.904 -12.189 1.00 1.00 O ATOM 1377 CB HIS A 93 14.070 29.381 -8.926 1.00 1.00 C ATOM 1378 CG HIS A 93 14.867 29.084 -7.684 1.00 1.00 C ATOM 1379 ND1 HIS A 93 14.334 29.180 -6.420 1.00 1.00 N ATOM 1380 CD2 HIS A 93 16.163 28.715 -7.511 1.00 1.00 C ATOM 1381 CE1 HIS A 93 15.263 28.898 -5.527 1.00 1.00 C ATOM 1382 NE2 HIS A 93 16.384 28.612 -6.159 1.00 1.00 N ATOM 0 H HIS A 93 15.556 31.373 -8.567 1.00 1.00 H new ATOM 0 HA HIS A 93 15.565 29.329 -10.460 1.00 1.00 H new ATOM 0 HB2 HIS A 93 13.229 30.020 -8.657 1.00 1.00 H new ATOM 0 HB3 HIS A 93 13.653 28.448 -9.305 1.00 1.00 H new ATOM 0 HD1 HIS A 93 13.369 29.431 -6.206 1.00 1.00 H new ATOM 0 HD2 HIS A 93 16.886 28.536 -8.293 1.00 1.00 H new ATOM 0 HE1 HIS A 93 15.128 28.901 -4.456 1.00 1.00 H new ATOM 1391 N ALA A 94 13.262 31.675 -10.889 1.00 1.00 N ATOM 1392 CA ALA A 94 12.333 32.265 -11.847 1.00 1.00 C ATOM 1393 C ALA A 94 13.039 32.573 -13.164 1.00 1.00 C ATOM 1394 O ALA A 94 12.534 32.248 -14.245 1.00 1.00 O ATOM 1395 CB ALA A 94 11.705 33.528 -11.272 1.00 1.00 C ATOM 0 H ALA A 94 13.369 32.209 -10.026 1.00 1.00 H new ATOM 0 HA ALA A 94 11.541 31.543 -12.044 1.00 1.00 H new ATOM 0 HB1 ALA A 94 11.015 33.955 -12.000 1.00 1.00 H new ATOM 0 HB2 ALA A 94 11.163 33.282 -10.359 1.00 1.00 H new ATOM 0 HB3 ALA A 94 12.487 34.252 -11.045 1.00 1.00 H new ATOM 1401 N ARG A 95 14.212 33.203 -13.061 1.00 1.00 N ATOM 1402 CA ARG A 95 15.011 33.556 -14.229 1.00 1.00 C ATOM 1403 C ARG A 95 15.391 32.323 -15.035 1.00 1.00 C ATOM 1404 O ARG A 95 15.298 32.331 -16.261 1.00 1.00 O ATOM 1405 CB ARG A 95 16.272 34.332 -13.811 1.00 1.00 C ATOM 1406 CG ARG A 95 17.434 34.198 -14.789 1.00 1.00 C ATOM 1407 CD ARG A 95 18.478 35.289 -14.596 1.00 1.00 C ATOM 1408 NE ARG A 95 17.979 36.612 -14.983 1.00 1.00 N ATOM 1409 CZ ARG A 95 18.770 37.642 -15.306 1.00 1.00 C ATOM 1410 NH1 ARG A 95 20.090 37.526 -15.240 1.00 1.00 N ATOM 1411 NH2 ARG A 95 18.236 38.796 -15.681 1.00 1.00 N ATOM 0 H ARG A 95 14.629 33.479 -12.172 1.00 1.00 H new ATOM 0 HA ARG A 95 14.400 34.198 -14.864 1.00 1.00 H new ATOM 0 HB2 ARG A 95 16.019 35.387 -13.706 1.00 1.00 H new ATOM 0 HB3 ARG A 95 16.594 33.982 -12.830 1.00 1.00 H new ATOM 0 HG2 ARG A 95 17.903 33.222 -14.662 1.00 1.00 H new ATOM 0 HG3 ARG A 95 17.054 34.238 -15.810 1.00 1.00 H new ATOM 0 HD2 ARG A 95 18.788 35.311 -13.551 1.00 1.00 H new ATOM 0 HD3 ARG A 95 19.363 35.050 -15.186 1.00 1.00 H new ATOM 0 HE ARG A 95 16.970 36.756 -15.008 1.00 1.00 H new ATOM 0 HH11 ARG A 95 20.510 36.646 -14.941 1.00 1.00 H new ATOM 0 HH12 ARG A 95 20.684 38.317 -15.488 1.00 1.00 H new ATOM 0 HH21 ARG A 95 17.222 38.899 -15.723 1.00 1.00 H new ATOM 0 HH22 ARG A 95 18.839 39.581 -15.927 1.00 1.00 H new ATOM 1425 N LEU A 96 15.721 31.240 -14.341 1.00 1.00 N ATOM 1426 CA LEU A 96 16.156 30.021 -15.009 1.00 1.00 C ATOM 1427 C LEU A 96 15.017 29.426 -15.816 1.00 1.00 C ATOM 1428 O LEU A 96 15.146 29.221 -17.011 1.00 1.00 O ATOM 1429 CB LEU A 96 16.671 28.990 -13.995 1.00 1.00 C ATOM 1430 CG LEU A 96 17.757 29.500 -13.049 1.00 1.00 C ATOM 1431 CD1 LEU A 96 18.240 28.389 -12.134 1.00 1.00 C ATOM 1432 CD2 LEU A 96 18.918 30.090 -13.834 1.00 1.00 C ATOM 0 H LEU A 96 15.696 31.181 -13.323 1.00 1.00 H new ATOM 0 HA LEU A 96 16.973 30.281 -15.682 1.00 1.00 H new ATOM 0 HB2 LEU A 96 15.829 28.636 -13.400 1.00 1.00 H new ATOM 0 HB3 LEU A 96 17.060 28.130 -14.540 1.00 1.00 H new ATOM 0 HG LEU A 96 17.326 30.287 -12.430 1.00 1.00 H new ATOM 0 HD11 LEU A 96 19.013 28.775 -11.469 1.00 1.00 H new ATOM 0 HD12 LEU A 96 17.404 28.017 -11.541 1.00 1.00 H new ATOM 0 HD13 LEU A 96 18.650 27.576 -12.734 1.00 1.00 H new ATOM 0 HD21 LEU A 96 19.681 30.447 -13.142 1.00 1.00 H new ATOM 0 HD22 LEU A 96 19.346 29.325 -14.482 1.00 1.00 H new ATOM 0 HD23 LEU A 96 18.561 30.921 -14.442 1.00 1.00 H new ATOM 1444 N LEU A 97 13.872 29.269 -15.170 1.00 1.00 N ATOM 1445 CA LEU A 97 12.689 28.689 -15.806 1.00 1.00 C ATOM 1446 C LEU A 97 12.339 29.416 -17.103 1.00 1.00 C ATOM 1447 O LEU A 97 12.239 28.804 -18.163 1.00 1.00 O ATOM 1448 CB LEU A 97 11.486 28.786 -14.865 1.00 1.00 C ATOM 1449 CG LEU A 97 11.617 28.058 -13.531 1.00 1.00 C ATOM 1450 CD1 LEU A 97 10.702 28.692 -12.499 1.00 1.00 C ATOM 1451 CD2 LEU A 97 11.275 26.591 -13.701 1.00 1.00 C ATOM 0 H LEU A 97 13.732 29.537 -14.196 1.00 1.00 H new ATOM 0 HA LEU A 97 12.919 27.647 -16.029 1.00 1.00 H new ATOM 0 HB2 LEU A 97 11.292 29.840 -14.663 1.00 1.00 H new ATOM 0 HB3 LEU A 97 10.611 28.395 -15.385 1.00 1.00 H new ATOM 0 HG LEU A 97 12.647 28.140 -13.185 1.00 1.00 H new ATOM 0 HD11 LEU A 97 10.803 28.165 -11.550 1.00 1.00 H new ATOM 0 HD12 LEU A 97 10.976 29.738 -12.364 1.00 1.00 H new ATOM 0 HD13 LEU A 97 9.669 28.629 -12.841 1.00 1.00 H new ATOM 0 HD21 LEU A 97 11.372 26.081 -12.742 1.00 1.00 H new ATOM 0 HD22 LEU A 97 10.251 26.496 -14.061 1.00 1.00 H new ATOM 0 HD23 LEU A 97 11.956 26.140 -14.422 1.00 1.00 H new ATOM 1463 N ARG A 98 12.140 30.724 -17.005 1.00 1.00 N ATOM 1464 CA ARG A 98 11.743 31.519 -18.159 1.00 1.00 C ATOM 1465 C ARG A 98 12.805 31.495 -19.259 1.00 1.00 C ATOM 1466 O ARG A 