USER MOD reduce.3.24.130724 H: found=0, std=0, add=765, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 766 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 34 LYS NZ :NH3+ -124:sc= 0.00124 (180deg=0) USER MOD Set 1.2: A 106 ASN : amide:sc= -0.0903 X(o=-0.089,f=-0.41) USER MOD Set 2.1: A 83 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 86 GLN : amide:sc= -1.8 X(o=-1.8,f=-1.3) USER MOD Set 3.1: A 22 ASN : amide:sc= 0 K(o=0.85,f=-0.51) USER MOD Set 3.2: A 67 THR OG1 : rot 97:sc= 0.847 USER MOD Set 4.1: A 58 HIS : no HE2:sc= -0.284 K(o=-0.44,f=-6.3!) USER MOD Set 4.2: A 62 GLN : amide:sc= -0.151 K(o=-0.44,f=-2!) USER MOD Set 5.1: A 52 ASN : amide:sc= -0.209 K(o=-1.4,f=-2.4) USER MOD Set 5.2: A 55 GLN : amide:sc= -1.15 K(o=-1.4,f=-0.11) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 141:sc= 0.49 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 102:sc= 0.695 USER MOD Single : A 19 CYS SG : rot 180:sc= -0.332 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -0.35 K(o=-0.35,f=-3.1!) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.29 K(o=-0.29,f=-2.8!) USER MOD Single : A 30 THR OG1 : rot 92:sc= -0.391 USER MOD Single : A 32 GLN : amide:sc= -1.75 X(o=-1.7,f=-1.4) USER MOD Single : A 35 ASN : amide:sc= -0.0239 X(o=-0.024,f=-0.35) USER MOD Single : A 37 MET CE :methyl -118:sc= -6.14! (180deg=-8.22!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 57 GLN : amide:sc= -2.96! K(o=-3!,f=-0.78) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 89:sc= -3.57! USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.0103 K(o=-0.01,f=-0.59) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0.17) USER MOD Single : A 89 GLN : amide:sc= -0.182 K(o=-0.18,f=-2.2!) USER MOD Single : A 92 GLN : amide:sc= -0.363 X(o=-0.36,f=-0.44) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot -85:sc= -2.79 USER MOD Single : A 105 ASN : amide:sc= -0.0594 K(o=-0.059,f=-1.9!) USER MOD Single : A 108 GLN : amide:sc= -0.0823 K(o=-0.082,f=-0.93) USER MOD Single : A 111 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 115 SER OG : rot 65:sc= 0.718 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= -0.0192 (180deg=-0.0192) USER MOD ----------------------------------------------------------------- ATOM 126 N ASP A 11 9.283 -17.652 -2.315 1.00 0.00 N ATOM 127 CA ASP A 11 8.421 -18.615 -1.651 1.00 0.00 C ATOM 128 C ASP A 11 7.216 -17.887 -1.053 1.00 0.00 C ATOM 129 O ASP A 11 7.284 -16.690 -0.775 1.00 0.00 O ATOM 130 CB ASP A 11 9.159 -19.321 -0.512 1.00 0.00 C ATOM 131 CG ASP A 11 10.613 -19.689 -0.813 1.00 0.00 C ATOM 132 OD1 ASP A 11 10.831 -20.323 -1.868 1.00 0.00 O ATOM 133 OD2 ASP A 11 11.474 -19.328 0.018 1.00 0.00 O ATOM 0 HA ASP A 11 8.108 -19.352 -2.390 