98 12.482 31.301 -20.427 1.00 1.00 O ATOM 1467 CB ARG A 98 11.399 32.952 -17.738 1.00 1.00 C ATOM 1468 CG ARG A 98 12.565 33.775 -17.207 1.00 1.00 C ATOM 1469 CD ARG A 98 12.063 34.818 -16.229 1.00 1.00 C ATOM 1470 NE ARG A 98 12.971 35.953 -16.069 1.00 1.00 N ATOM 1471 CZ ARG A 98 12.972 37.016 -16.872 1.00 1.00 C ATOM 1472 NH1 ARG A 98 12.216 37.019 -17.968 1.00 1.00 N ATOM 1473 NH2 ARG A 98 13.731 38.070 -16.593 1.00 1.00 N ATOM 0 H ARG A 98 12.247 31.255 -16.141 1.00 1.00 H new ATOM 0 HA ARG A 98 10.845 31.067 -18.580 1.00 1.00 H new ATOM 0 HB2 ARG A 98 10.970 33.471 -18.595 1.00 1.00 H new ATOM 0 HB3 ARG A 98 10.626 32.911 -16.971 1.00 1.00 H new ATOM 0 HG2 ARG A 98 13.287 33.123 -16.716 1.00 1.00 H new ATOM 0 HG3 ARG A 98 13.084 34.260 -18.034 1.00 1.00 H new ATOM 0 HD2 ARG A 98 11.093 35.184 -16.566 1.00 1.00 H new ATOM 0 HD3 ARG A 98 11.907 34.348 -15.258 1.00 1.00 H new ATOM 0 HE ARG A 98 13.641 35.930 -15.300 1.00 1.00 H new ATOM 0 HH11 ARG A 98 11.638 36.209 -18.191 1.00 1.00 H new ATOM 0 HH12 ARG A 98 12.215 37.832 -18.585 1.00 1.00 H new ATOM 0 HH21 ARG A 98 14.318 38.069 -15.759 1.00 1.00 H new ATOM 0 HH22 ARG A 98 13.726 38.880 -17.213 1.00 1.00 H new ATOM 1487 N GLN A 99 14.071 31.638 -18.886 1.00 1.00 N ATOM 1488 CA GLN A 99 15.150 31.617 -19.870 1.00 1.00 C ATOM 1489 C GLN A 99 15.258 30.227 -20.503 1.00 1.00 C ATOM 1490 O GLN A 99 15.750 30.068 -21.619 1.00 1.00 O ATOM 1491 CB GLN A 99 16.480 32.041 -19.220 1.00 1.00 C ATOM 1492 CG GLN A 99 17.177 30.963 -18.397 1.00 1.00 C ATOM 1493 CD GLN A 99 18.346 30.316 -19.123 1.00 1.00 C ATOM 1494 OE1 GLN A 99 18.369 30.234 -20.349 1.00 1.00 O ATOM 1495 NE2 GLN A 99 19.329 29.846 -18.367 1.00 1.00 N ATOM 0 H GLN A 99 14.375 31.768 -17.921 1.00 1.00 H new ATOM 0 HA GLN A 99 14.924 32.333 -20.660 1.00 1.00 H new ATOM 0 HB2 GLN A 99 17.160 32.371 -20.005 1.00 1.00 H new ATOM 0 HB3 GLN A 99 16.293 32.901 -18.577 1.00 1.00 H new ATOM 0 HG2 GLN A 99 17.534 31.401 -17.465 1.00 1.00 H new ATOM 0 HG3 GLN A 99 16.453 30.193 -18.131 1.00 1.00 H new ATOM 0 HE21 GLN A 99 19.277 29.931 -17.352 1.00 1.00 H new ATOM 0 HE22 GLN A 99 20.137 29.399 -18.801 1.00 1.00 H new ATOM 1504 N LEU A 100 14.746 29.235 -19.786 1.00 1.00 N ATOM 1505 CA LEU A 100 14.774 27.855 -20.238 1.00 1.00 C ATOM 1506 C LEU A 100 13.702 27.582 -21.287 1.00 1.00 C ATOM 1507 O LEU A 100 13.769 26.577 -21.996 1.00 1.00 O ATOM 1508 CB LEU A 100 14.615 26.904 -19.048 1.00 1.00 C ATOM 1509 CG LEU A 100 15.854 26.766 -18.157 1.00 1.00 C ATOM 1510 CD1 LEU A 100 15.775 25.509 -17.305 1.00 1.00 C ATOM 1511 CD2 LEU A 100 17.129 26.790 -18.989 1.00 1.00 C ATOM 0 H LEU A 100 14.301 29.366 -18.877 1.00 1.00 H new ATOM 0 HA LEU A 100 15.742 27.679 -20.707 1.00 1.00 H new ATOM 0 HB2 LEU A 100 13.782 27.250 -18.435 1.00 1.00 H new ATOM 0 HB3 LEU A 100 14.346 25.917 -19.425 1.00 1.00 H new ATOM 0 HG LEU A 100 15.882 27.622 -17.483 1.00 1.00 H new ATOM 0 HD11 LEU A 100 16.666 25.435 -16.682 1.00 1.00 H new ATOM 0 HD12 LEU A 100 14.891 25.555 -16.669 1.00 1.00 H new ATOM 0 HD13 LEU A 100 15.711 24.634 -17.952 1.00 1.00 H new ATOM 0 HD21 LEU A 100 17.994 26.690 -18.333 1.00 1.00 H new ATOM 0 HD22 LEU A 100 17.116 25.963 -19.699 1.00 1.00 H new ATOM 0 HD23 LEU A 100 17.192 27.733 -19.531 1.00 1.00 H new ATOM 1523 N GLY A 101 12.758 28.505 -21.434 1.00 1.00 N ATOM 1524 CA GLY A 101 11.696 28.307 -22.397 1.00 1.00 C ATOM 1525 C GLY A 101 10.433 29.061 -22.056 1.00 1.00 C ATOM 1526 O GLY A 101 9.689 29.475 -22.944 1.00 1.00 O ATOM 0 H GLY A 101 12.710 29.378 -20.908 1.00 1.00 H new ATOM 0 HA2 GLY A 101 12.044 28.621 -23.381 1.00 1.00 H new ATOM 0 HA3 GLY A 101 11.469 27.243 -22.464 1.00 1.00 H new ATOM 1530 N VAL A 102 10.171 29.193 -20.769 1.00 1.00 N ATOM 1531 CA VAL A 102 8.958 29.838 -20.291 1.00 1.00 C ATOM 1532 C VAL A 102 9.028 31.363 -20.409 1.00 1.00 C ATOM 1533 O VAL A 102 9.739 31.913 -21.244 1.00 1.00 O ATOM 1534 CB VAL A 102 8.642 29.458 -18.836 1.00 1.00 C ATOM 1535 CG1 VAL A 102 7.143 29.450 -18.611 1.00 1.00 C ATOM 1536 CG2 VAL A 102 9.241 28.118 -18.458 1.00 1.00 C ATOM 0 H VAL A 102 10.787 28.859 -20.028 1.00 1.00 H new ATOM 0 HA VAL A 102 8.157 29.475 -20.935 1.00 1.00 H new ATOM 0 HB VAL A 102 9.097 30.211 -18.192 1.00 1.00 H new ATOM 0 HG11 VAL A 102 6.932 29.179 -17.576 1.00 1.00 H new ATOM 0 HG12 VAL A 102 6.739 30.441 -18.816 1.00 1.00 H new ATOM 0 HG13 VAL A 102 6.679 28.724 -19.278 1.00 1.00 H new ATOM 0 HG21 VAL A 102 8.994 27.888 -17.422 1.00 1.00 H new ATOM 0 HG22 VAL A 102 8.837 27.342 -19.108 1.00 1.00 H new ATOM 0 HG23 VAL A 102 10.324 28.159 -18.572 1.00 1.00 H new ATOM 1546 N GLU A 103 8.295 32.037 -19.532 1.00 1.00 N ATOM 1547 CA GLU A 103 8.195 33.484 -19.539 1.00 1.00 C ATOM 1548 C GLU A 103 7.610 33.949 -18.216 1.00 1.00 C ATOM 1549 O GLU A 103 7.050 33.148 -17.463 1.00 1.00 O ATOM 1550 CB GLU A 103 7.297 33.954 -20.684 1.00 1.00 C ATOM 1551 CG GLU A 103 5.883 33.409 -20.608 1.00 1.00 C ATOM 1552 CD GLU A 103 5.097 33.679 -21.869 1.00 1.00 C ATOM 1553 OE1 GLU A 103 5.164 32.852 -22.799 1.00 1.00 O ATOM 1554 OE2 GLU A 103 4.410 34.716 -21.934 1.00 1.00 O ATOM 0 H GLU A 103 7.752 31.590 -18.794 1.00 1.00 H new ATOM 0 HA GLU A 103 9.190 33.907 -19.679 1.00 1.00 H new ATOM 0 HB2 GLU A 103 7.259 35.043 -20.681 1.00 1.00 H new ATOM 0 HB3 GLU A 103 7.743 33.653 -21.632 1.00 1.00 H new ATOM 0 HG2 GLU A 103 5.919 32.335 -20.428 1.00 1.00 H new ATOM 0 HG3 GLU A 103 5.368 33.857 -19.758 1.00 1.00 H new ATOM 1561 N ALA A 104 7.695 35.246 -17.962 1.00 1.00 N ATOM 1562 CA ALA A 104 7.267 35.807 -16.686 1.00 1.00 C ATOM 1563 C ALA A 104 5.759 35.696 -16.496 1.00 1.00 C ATOM 1564 O ALA A 104 5.259 35.788 -15.375 1.00 1.00 O ATOM 1565 CB ALA A 104 7.721 37.257 -16.572 1.00 1.00 C ATOM 0 H ALA A 104 8.057 35.933 -18.623 1.00 1.00 H new ATOM 0 HA ALA A 104 7.735 35.226 -15.891 1.00 1.00 H new ATOM 0 HB1 ALA A 104 7.396 37.666 -15.615 1.00 1.00 H new ATOM 0 HB2 ALA A 104 8.808 37.304 -16.636 1.00 1.00 H new ATOM 0 HB3 ALA A 104 7.284 37.840 -17.383 1.00 1.00 H new ATOM 1571 N ALA A 105 5.034 35.588 -17.603 1.00 1.00 N ATOM 1572 CA ALA A 105 3.592 35.402 -17.555 1.00 1.00 C ATOM 1573 C ALA A 105 3.240 34.145 -16.769 1.00 1.00 C ATOM 1574 O ALA A 105 2.223 34.085 -16.079 1.00 1.00 O ATOM 1575 CB ALA A 105 3.017 35.331 -18.960 1.00 1.00 C ATOM 0 H ALA A 105 5.423 35.626 -18.545 1.00 1.00 H new ATOM 0 HA ALA A 105 3.152 36.259 -17.046 1.00 1.00 H new ATOM 0 HB1 ALA A 105 1.937 35.192 -18.905 1.00 1.00 H new ATOM 0 HB2 ALA A 105 3.237 36.258 -19.490 1.00 1.00 H new ATOM 0 HB3 ALA A 105 3.464 34.493 -19.494 1.00 1.00 H new ATOM 1581 N ARG A 106 4.095 33.134 -16.894 1.00 1.00 N ATOM 1582 CA ARG A 106 3.870 31.862 -16.226 1.00 1.00 C ATOM 1583 C ARG A 106 4.681 31.774 -14.945 1.00 1.00 C ATOM 1584 O ARG A 106 4.178 31.331 -13.921 1.00 1.00 O ATOM 1585 CB ARG A 106 4.212 30.687 -17.141 1.00 1.00 C ATOM 1586 CG ARG A 106 4.072 31.015 -18.613 1.00 1.00 C ATOM 1587 CD ARG A 106 3.922 29.757 -19.436 1.00 1.00 C ATOM 1588 NE ARG A 106 2.554 29.243 -19.427 1.00 1.00 N ATOM 1589 CZ ARG A 106 2.152 28.217 -20.172 1.00 1.00 C ATOM 1590 NH1 ARG A 106 3.019 27.600 -20.969 1.00 1.00 N ATOM 1591 NH2 ARG A 106 0.891 27.809 -20.115 1.00 1.00 N ATOM 0 H ARG A 106 4.948 33.174 -17.452 1.00 1.00 H new ATOM 0 HA ARG A 106 2.810 31.807 -15.977 1.00 1.00 H new ATOM 0 HB2 ARG A 106 5.235 30.367 -16.943 1.00 1.00 H new ATOM 0 HB3 ARG A 106 3.562 29.846 -16.900 1.00 1.00 H new ATOM 0 HG2 ARG A 106 3.206 31.659 -18.765 1.00 1.00 H new ATOM 0 HG3 ARG A 106 4.946 31.572 -18.950 1.00 1.00 H new ATOM 0 HD2 ARG A 106 4.224 29.961 -20.463 1.00 1.00 H new ATOM 0 HD3 ARG A 106 4.597 28.992 -19.051 1.00 1.00 H new ATOM 0 HE ARG A 106 1.872 29.695 -18.818 1.00 1.00 H new ATOM 0 HH11 ARG A 106 3.989 27.914 -21.008 1.00 1.00 H new ATOM 0 HH12 ARG A 106 2.714 26.813 -21.542 1.00 1.00 H new ATOM 0 HH21 ARG A 106 0.229 28.282 -19.500 1.00 1.00 H new ATOM 0 HH22 ARG A 106 0.583 27.022 -20.687 1.00 1.00 H new ATOM 1605 N VAL A 107 5.923 32.243 -14.979 1.00 1.00 N ATOM 1606 CA VAL A 107 6.774 32.174 -13.805 1.00 1.00 C ATOM 1607 C VAL A 107 6.445 33.306 -12.831 1.00 1.00 C ATOM 1608 O VAL A 107 6.478 34.489 -13.177 1.00 1.00 O ATOM 1609 CB VAL A 107 8.278 32.207 -14.183 1.00 1.00 C ATOM 1610 CG1 VAL A 107 8.688 33.549 -14.744 1.00 1.00 C ATOM 1611 CG2 VAL A 107 9.140 31.838 -12.988 1.00 1.00 C ATOM 0 H VAL A 107 6.356 32.670 -15.798 1.00 1.00 H new ATOM 0 HA VAL A 107 6.576 31.221 -13.315 1.00 1.00 H new ATOM 0 HB VAL A 107 8.434 31.465 -14.967 1.00 1.00 H new ATOM 0 HG11 VAL A 107 9.748 33.530 -14.996 1.00 1.00 H new ATOM 0 HG12 VAL A 107 8.106 33.762 -15.641 1.00 1.00 H new ATOM 0 HG13 VAL A 107 8.506 34.325 -14.001 1.00 1.00 H new ATOM 0 HG21 VAL A 107 10.191 31.867 -13.275 1.00 1.00 H new ATOM 0 HG22 VAL A 107 8.964 32.548 -12.180 1.00 1.00 H new ATOM 0 HG23 VAL A 107 8.884 30.834 -12.651 1.00 1.00 H new ATOM 1621 N ARG A 108 6.083 32.934 -11.621 1.00 1.00 N ATOM 1622 CA ARG A 108 5.715 33.902 -10.612 1.00 1.00 C ATOM 1623 C ARG A 108 6.311 33.515 -9.275 1.00 1.00 C ATOM 1624 O ARG A 108 6.524 32.343 -8.996 1.00 1.00 O ATOM 1625 CB ARG A 108 4.197 33.991 -10.470 1.00 1.00 C ATOM 1626 CG ARG A 108 3.469 34.351 -11.750 1.00 1.00 C ATOM 1627 CD ARG A 108 3.826 35.755 -12.198 1.00 1.00 C ATOM 1628 NE ARG A 108 3.607 36.739 -11.134 1.00 1.00 N ATOM 1629 CZ ARG A 108 3.664 38.060 -11.316 1.00 1.00 C ATOM 1630 NH1 ARG A 108 3.868 38.557 -12.531 1.00 1.00 N ATOM 1631 NH2 ARG A 108 3.521 38.879 -10.280 1.00 1.00 N ATOM 0 H ARG A 108 6.036 31.963 -11.312 1.00 1.00 H new ATOM 0 HA ARG A 108 6.102 34.872 -10.923 1.00 1.00 H new ATOM 0 HB2 ARG A 108 3.821 33.033 -10.109 1.00 1.00 H new ATOM 0 HB3 ARG A 108 3.958 34.734 -9.709 1.00 1.00 H new ATOM 0 HG2 ARG A 108 3.727 33.638 -12.533 1.00 1.00 H new ATOM 0 HG3 ARG A 108 2.393 34.277 -11.594 1.00 1.00 H new ATOM 0 HD2 ARG A 108 4.870 35.783 -12.509 1.00 1.00 H new ATOM 0 HD3 ARG A 108 3.227 36.022 -13.069 1.00 1.00 H new ATOM 0 HE ARG A 108 3.398 36.393 -10.197 1.00 1.00 H new ATOM 0 HH11 ARG A 108 3.981 37.929 -13.327 1.00 1.00 H new ATOM 0 HH12 ARG A 108 3.911 39.567 -12.668 1.00 1.00 H new ATOM 0 HH21 