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.138 -18.678 0.368 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.615 -20.230 -0.256 1.00 0.00 H new ATOM 138 N PHE A 12 6.140 -18.639 -0.874 1.00 0.00 N ATOM 139 CA PHE A 12 4.921 -18.080 -0.315 1.00 0.00 C ATOM 140 C PHE A 12 5.218 -17.273 0.951 1.00 0.00 C ATOM 141 O PHE A 12 4.770 -16.135 1.086 1.00 0.00 O ATOM 142 CB PHE A 12 4.013 -19.257 0.047 1.00 0.00 C ATOM 143 CG PHE A 12 2.574 -18.856 0.377 1.00 0.00 C ATOM 144 CD1 PHE A 12 2.260 -18.421 1.626 1.00 0.00 C ATOM 145 CD2 PHE A 12 1.610 -18.934 -0.579 1.00 0.00 C ATOM 146 CE1 PHE A 12 0.924 -18.048 1.933 1.00 0.00 C ATOM 147 CE2 PHE A 12 0.275 -18.561 -0.272 1.00 0.00 C ATOM 148 CZ PHE A 12 -0.040 -18.126 0.977 1.00 0.00 C ATOM 0 H PHE A 12 6.087 -19.631 -1.106 1.00 0.00 H new ATOM 0 HA PHE A 12 4.453 -17.412 -1.038 1.00 0.00 H new ATOM 0 HB2 PHE A 12 4.001 -19.962 -0.784 1.00 0.00 H new ATOM 0 HB3 PHE A 12 4.439 -19.781 0.903 1.00 0.00 H new ATOM 0 HD1 PHE A 12 3.026 -18.359 2.385 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.860 -19.280 -1.571 1.00 0.00 H new ATOM 0 HE1 PHE A 12 0.674 -17.703 2.925 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -0.491 -18.623 -1.031 1.00 0.00 H new ATOM 0 HZ PHE A 12 -1.056 -17.842 1.210 1.00 0.00 H new ATOM 158 N SER A 13 5.971 -17.894 1.847 1.00 0.00 N ATOM 159 CA SER A 13 6.333 -17.248 3.097 1.00 0.00 C ATOM 160 C SER A 13 7.287 -16.083 2.827 1.00 0.00 C ATOM 161 O SER A 13 7.353 -15.136 3.610 1.00 0.00 O ATOM 162 CB SER A 13 6.973 -18.244 4.066 1.00 0.00 C ATOM 163 OG SER A 13 6.115 -18.550 5.162 1.00 0.00 O ATOM 0 H SER A 13 6.340 -18.838 1.732 1.00 0.00 H new ATOM 0 HA SER A 13 5.424 -16.865 3.560 1.00 0.00 H new ATOM 0 HB2 SER A 13 7.220 -19.162 3.532 1.00 0.00 H new ATOM 0 HB3 SER A 13 7.909 -17.833 4.443 1.00 0.00 H new ATOM 0 HG SER A 13 6.559 -19.190 5.756 1.00 0.00 H new ATOM 169 N SER A 14 8.001 -16.190 1.716 1.00 0.00 N ATOM 170 CA SER A 14 8.948 -15.156 1.333 1.00 0.00 C ATOM 171 C SER A 14 8.209 -13.982 0.688 1.00 0.00 C ATOM 172 O SER A 14 8.636 -12.835 0.805 1.00 0.00 O ATOM 173 CB SER A 14 10.007 -15.707 0.376 1.00 0.00 C ATOM 174 OG SER A 14 10.777 -16.747 0.973 1.00 0.00 O ATOM 0 H SER A 14 7.943 -16.976 1.069 1.00 0.00 H new ATOM 0 HA SER A 14 9.456 -14.807 2.232 1.00 0.00 H new ATOM 0 HB2 SER A 14 9.521 -16.086 -0.523 1.00 0.00 H new ATOM 0 HB3 SER A 14 10.669 -14.899 0.064 1.00 0.00 H new ATOM 0 HG SER A 14 10.955 -17.445 0.309 1.00 0.00 H new ATOM 180 N ILE A 15 7.112 -14.310 0.020 1.00 0.00 N ATOM 181 CA ILE A 15 6.310 -13.297 -0.644 1.00 0.00 C ATOM 182 C ILE A 15 5.355 -12.663 0.370 1.00 0.00 C ATOM 183 O ILE A 15 5.221 -11.442 0.421 1.00 0.00 O ATOM 184 CB ILE A 15 5.605 -13.889 -1.866 1.00 0.00 C ATOM 185 