ARG A 108 3.368 38.498 -9.346 1.00 1.00 H new ATOM 0 HH22 ARG A 108 3.564 39.889 -10.418 1.00 1.00 H new ATOM 1645 N MET A 109 6.592 34.512 -8.469 1.00 1.00 N ATOM 1646 CA MET A 109 7.143 34.291 -7.140 1.00 1.00 C ATOM 1647 C MET A 109 6.037 33.870 -6.191 1.00 1.00 C ATOM 1648 O MET A 109 4.943 34.424 -6.243 1.00 1.00 O ATOM 1649 CB MET A 109 7.820 35.560 -6.625 1.00 1.00 C ATOM 1650 CG MET A 109 9.034 35.969 -7.435 1.00 1.00 C ATOM 1651 SD MET A 109 10.404 34.814 -7.257 1.00 1.00 S ATOM 1652 CE MET A 109 10.603 34.832 -5.481 1.00 1.00 C ATOM 0 H MET A 109 6.449 35.493 -8.707 1.00 1.00 H new ATOM 0 HA MET A 109 7.890 33.499 -7.196 1.00 1.00 H new ATOM 0 HB2 MET A 109 7.097 36.376 -6.631 1.00 1.00 H new ATOM 0 HB3 MET A 109 8.120 35.407 -5.588 1.00 1.00 H new ATOM 0 HG2 MET A 109 8.758 36.040 -8.487 1.00 1.00 H new ATOM 0 HG3 MET A 109 9.357 36.962 -7.123 1.00 1.00 H new ATOM 0 HE1 MET A 109 11.653 34.679 -5.231 1.00 1.00 H new ATOM 0 HE2 MET A 109 10.273 35.794 -5.088 1.00 1.00 H new ATOM 0 HE3 MET A 109 10.005 34.035 -5.040 1.00 1.00 H new ATOM 1662 N LEU A 110 6.312 32.903 -5.326 1.00 1.00 N ATOM 1663 CA LEU A 110 5.321 32.438 -4.353 1.00 1.00 C ATOM 1664 C LEU A 110 4.809 33.596 -3.509 1.00 1.00 C ATOM 1665 O LEU A 110 3.603 33.822 -3.421 1.00 1.00 O ATOM 1666 CB LEU A 110 5.946 31.344 -3.461 1.00 1.00 C ATOM 1667 CG LEU A 110 5.008 30.643 -2.457 1.00 1.00 C ATOM 1668 CD1 LEU A 110 4.862 31.455 -1.178 1.00 1.00 C ATOM 1669 CD2 LEU A 110 3.637 30.380 -3.077 1.00 1.00 C ATOM 0 H LEU A 110 7.211 32.423 -5.275 1.00 1.00 H new ATOM 0 HA LEU A 110 4.470 32.016 -4.888 1.00 1.00 H new ATOM 0 HB2 LEU A 110 6.378 30.583 -4.110 1.00 1.00 H new ATOM 0 HB3 LEU A 110 6.768 31.791 -2.902 1.00 1.00 H new ATOM 0 HG LEU A 110 5.461 29.685 -2.203 1.00 1.00 H new ATOM 0 HD11 LEU A 110 4.195 30.935 -0.491 1.00 1.00 H new ATOM 0 HD12 LEU A 110 5.839 31.578 -0.712 1.00 1.00 H new ATOM 0 HD13 LEU A 110 4.447 32.435 -1.414 1.00 1.00 H new ATOM 0 HD21 LEU A 110 2.996 29.885 -2.347 1.00 1.00 H new ATOM 0 HD22 LEU A 110 3.185 31.326 -3.374 1.00 1.00 H new ATOM 0 HD23 LEU A 110 3.750 29.741 -3.953 1.00 1.00 H new ATOM 1681 N ARG A 111 5.724 34.391 -2.973 1.00 1.00 N ATOM 1682 CA ARG A 111 5.339 35.504 -2.126 1.00 1.00 C ATOM 1683 C ARG A 111 4.697 36.611 -2.952 1.00 1.00 C ATOM 1684 O ARG A 111 4.035 37.488 -2.418 1.00 1.00 O ATOM 1685 CB ARG A 111 6.541 36.057 -1.365 1.00 1.00 C ATOM 1686 CG ARG A 111 6.127 36.969 -0.226 1.00 1.00 C ATOM 1687 CD ARG A 111 7.296 37.733 0.358 1.00 1.00 C ATOM 1688 NE ARG A 111 6.961 38.265 1.679 1.00 1.00 N ATOM 1689 CZ ARG A 111 7.482 37.808 2.818 1.00 1.00 C ATOM 1690 NH1 ARG A 111 8.454 36.907 2.791 1.00 1.00 N ATOM 1691 NH2 ARG A 111 7.044 38.259 3.986 1.00 1.00 N ATOM 0 H ARG A 111 6.729 34.285 -3.110 1.00 1.00 H new ATOM 0 HA ARG A 111 4.612 35.133 -1.403 1.00 1.00 H new ATOM 0 HB2 ARG A 111 7.131 35.230 -0.970 1.00 1.00 H new ATOM 0 HB3 ARG A 111 7.183 36.606 -2.053 1.00 1.00 H new ATOM 0 HG2 ARG A 111 5.378 37.675 -0.584 1.00 1.00 H new ATOM 0 HG3 ARG A 111 5.657 36.376 0.558 1.00 1.00 H new ATOM 0 HD2 ARG A 111 8.163 37.077 0.434 1.00 1.00 H new ATOM 0 HD3 ARG A 111 7.572 38.550 -0.309 1.00 1.00 H new ATOM 0 HE ARG A 111 6.289 39.031 1.732 1.00 1.00 H new ATOM 0 HH11 ARG A 111 8.805 36.562 1.898 1.00 1.00 H new ATOM 0 HH12 ARG A 111 8.851 36.559 3.664 1.00 1.00 H new ATOM 0 HH21 ARG A 111 6.304 38.960 4.017 1.00 1.00 H new ATOM 0 HH22 ARG A 111 7.447 37.905 4.853 1.00 1.00 H new ATOM 1705 N SER A 112 4.854 36.535 -4.265 1.00 1.00 N ATOM 1706 CA SER A 112 4.289 37.535 -5.148 1.00 1.00 C ATOM 1707 C SER A 112 2.774 37.405 -5.196 1.00 1.00 C ATOM 1708 O SER A 112 2.089 38.296 -5.695 1.00 1.00 O ATOM 1709 CB SER A 112 4.898 37.415 -6.550 1.00 1.00 C ATOM 1710 OG SER A 112 4.222 38.234 -7.490 1.00 1.00 O ATOM 0 H SER A 112 5.367 35.792 -4.738 1.00 1.00 H new ATOM 0 HA SER A 112 4.531 38.524 -4.758 1.00 1.00 H new ATOM 0 HB2 SER A 112 5.951 37.696 -6.514 1.00 1.00 H new ATOM 0 HB3 SER A 112 4.856 36.376 -6.877 1.00 1.00 H new ATOM 0 HG SER A 112 3.401 38.586 -7.087 1.00 1.00 H new ATOM 1716 N PHE A 113 2.242 36.288 -4.702 1.00 1.00 N ATOM 1717 CA PHE A 113 0.809 36.085 -4.651 1.00 1.00 C ATOM 1718 C PHE A 113 0.245 36.595 -3.327 1.00 1.00 C ATOM 1719 O PHE A 113 -0.963 36.783 -3.184 1.00 1.00 O ATOM 1720 CB PHE A 113 0.510 34.588 -4.781 1.00 1.00 C ATOM 1721 CG PHE A 113 0.910 33.980 -6.097 1.00 1.00 C ATOM 1722 CD1 PHE A 113 0.076 34.070 -7.200 1.00 1.00 C ATOM 1723 CD2 PHE A 113 2.109 33.304 -6.224 1.00 1.00 C ATOM 1724 CE1 PHE A 113 0.436 33.500 -8.405 1.00 1.00 C ATOM 1725 CE2 PHE A 113 2.473 32.728 -7.426 1.00 1.00 C ATOM 1726 CZ PHE A 113 1.635 32.826 -8.518 1.00 1.00 C ATOM 0 H PHE A 113 2.791 35.512 -4.332 1.00 1.00 H new ATOM 0 HA PHE A 113 0.344 36.635 -5.469 1.00 1.00 H new ATOM 0 HB2 PHE A 113 1.024 34.058 -3.980 1.00 1.00 H new ATOM 0 HB3 PHE A 113 -0.558 34.430 -4.633 1.00 1.00 H new ATOM 0 HD1 PHE A 113 -0.866 34.592 -7.116 1.00 1.00 H new ATOM 0 HD2 PHE A 113 2.769 33.225 -5.373 1.00 1.00 H new ATOM 0 HE1 PHE A 113 -0.220 33.582 -9.259 1.00 1.00 H new ATOM 0 HE2 PHE A 113 3.412 32.202 -7.511 1.00 1.00 H new ATOM 0 HZ PHE A 113 1.917 32.376 -9.459 1.00 1.00 H new ATOM 1736 N ASP A 114 1.135 36.818 -2.368 1.00 1.00 N ATOM 1737 CA ASP A 114 0.748 37.246 -1.028 1.00 1.00 C ATOM 1738 C ASP A 114 0.281 38.697 -1.026 1.00 1.00 C ATOM 1739 O ASP A 114 1.007 39.596 -1.461 1.00 1.00 O ATOM 1740 CB ASP A 114 1.929 37.067 -0.062 1.00 1.00 C ATOM 1741 CG ASP A 114 1.681 37.640 1.321 1.00 1.00 C ATOM 1742 OD1 ASP A 114 0.523 37.638 1.786 1.00 1.00 O ATOM 1743 OD2 ASP A 114 2.652 38.110 1.948 1.00 1.00 O ATOM 0 H ASP A 114 2.141 36.708 -2.495 1.00 1.00 H new ATOM 0 HA ASP A 114 -0.085 36.625 -0.698 1.00 1.00 H new ATOM 0 HB2 ASP A 114 2.153 36.004 0.030 1.00 1.00 H new ATOM 0 HB3 ASP A 114 2.811 37.543 -0.490 1.00 1.00 H new ATOM 2056 N GLU A 136 7.034 26.957 10.749 1.00 1.00 N ATOM 2057 CA GLU A 136 5.656 27.420 10.674 1.00 1.00 C ATOM 2058 C GLU A 136 5.579 28.848 10.152 1.00 1.00 C ATOM 2059 O GLU A 136 4.524 29.294 9.704 1.00 1.00 O ATOM 2060 CB GLU A 136 4.963 27.312 12.028 1.00 1.00 C ATOM 2061 CG GLU A 136 4.880 25.890 12.548 1.00 1.00 C ATOM 2062 CD GLU A 136 3.845 25.736 13.632 1.00 1.00 C ATOM 2063 OE1 GLU A 136 4.045 26.295 14.726 1.00 1.00 O ATOM 2064 OE2 GLU A 136 2.825 25.054 13.390 1.00 1.00 O ATOM 0 HA GLU A 136 5.135 26.772 9.970 1.00 1.00 H new ATOM 0 HB2 GLU A 136 5.499 27.926 12.752 1.00 1.00 H new ATOM 0 HB3 GLU A 136 3.956 27.721 11.947 1.00 1.00 H new ATOM 0 HG2 GLU A 136 4.642 25.218 11.724 1.00 1.00 H new ATOM 0 HG3 GLU A 136 5.854 25.589 12.934 1.00 1.00 H new ATOM 2071 N GLU A 137 6.686 29.576 10.242 1.00 1.00 N ATOM 2072 CA GLU A 137 6.752 30.915 9.688 1.00 1.00 C ATOM 2073 C GLU A 137 6.578 30.825 8.183 1.00 1.00 C ATOM 2074 O GLU A 137 5.726 31.487 7.600 1.00 1.00 O ATOM 2075 CB GLU A 137 8.081 31.584 10.032 1.00 1.00 C ATOM 2076 CG GLU A 137 8.184 33.009 9.525 1.00 1.00 C ATOM 2077 CD GLU A 137 7.138 33.918 10.135 1.00 1.00 C ATOM 2078 OE1 GLU A 137 7.344 34.393 11.272 1.00 1.00 O ATOM 2079 OE2 GLU A 137 6.107 34.175 9.475 1.00 1.00 O ATOM 0 H GLU A 137 7.545 29.260 10.692 1.00 1.00 H new ATOM 0 HA GLU A 137 5.957 31.524 10.118 1.00 1.00 H new ATOM 0 HB2 GLU A 137 8.212 31.580 11.114 1.00 1.00 H new ATOM 0 HB3 GLU A 137 8.896 30.996 9.610 1.00 1.00 H new ATOM 0 HG2 GLU A 137 9.176 33.400 9.749 1.00 1.00 H new ATOM 0 HG3 GLU A 137 8.077 33.014 8.440 1.00 1.00 H new ATOM 2086 N VAL A 138 7.334 29.913 7.582 1.00 1.00 N ATOM 2087 CA VAL A 138 7.245 29.642 6.152 1.00 1.00 C ATOM 2088 C VAL A 138 5.841 29.162 5.800 1.00 1.00 C ATOM 2089 O VAL A 138 5.284 29.520 4.762 1.00 1.00 O ATOM 2090 CB VAL A 138 8.264 28.569 5.750 1.00 1.00 C ATOM 2091 CG1 VAL A 138 8.030 28.070 4.332 1.00 1.00 C ATOM 2092 CG2 VAL A 138 9.684 29.082 5.921 1.00 1.00 C ATOM 0 H VAL A 138 8.024 29.342 8.071 1.00 1.00 H new ATOM 0 HA VAL A 138 7.462 30.563 5.610 1.00 1.00 H new ATOM 0 HB VAL A 138 8.125 27.719 6.418 1.00 1.00 H new ATOM 0 HG11 VAL A 138 8.773 27.311 4.086 1.00 1.00 H new ATOM 0 HG12 VAL A 138 7.032 27.638 4.258 1.00 1.00 H new ATOM 0 HG13 VAL A 138 8.117 28.903 3.634 1.00 1.00 H new ATOM 0 HG21 VAL A 138 10.390 28.304 5.630 1.00 1.00 H new ATOM 0 HG22 VAL A 138 9.832 29.960 5.292 1.00 1.00 H new ATOM 0 HG23 VAL A 138 9.851 29.351 6.964 1.00 1.00 H new ATOM 2102 N PHE A 139 5.309 28.309 6.665 1.00 1.00 N ATOM 2103 CA PHE A 139 3.942 27.815 6.521 1.00 1.00 C ATOM 2104 C PHE A 139 2.991 29.000 6.398 1.00 1.00 C ATOM 2105 O PHE A 139 2.118 29.031 5.529 1.00 1.00 O ATOM 2106 CB PHE A 139 3.554 26.919 7.706 1.00 1.00 C ATOM 2107 CG PHE A 139 2.170 26.334 7.607 1.00 1.00 C ATOM 2108 CD1 PHE A 139 1.967 25.115 6.984 1.00 1.00 C ATOM 2109 CD2 PHE A 139 1.077 26.999 8.142 1.00 1.00 C ATOM 2110 CE1 PHE A 139 0.701 24.569 6.893 1.00 1.00 C ATOM 2111 CE2 PHE A 139 -0.192 26.460 8.052 1.00 1.00 C ATOM 2112 CZ PHE A 139 -0.379 25.243 7.427 1.00 1.00 C ATOM 0 H PHE A 139 5.804 27.942 7.478 1.00 1.00 H new ATOM 0 HA PHE A 139 3.874 27.207 5.619 1.00 1.00 H new ATOM 0 HB2 PHE A 139 4.276 26.106 7.784 1.00 1.00 H new ATOM 0 HB3 PHE A 139 3.627 27.500 8.626 1.00 1.00 H new ATOM 0 HD1 PHE A 139 2.808 24.584 6.564 1.00 1.00 H new ATOM 0 HD2 PHE A 139 1.219 27.949 8.635 1.00 1.00 H new ATOM 0 HE1 PHE A 139 0.557 23.616 6.405 1.00 1.00 H new ATOM 0 HE2 PHE A 139 -1.036 26.989 8.470 1.00 1.00 H new ATOM 0 HZ PHE A 139 -1.370 24.819 7.356 1.00 1.00 H new ATOM 2122 N ALA A 140 3.237 30.012 7.221 1.00 1.00 N ATOM 2123 CA ALA A 140 2.454 31.238 7.193 1.00 1.00 C ATOM 2124 C ALA A 140 2.686 31.993 5.892 1.00 1.00 C ATOM 2125 O ALA A 140 1.758 32.543 5.313 1.00 1.00 O ATOM 2126 CB ALA A 140 2.806 32.117 8.379 1.00 1.00 C ATOM 0 H ALA A 140 3.979 30.005 7.921 1.00 1.00 H new ATOM 0 HA ALA A 140 1.399 30.972 7.255 1.00 1.00 H new ATOM 0 HB1 ALA A 140 2.212 33.030 8.344 1.00 1.00 H new ATOM 0 HB2 ALA A 140 2.594 31.581 9.304 1.00 1.00 H new ATOM 0 HB3 ALA A 140 3.865 32.371 8.342 1.00 1.00 H new ATOM 2132 N VAL A 141 3.937 32.015 5.441 1.00 1.00 N ATOM 2133 CA VAL A 141 4.291 32.668 4.187 1.00 1.00 C ATOM 2134 