CG1 ILE A 15 6.615 -14.491 -2.844 1.00 0.00 C ATOM 186 CG2 ILE A 15 4.707 -12.848 -2.539 1.00 0.00 C ATOM 187 CD1 ILE A 15 5.913 -15.347 -3.900 1.00 0.00 C ATOM 0 H ILE A 15 6.760 -15.263 -0.075 1.00 0.00 H new ATOM 0 HA ILE A 15 6.945 -12.498 -1.027 1.00 0.00 H new ATOM 0 HB ILE A 15 4.961 -14.701 -1.528 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.175 -13.693 -3.331 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.337 -15.099 -2.299 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.218 -13.295 -3.405 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.952 -12.507 -1.831 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.311 -12.000 -2.861 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.654 -15.763 -4.583 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.374 -16.159 -3.411 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.210 -14.730 -4.460 1.00 0.00 H new ATOM 199 N ILE A 16 4.717 -13.522 1.151 1.00 0.00 N ATOM 200 CA ILE A 16 3.779 -13.062 2.160 1.00 0.00 C ATOM 201 C ILE A 16 4.453 -11.998 3.029 1.00 0.00 C ATOM 202 O ILE A 16 4.042 -10.839 3.027 1.00 0.00 O ATOM 203 CB ILE A 16 3.224 -14.245 2.956 1.00 0.00 C ATOM 204 CG1 ILE A 16 2.141 -14.980 2.163 1.00 0.00 C ATOM 205 CG2 ILE A 16 2.723 -13.795 4.330 1.00 0.00 C ATOM 206 CD1 ILE A 16 0.947 -15.325 3.055 1.00 0.00 C ATOM 0 H ILE A 16 4.831 -14.535 1.105 1.00 0.00 H new ATOM 0 HA ILE A 16 2.915 -12.591 1.690 1.00 0.00 H new ATOM 0 HB ILE A 16 4.035 -14.953 3.125 1.00 0.00 H new ATOM 0 HG12 ILE A 16 1.810 -14.359 1.331 1.00 0.00 H new ATOM 0 HG13 ILE A 16 2.555 -15.893 1.735 1.00 0.00 H new ATOM 0 HG21 ILE A 16 2.334 -14.655 4.875 1.00 0.00 H new ATOM 0 HG22 ILE A 16 3.546 -13.353 4.891 1.00 0.00 H new ATOM 0 HG23 ILE A 16 1.931 -13.056 4.205 1.00 0.00 H new ATOM 0 HD11 ILE A 16 0.192 -15.847 2.467 1.00 0.00 H new ATOM 0 HD12 ILE A 16 1.277 -15.966 3.873 1.00 0.00 H new ATOM 0 HD13 ILE A 16 0.520 -14.408 3.462 1.00 0.00 H new ATOM 218 N GLN A 17 5.476 -12.431 3.751 1.00 0.00 N ATOM 219 CA GLN A 17 6.211 -11.530 4.622 1.00 0.00 C ATOM 220 C GLN A 17 6.410 -10.175 3.940 1.00 0.00 C ATOM 221 O GLN A 17 6.234 -9.130 4.564 1.00 0.00 O ATOM 222 CB GLN A 17 7.553 -12.139 5.034 1.00 0.00 C ATOM 223 CG GLN A 17 7.425 -12.911 6.349 1.00 0.00 C ATOM 224 CD GLN A 17 8.799 -13.155 6.977 1.00 0.00 C ATOM 225 OE1 GLN A 17 9.544 -14.034 6.580 1.00 0.00 O ATOM 226 NE2 GLN A 17 9.090 -12.329 7.978 1.00 0.00 N ATOM 0 H GLN A 17 5.813 -13.394 3.751 1.00 0.00 H new ATOM 0 HA GLN A 17 5.626 -11.375 5.528 1.00 0.00 H new ATOM 0 HB2 GLN A 17 7.909 -12.807 4.250 1.00 0.00 H new ATOM 0 HB3 GLN A 17 8.297 -11.349 5.143 1.00 0.00 H new ATOM 0 HG2 GLN A 17 6.798 -12.352 7.043 1.00 0.00 H new ATOM 0 HG3 GLN A 17 6.929 -13.865 