C VAL A 141 3.457 32.105 3.050 1.00 1.00 C ATOM 2135 O VAL A 141 2.838 32.837 2.280 1.00 1.00 O ATOM 2136 CB VAL A 141 5.779 32.444 3.817 1.00 1.00 C ATOM 2137 CG1 VAL A 141 6.200 33.368 2.687 1.00 1.00 C ATOM 2138 CG2 VAL A 141 6.701 32.592 5.018 1.00 1.00 C ATOM 0 H VAL A 141 4.724 31.586 5.928 1.00 1.00 H new ATOM 0 HA VAL A 141 4.105 33.733 4.328 1.00 1.00 H new ATOM 0 HB VAL A 141 5.872 31.414 3.472 1.00 1.00 H new ATOM 0 HG11 VAL A 141 7.248 33.192 2.445 1.00 1.00 H new ATOM 0 HG12 VAL A 141 5.586 33.171 1.808 1.00 1.00 H new ATOM 0 HG13 VAL A 141 6.068 34.405 2.996 1.00 1.00 H new ATOM 0 HG21 VAL A 141 7.733 32.426 4.707 1.00 1.00 H new ATOM 0 HG22 VAL A 141 6.603 33.596 5.430 1.00 1.00 H new ATOM 0 HG23 VAL A 141 6.429 31.860 5.778 1.00 1.00 H new ATOM 2148 N ILE A 142 3.435 30.791 2.974 1.00 1.00 N ATOM 2149 CA ILE A 142 2.706 30.100 1.932 1.00 1.00 C ATOM 2150 C ILE A 142 1.201 30.273 2.084 1.00 1.00 C ATOM 2151 O ILE A 142 0.515 30.595 1.122 1.00 1.00 O ATOM 2152 CB ILE A 142 3.067 28.613 1.923 1.00 1.00 C ATOM 2153 CG1 ILE A 142 4.521 28.451 1.485 1.00 1.00 C ATOM 2154 CG2 ILE A 142 2.131 27.851 1.002 1.00 1.00 C ATOM 2155 CD1 ILE A 142 5.283 27.433 2.291 1.00 1.00 C ATOM 0 H ILE A 142 3.918 30.175 3.628 1.00 1.00 H new ATOM 0 HA ILE A 142 2.997 30.545 0.980 1.00 1.00 H new ATOM 0 HB ILE A 142 2.954 28.202 2.926 1.00 1.00 H new ATOM 0 HG12 ILE A 142 4.545 28.162 0.434 1.00 1.00 H new ATOM 0 HG13 ILE A 142 5.025 29.415 1.563 1.00 1.00 H new ATOM 0 HG21 ILE A 142 2.399 26.794 1.005 1.00 1.00 H new ATOM 0 HG22 ILE A 142 1.105 27.966 1.350 1.00 1.00 H new ATOM 0 HG23 ILE A 142 2.217 28.245 -0.011 1.00 1.00 H new ATOM 0 HD11 ILE A 142 6.308 27.371 1.924 1.00 1.00 H new ATOM 0 HD12 ILE A 142 5.290 27.731 3.340 1.00 1.00 H new ATOM 0 HD13 ILE A 142 4.804 26.459 2.194 1.00 1.00 H new ATOM 2167 N GLU A 143 0.688 30.027 3.282 1.00 1.00 N ATOM 2168 CA GLU A 143 -0.744 30.188 3.535 1.00 1.00 C ATOM 2169 C GLU A 143 -1.177 31.619 3.209 1.00 1.00 C ATOM 2170 O GLU A 143 -2.331 31.866 2.857 1.00 1.00 O ATOM 2171 CB GLU A 143 -1.124 29.815 4.979 1.00 1.00 C ATOM 2172 CG GLU A 143 -0.816 30.883 6.017 1.00 1.00 C ATOM 2173 CD GLU A 143 -1.532 30.646 7.334 1.00 1.00 C ATOM 2174 OE1 GLU A 143 -2.683 31.107 7.476 1.00 1.00 O ATOM 2175 OE2 GLU A 143 -0.946 30.013 8.239 1.00 1.00 O ATOM 0 H GLU A 143 1.232 29.719 4.088 1.00 1.00 H new ATOM 0 HA GLU A 143 -1.276 29.497 2.881 1.00 1.00 H new ATOM 0 HB2 GLU A 143 -2.191 29.593 5.013 1.00 1.00 H new ATOM 0 HB3 GLU A 143 -0.599 28.900 5.253 1.00 1.00 H new ATOM 0 HG2 GLU A 143 0.259 30.913 6.193 1.00 1.00 H new ATOM 0 HG3 GLU A 143 -1.102 31.859 5.624 1.00 1.00 H new ATOM 2182 N SER A 144 -0.244 32.557 3.342 1.00 1.00 N ATOM 2183 CA SER A 144 -0.495 33.952 3.020 1.00 1.00 C ATOM 2184 C SER A 144 -0.518 34.144 1.505 1.00 1.00 C ATOM 2185 O SER A 144 -1.135 35.071 0.996 1.00 1.00 O ATOM 2186 CB SER A 144 0.571 34.851 3.648 1.00 1.00 C ATOM 2187 OG SER A 144 0.073 36.164 3.870 1.00 1.00 O ATOM 0 H SER A 144 0.702 32.370 3.675 1.00 1.00 H new ATOM 0 HA SER A 144 -1.466 34.232 3.429 1.00 1.00 H new ATOM 0 HB2 SER A 144 0.902 34.421 4.593 1.00 1.00 H new ATOM 0 HB3 SER A 144 1.443 34.896 2.995 1.00 1.00 H new ATOM 0 HG SER A 144 0.115 36.675 3.035 1.00 1.00 H new ATOM 2193 N ALA A 145 0.213 33.295 0.795 1.00 1.00 N ATOM 2194 CA ALA A 145 0.253 33.360 -0.659 1.00 1.00 C ATOM 2195 C ALA A 145 -0.872 32.573 -1.282 1.00 1.00 C ATOM 2196 O ALA A 145 -1.240 32.823 -2.427 1.00 1.00 O ATOM 2197 CB ALA A 145 1.561 32.838 -1.213 1.00 1.00 C ATOM 0 H ALA A 145 0.785 32.555 1.202 1.00 1.00 H new ATOM 0 HA ALA A 145 0.148 34.415 -0.913 1.00 1.00 H new ATOM 0 HB1 ALA A 145 1.548 32.905 -2.301 1.00 1.00 H new ATOM 0 HB2 ALA A 145 2.385 33.435 -0.823 1.00 1.00 H new ATOM 0 HB3 ALA A 145 1.693 31.798 -0.915 1.00 1.00 H new ATOM 2203 N LEU A 146 -1.403 31.595 -0.563 1.00 1.00 N ATOM 2204 CA LEU A 146 -2.463 30.763 -1.103 1.00 1.00 C ATOM 2205 C LEU A 146 -3.687 31.589 -1.560 1.00 1.00 C ATOM 2206 O LEU A 146 -4.284 31.252 -2.575 1.00 1.00 O ATOM 2207 CB LEU A 146 -2.868 29.677 -0.095 1.00 1.00 C ATOM 2208 CG LEU A 146 -1.726 28.749 0.338 1.00 1.00 C ATOM 2209 CD1 LEU A 146 -2.259 27.482 0.983 1.00 1.00 C ATOM 2210 CD2 LEU A 146 -0.836 28.404 -0.843 1.00 1.00 C ATOM 0 H LEU A 146 -1.119 31.361 0.388 1.00 1.00 H new ATOM 0 HA LEU A 146 -2.067 30.276 -1.994 1.00 1.00 H new ATOM 0 HB2 LEU A 146 -3.283 30.158 0.791 1.00 1.00 H new ATOM 0 HB3 LEU A 146 -3.663 29.073 -0.532 1.00 1.00 H new ATOM 0 HG LEU A 146 -1.131 29.282 1.080 1.00 1.00 H new ATOM 0 HD11 LEU A 146 -1.425 26.846 1.279 1.00 1.00 H new ATOM 0 HD12 LEU A 146 -2.847 27.742 1.863 1.00 1.00 H new ATOM 0 HD13 LEU A 146 -2.888 26.948 0.271 1.00 1.00 H new ATOM 0 HD21 LEU A 146 -0.033 27.745 -0.513 1.00 1.00 H new ATOM 0 HD22 LEU A 146 -1.426 27.901 -1.609 1.00 1.00 H new ATOM 0 HD23 LEU A 146 -0.409 29.318 -1.256 1.00 1.00 H new ATOM 2222 N PRO A 147 -4.064 32.700 -0.863 1.00 1.00 N ATOM 2223 CA PRO A 147 -5.187 33.565 -1.290 1.00 1.00 C ATOM 2224 C PRO A 147 -4.865 34.299 -2.589 1.00 1.00 C ATOM 2225 O PRO A 147 -5.751 34.800 -3.280 1.00 1.00 O ATOM 2226 CB PRO A 147 -5.335 34.572 -0.141 1.00 1.00 C ATOM 2227 CG PRO A 147 -4.008 34.587 0.522 1.00 1.00 C ATOM 2228 CD PRO A 147 -3.468 33.194 0.392 1.00 1.00 C ATOM 0 HA PRO A 147 -6.093 32.991 -1.483 1.00 1.00 H new ATOM 0 HB2 PRO A 147 -5.602 35.561 -0.513 1.00 1.00 H new ATOM 0 HB3 PRO A 147 -6.120 34.269 0.552 1.00 1.00 H new ATOM 0 HG2 PRO A 147 -3.343 35.309 0.049 1.00 1.00 H new ATOM 0 HG3 PRO A 147 -4.098 34.875 1.569 1.00 1.00 H new ATOM 0 HD2 PRO A 147 -2.379 33.190 0.346 1.00 1.00 H new ATOM 0 HD3 PRO A 147 -3.753 32.574 1.242 1.00 1.00 H new ATOM 2236 N GLY A 148 -3.599 34.256 -2.954 1.00 1.00 N ATOM 2237 CA GLY A 148 -3.154 34.905 -4.160 1.00 1.00 C ATOM 2238 C GLY A 148 -2.902 33.892 -5.245 1.00 1.00 C ATOM 2239 O GLY A 148 -3.205 34.124 -6.415 1.00 1.00 O ATOM 0 H GLY A 148 -2.865 33.778 -2.431 1.00 1.00 H new ATOM 0 HA2 GLY A 148 -3.905 35.622 -4.492 1.00 1.00 H new ATOM 0 HA3 GLY A 148 -2.242 35.468 -3.961 1.00 1.00 H new ATOM 2243 N LEU A 149 -2.435 32.725 -4.829 1.00 1.00 N ATOM 2244 CA LEU A 149 -2.154 31.639 -5.743 1.00 1.00 C ATOM 2245 C LEU A 149 -3.472 31.010 -6.183 1.00 1.00 C ATOM 2246 O LEU A 149 -3.662 30.686 -7.354 1.00 1.00 O ATOM 2247 CB LEU A 149 -1.230 30.608 -5.064 1.00 1.00 C ATOM 2248 CG LEU A 149 0.029 30.255 -5.850 1.00 1.00 C ATOM 2249 CD1 LEU A 149 0.692 29.026 -5.270 1.00 1.00 C ATOM 2250 CD2 LEU A 149 -0.301 30.030 -7.304 1.00 1.00 C ATOM 0 H LEU A 149 -2.242 32.509 -3.851 1.00 1.00 H new ATOM 0 HA LEU A 149 -1.636 32.012 -6.627 1.00 1.00 H new ATOM 0 HB2 LEU A 149 -0.935 30.994 -4.088 1.00 1.00 H new ATOM 0 HB3 LEU A 149 -1.798 29.695 -4.887 1.00 1.00 H new ATOM 0 HG LEU A 149 0.723 31.092 -5.775 1.00 1.00 H new ATOM 0 HD11 LEU A 149 1.588 28.791 -5.844 1.00 1.00 H new ATOM 0 HD12 LEU A 149 0.966 29.216 -4.232 1.00 1.00 H new ATOM 0 HD13 LEU A 149 0.001 28.184 -5.315 1.00 1.00 H new ATOM 0 HD21 LEU A 149 0.609 29.779 -7.849 1.00 1.00 H new ATOM 0 HD22 LEU A 149 -1.014 29.211 -7.393 1.00 1.00 H new ATOM 0 HD23 LEU A 149 -0.736 30.937 -7.723 1.00 1.00 H new ATOM 2262 N HIS A 150 -4.383 30.868 -5.219 1.00 1.00 N ATOM 2263 CA HIS A 150 -5.736 30.380 -5.488 1.00 1.00 C ATOM 2264 C HIS A 150 -6.392 31.220 -6.567 1.00 1.00 C ATOM 2265 O HIS A 150 -6.861 30.702 -7.573 1.00 1.00 O ATOM 2266 CB HIS A 150 -6.613 30.459 -4.232 1.00 1.00 C ATOM 2267 CG HIS A 150 -6.790 29.168 -3.496 1.00 1.00 C ATOM 2268 ND1 HIS A 150 -7.939 28.419 -3.564 1.00 1.00 N ATOM 2269 CD2 HIS A 150 -5.979 28.529 -2.626 1.00 1.00 C ATOM 2270 CE1 HIS A 150 -7.830 27.378 -2.765 1.00 1.00 C ATOM 2271 NE2 HIS A 150 -6.648 27.416 -2.176 1.00 1.00 N ATOM 0 H HIS A 150 -4.206 31.086 -4.238 1.00 1.00 H new ATOM 0 HA HIS A 150 -5.648 29.342 -5.810 1.00 1.00 H new ATOM 0 HB2 HIS A 150 -6.179 31.191 -3.551 1.00 1.00 H new ATOM 0 HB3 HIS A 150 -7.596 30.834 -4.518 1.00 1.00 H new ATOM 0 HD2 HIS A 150 -4.985 28.837 -2.336 1.00 1.00 H new ATOM 0 HE1 HIS A 150 -8.583 26.618 -2.616 1.00 1.00 H new ATOM 0 HE2 HIS A 150 -6.293 26.736 -1.503 1.00 1.00 H new ATOM 2280 N ASP A 151 -6.389 32.529 -6.357 1.00 1.00 N ATOM 2281 CA ASP A 151 -7.046 33.455 -7.270 1.00 1.00 C ATOM 2282 C ASP A 151 -6.451 33.357 -8.664 1.00 1.00 C ATOM 2283 O ASP A 151 -7.176 33.277 -9.655 1.00 1.00 O ATOM 2284 CB ASP A 151 -6.918 34.884 -6.744 1.00 1.00 C ATOM 2285 CG ASP A 151 -7.981 35.807 -7.304 1.00 1.00 C ATOM 2286 OD1 ASP A 151 -7.814 36.306 -8.432 1.00 1.00 O ATOM 2287 OD2 ASP A 151 -8.992 36.040 -6.609 1.00 1.00 O ATOM 0 H ASP A 151 -5.937 32.975 -5.559 1.00 1.00 H new ATOM 0 HA ASP A 151 -8.101 33.187 -7.330 1.00 1.00 H new ATOM 0 HB2 ASP A 151 -6.986 34.875 -5.656 1.00 1.00 H new ATOM 0 HB3 ASP A 151 -5.932 35.274 -6.998 1.00 1.00 H new ATOM 2292 N TRP A 152 -5.124 33.302 -8.717 1.00 1.00 N ATOM 2293 CA TRP A 152 -4.404 33.235 -9.977 1.00 1.00 C ATOM 2294 C TRP A 152 -4.795 31.984 -10.755 1.00 1.00 C ATOM 2295 O TRP A 152 -5.234 32.075 -11.901 1.00 1.00 O ATOM 2296 CB TRP A 152 -2.898 33.250 -9.717 1.00 1.00 C ATOM 2297 CG TRP A 152 -2.059 33.461 -10.944 1.00 1.00 C ATOM 2298 CD1 TRP A 152 -1.439 34.620 -11.317 1.00 1.00 C ATOM 2299 CD2 TRP A 152 -1.737 32.494 -11.955 1.00 1.00 C ATOM 2300 NE1 TRP A 152 -0.749 34.428 -12.490 1.00 1.00 N ATOM 2301 CE2 TRP A 152 -0.920 33.135 -12.901 1.00 1.00 C ATOM 2302 CE3 TRP A 152 -2.060 31.145 -12.151 1.00 1.00 C ATOM 2303 CZ2 TRP A 152 -0.421 32.477 -14.023 1.00 1.00 C ATOM 2304 CZ3 TRP A 152 -1.565 30.497 -13.264 1.00 1.00 C ATOM 2305 CH2 TRP A 152 -0.753 31.163 -14.188 1.00 1.00 C ATOM 0 H TRP A 152 -4.524 33.303 -7.892 1.00 1.00 H new ATOM 0 HA TRP A 152 -4.669 34.106 -10.577 1.00 1.00 H new ATOM 0 HB2 TRP A 152 -2.674 34.038 -8.998 1.00 1.00 H new ATOM 0 HB3 TRP A 152 -2.612 32.306 -9.254 1.00 1.00 H new ATOM 0 HD1 TRP A 152 -1.484 35.550 -10.770 1.00 1.00 H new ATOM 0 HE1 TRP A 152 -0.198 35.136 -12.976 1.00 1.00 H new ATOM 0 HE3 TRP A 152 -2.686 30.621 -11.443 1.00 1.00 H new ATOM 0 HZ2 TRP A 152 0.207 32.989 -14.738 1.00 1.00 H new ATOM 0 HZ3 TRP A 152 -1.809 29.457 -13.425 