6.168 1.00 0.00 H new ATOM 0 HE21 GLN A 17 8.420 -11.614 8.260 1.00 0.00 H new ATOM 0 HE22 GLN A 17 9.983 -12.411 8.463 1.00 0.00 H new ATOM 235 N THR A 18 6.775 -10.237 2.668 1.00 0.00 N ATOM 236 CA THR A 18 7.000 -9.028 1.894 1.00 0.00 C ATOM 237 C THR A 18 5.692 -8.252 1.725 1.00 0.00 C ATOM 238 O THR A 18 5.666 -7.032 1.876 1.00 0.00 O ATOM 239 CB THR A 18 7.643 -9.430 0.565 1.00 0.00 C ATOM 240 OG1 THR A 18 8.923 -9.934 0.938 1.00 0.00 O ATOM 241 CG2 THR A 18 7.961 -8.223 -0.320 1.00 0.00 C ATOM 0 H THR A 18 6.921 -11.106 2.154 1.00 0.00 H new ATOM 0 HA THR A 18 7.680 -8.350 2.409 1.00 0.00 H new ATOM 0 HB THR A 18 6.978 -10.107 0.030 1.00 0.00 H new ATOM 0 HG1 THR A 18 8.907 -10.914 0.919 1.00 0.00 H new ATOM 0 HG21 THR A 18 8.416 -8.564 -1.250 1.00 0.00 H new ATOM 0 HG22 THR A 18 7.041 -7.682 -0.542 1.00 0.00 H new ATOM 0 HG23 THR A 18 8.653 -7.562 0.201 1.00 0.00 H new ATOM 249 N CYS A 19 4.638 -8.992 1.414 1.00 0.00 N ATOM 250 CA CYS A 19 3.330 -8.389 1.224 1.00 0.00 C ATOM 251 C CYS A 19 2.919 -7.709 2.531 1.00 0.00 C ATOM 252 O CYS A 19 2.590 -6.523 2.542 1.00 0.00 O ATOM 253 CB CYS A 19 2.294 -9.417 0.766 1.00 0.00 C ATOM 254 SG CYS A 19 2.480 -9.738 -1.027 1.00 0.00 S ATOM 0 H CYS A 19 4.663 -10.004 1.289 1.00 0.00 H new ATOM 0 HA CYS A 19 3.383 -7.645 0.429 1.00 0.00 H new ATOM 0 HB2 CYS A 19 2.419 -10.345 1.325 1.00 0.00 H new ATOM 0 HB3 CYS A 19 1.289 -9.051 0.976 1.00 0.00 H new ATOM 0 HG CYS A 19 1.597 -10.614 -1.405 1.00 0.00 H new ATOM 260 N SER A 20 2.952 -8.488 3.602 1.00 0.00 N ATOM 261 CA SER A 20 2.587 -7.976 4.912 1.00 0.00 C ATOM 262 C SER A 20 3.216 -6.597 5.128 1.00 0.00 C ATOM 263 O SER A 20 2.525 -5.647 5.492 1.00 0.00 O ATOM 264 CB SER A 20 3.022 -8.937 6.020 1.00 0.00 C ATOM 265 OG SER A 20 2.498 -8.560 7.290 1.00 0.00 O ATOM 0 H SER A 20 3.226 -9.470 3.589 1.00 0.00 H new ATOM 0 HA SER A 20 1.502 -7.884 4.953 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.690 -9.946 5.776 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.111 -8.963 6.070 1.00 0.00 H new ATOM 0 HG SER A 20 2.797 -9.199 7.970 1.00 0.00 H new ATOM 271 N GLY A 21 4.518 -6.533 4.895 1.00 0.00 N ATOM 272 CA GLY A 21 5.247 -5.287 5.060 1.00 0.00 C ATOM 273 C GLY A 21 4.653 -4.184 4.182 1.00 0.00 C ATOM 274 O GLY A 21 4.236 -3.142 4.685 1.00 0.00 O ATOM 0 H GLY A 21 5.087 -7.324 4.593 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.218 -4.980 6.105 1.00 0.00 H new ATOM 0 HA3 GLY A 21 6.295 -5.438 4.801 1.00 0.00 H new ATOM 278 N ASN A 22 4.634 -4.451 2.884 1.00 0.00 N ATOM 279 CA ASN A 22 4.098 -3.494 1.931 1.00 0.00 C ATOM 280 C ASN A 22 2.821 -2.873 2.502 1.00 0.00 C ATOM 281 O ASN A 22 2.738 -1.657 2.668 1.00 0.00 O ATOM 282 CB ASN A 22 3.743 -4.174 0.608 1.00 0.00 C ATOM 