1.00 1.00 H new ATOM 0 HH2 TRP A 152 -0.381 30.627 -15.049 1.00 1.00 H new ATOM 2316 N VAL A 153 -4.657 30.818 -10.131 1.00 1.00 N ATOM 2317 CA VAL A 153 -4.983 29.564 -10.799 1.00 1.00 C ATOM 2318 C VAL A 153 -6.458 29.535 -11.210 1.00 1.00 C ATOM 2319 O VAL A 153 -6.775 29.102 -12.314 1.00 1.00 O ATOM 2320 CB VAL A 153 -4.639 28.319 -9.936 1.00 1.00 C ATOM 2321 CG1 VAL A 153 -3.196 28.375 -9.458 1.00 1.00 C ATOM 2322 CG2 VAL A 153 -5.574 28.176 -8.746 1.00 1.00 C ATOM 0 H VAL A 153 -4.325 30.716 -9.172 1.00 1.00 H new ATOM 0 HA VAL A 153 -4.362 29.516 -11.693 1.00 1.00 H new ATOM 0 HB VAL A 153 -4.771 27.444 -10.573 1.00 1.00 H new ATOM 0 HG11 VAL A 153 -2.978 27.493 -8.856 1.00 1.00 H new ATOM 0 HG12 VAL A 153 -2.528 28.401 -10.319 1.00 1.00 H new ATOM 0 HG13 VAL A 153 -3.047 29.271 -8.856 1.00 1.00 H new ATOM 0 HG21 VAL A 153 -5.298 27.293 -8.170 1.00 1.00 H new ATOM 0 HG22 VAL A 153 -5.496 29.060 -8.114 1.00 1.00 H new ATOM 0 HG23 VAL A 153 -6.600 28.072 -9.100 1.00 1.00 H new ATOM 2332 N ASP A 154 -7.342 30.051 -10.344 1.00 1.00 N ATOM 2333 CA ASP A 154 -8.775 30.104 -10.640 1.00 1.00 C ATOM 2334 C ASP A 154 -9.041 30.915 -11.896 1.00 1.00 C ATOM 2335 O ASP A 154 -9.666 30.441 -12.840 1.00 1.00 O ATOM 2336 CB ASP A 154 -9.576 30.702 -9.476 1.00 1.00 C ATOM 2337 CG ASP A 154 -9.992 29.675 -8.441 1.00 1.00 C ATOM 2338 OD1 ASP A 154 -10.748 28.748 -8.793 1.00 1.00 O ATOM 2339 OD2 ASP A 154 -9.590 29.809 -7.267 1.00 1.00 O ATOM 0 H ASP A 154 -7.087 30.436 -9.435 1.00 1.00 H new ATOM 0 HA ASP A 154 -9.101 29.076 -10.795 1.00 1.00 H new ATOM 0 HB2 ASP A 154 -8.978 31.474 -8.991 1.00 1.00 H new ATOM 0 HB3 ASP A 154 -10.467 31.191 -9.871 1.00 1.00 H new ATOM 2344 N GLU A 155 -8.549 32.143 -11.896 1.00 1.00 N ATOM 2345 CA GLU A 155 -8.760 33.046 -13.018 1.00 1.00 C ATOM 2346 C GLU A 155 -8.123 32.479 -14.288 1.00 1.00 C ATOM 2347 O GLU A 155 -8.655 32.622 -15.392 1.00 1.00 O ATOM 2348 CB GLU A 155 -8.191 34.431 -12.701 1.00 1.00 C ATOM 2349 CG GLU A 155 -6.708 34.576 -12.990 1.00 1.00 C ATOM 2350 CD GLU A 155 -6.199 35.975 -12.717 1.00 1.00 C ATOM 2351 OE1 GLU A 155 -6.436 36.884 -13.538 1.00 1.00 O ATOM 2352 OE2 GLU A 155 -5.569 36.173 -11.659 1.00 1.00 O ATOM 0 H GLU A 155 -8.001 32.538 -11.132 1.00 1.00 H new ATOM 0 HA GLU A 155 -9.832 33.145 -13.188 1.00 1.00 H new ATOM 0 HB2 GLU A 155 -8.737 35.177 -13.279 1.00 1.00 H new ATOM 0 HB3 GLU A 155 -8.368 34.652 -11.648 1.00 1.00 H new ATOM 0 HG2 GLU A 155 -6.151 33.865 -12.380 1.00 1.00 H new ATOM 0 HG3 GLU A 155 -6.517 34.320 -14.032 1.00 1.00 H new ATOM 2359 N ARG A 156 -7.008 31.788 -14.113 1.00 1.00 N ATOM 2360 CA ARG A 156 -6.296 31.208 -15.231 1.00 1.00 C ATOM 2361 C ARG A 156 -7.009 29.979 -15.776 1.00 1.00 C ATOM 2362 O ARG A 156 -7.129 29.809 -16.990 1.00 1.00 O ATOM 2363 CB ARG A 156 -4.862 30.882 -14.845 1.00 1.00 C ATOM 2364 CG ARG A 156 -3.980 32.115 -14.731 1.00 1.00 C ATOM 2365 CD ARG A 156 -4.249 33.075 -15.870 1.00 1.00 C ATOM 2366 NE ARG A 156 -3.144 34.001 -16.091 1.00 1.00 N ATOM 2367 CZ ARG A 156 -3.183 35.309 -15.852 1.00 1.00 C ATOM 2368 NH1 ARG A 156 -4.263 35.871 -15.328 1.00 1.00 N ATOM 2369 NH2 ARG A 156 -2.123 36.049 -16.140 1.00 1.00 N ATOM 0 H ARG A 156 -6.579 31.617 -13.204 1.00 1.00 H new ATOM 0 HA ARG A 156 -6.275 31.950 -16.029 1.00 1.00 H new ATOM 0 HB2 ARG A 156 -4.860 30.352 -13.893 1.00 1.00 H new ATOM 0 HB3 ARG A 156 -4.437 30.206 -15.587 1.00 1.00 H new ATOM 0 HG2 ARG A 156 -4.164 32.613 -13.779 1.00 1.00 H new ATOM 0 HG3 ARG A 156 -2.931 31.819 -14.739 1.00 1.00 H new ATOM 0 HD2 ARG A 156 -4.433 32.509 -16.783 1.00 1.00 H new ATOM 0 HD3 ARG A 156 -5.156 33.641 -15.658 1.00 1.00 H new ATOM 0 HE ARG A 156 -2.274 33.616 -16.457 1.00 1.00 H new ATOM 0 HH11 ARG A 156 -5.077 35.299 -15.103 1.00 1.00 H new ATOM 0 HH12 ARG A 156 -4.280 36.875 -15.150 1.00 1.00 H new ATOM 0 HH21 ARG A 156 -1.291 35.615 -16.540 1.00 1.00 H new ATOM 0 HH22 ARG A 156 -2.139 37.053 -15.962 1.00 1.00 H new ATOM 2383 N LEU A 157 -7.497 29.131 -14.885 1.00 1.00 N ATOM 2384 CA LEU A 157 -8.205 27.926 -15.311 1.00 1.00 C ATOM 2385 C LEU A 157 -9.521 28.315 -15.965 1.00 1.00 C ATOM 2386 O LEU A 157 -10.043 27.600 -16.819 1.00 1.00 O ATOM 2387 CB LEU A 157 -8.422 26.946 -14.135 1.00 1.00 C ATOM 2388 CG LEU A 157 -9.311 27.422 -12.977 1.00 1.00 C ATOM 2389 CD1 LEU A 157 -10.790 27.249 -13.299 1.00 1.00 C ATOM 2390 CD2 LEU A 157 -8.959 26.667 -11.705 1.00 1.00 C ATOM 0 H LEU A 157 -7.420 29.248 -13.875 1.00 1.00 H new ATOM 0 HA LEU A 157 -7.591 27.400 -16.043 1.00 1.00 H new ATOM 0 HB2 LEU A 157 -8.853 26.028 -14.536 1.00 1.00 H new ATOM 0 HB3 LEU A 157 -7.445 26.688 -13.726 1.00 1.00 H new ATOM 0 HG LEU A 157 -9.126 28.486 -12.828 1.00 1.00 H new ATOM 0 HD11 LEU A 157 -11.389 27.596 -12.457 1.00 1.00 H new ATOM 0 HD12 LEU A 157 -11.040 27.831 -14.186 1.00 1.00 H new ATOM 0 HD13 LEU A 157 -11.001 26.196 -13.485 1.00 1.00 H new ATOM 0 HD21 LEU A 157 -9.595 27.012 -10.890 1.00 1.00 H new ATOM 0 HD22 LEU A 157 -9.115 25.599 -11.861 1.00 1.00 H new ATOM 0 HD23 LEU A 157 -7.914 26.848 -11.452 1.00 1.00 H new