283 CG ASN A 22 5.004 -4.597 -0.147 1.00 0.00 C ATOM 284 OD1 ASN A 22 6.122 -4.393 0.296 1.00 0.00 O ATOM 285 ND2 ASN A 22 4.764 -5.197 -1.310 1.00 0.00 N ATOM 0 H ASN A 22 4.981 -5.316 2.470 1.00 0.00 H new ATOM 0 HA ASN A 22 4.858 -2.734 1.752 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.120 -5.047 0.800 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.157 -3.493 -0.009 1.00 0.00 H new ATOM 0 HD21 ASN A 22 5.541 -5.517 -1.889 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.803 -5.337 -1.623 1.00 0.00 H new ATOM 292 N ILE A 23 1.857 -3.737 2.786 1.00 0.00 N ATOM 293 CA ILE A 23 0.588 -3.289 3.334 1.00 0.00 C ATOM 294 C ILE A 23 0.849 -2.255 4.431 1.00 0.00 C ATOM 295 O ILE A 23 0.382 -1.120 4.343 1.00 0.00 O ATOM 296 CB ILE A 23 -0.246 -4.484 3.800 1.00 0.00 C ATOM 297 CG1 ILE A 23 -0.797 -5.267 2.607 1.00 0.00 C ATOM 298 CG2 ILE A 23 -1.354 -4.039 4.756 1.00 0.00 C ATOM 299 CD1 ILE A 23 -1.639 -6.456 3.073 1.00 0.00 C ATOM 0 H ILE A 23 1.929 -4.745 2.647 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.007 -2.796 2.565 1.00 0.00 H new ATOM 0 HB ILE A 23 0.405 -5.160 4.354 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.404 -4.609 1.985 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.027 -5.621 1.988 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.932 -4.907 5.072 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.911 -3.560 5.629 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.010 -3.332 4.249 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -2.019 -6.995 2.205 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -1.023 -7.124 3.675 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.476 -6.097 3.671 1.00 0.00 H new ATOM 311 N GLN A 24 1.593 -2.684 5.440 1.00 0.00 N ATOM 312 CA GLN A 24 1.920 -1.809 6.553 1.00 0.00 C ATOM 313 C GLN A 24 2.323 -0.425 6.040 1.00 0.00 C ATOM 314 O GLN A 24 1.687 0.573 6.373 1.00 0.00 O ATOM 315 CB GLN A 24 3.026 -2.416 7.420 1.00 0.00 C ATOM 316 CG GLN A 24 2.610 -3.786 7.959 1.00 0.00 C ATOM 317 CD GLN A 24 2.397 -3.738 9.473 1.00 0.00 C ATOM 318 OE1 GLN A 24 2.703 -2.762 10.138 1.00 0.00 O ATOM 319 NE2 GLN A 24 1.856 -4.843 9.978 1.00 0.00 N ATOM 0 H GLN A 24 1.979 -3.626 5.510 1.00 0.00 H new ATOM 0 HA GLN A 24 1.033 -1.699 7.177 1.00 0.00 H new ATOM 0 HB2 GLN A 24 3.940 -2.514 6.834 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.250 -1.747 8.251 1.00 0.00 H new ATOM 0 HG2 GLN A 24 1.692 -4.110 7.469 1.00 0.00 H new ATOM 0 HG3 GLN A 24 3.376 -4.523 7.719 1.00 0.00 H new ATOM 0 HE21 GLN A 24 1.624 -5.624 9.364 1.00 0.00 H new ATOM 0 HE22 GLN A 24 1.673 -4.910 10.979 1.00 0.00 H new ATOM 328 N ARG A 25 3.377 -0.411 5.238 1.00 0.00 N ATOM 329 CA ARG A 25 3.873 0.834 4.675 1.00 0.00 C ATOM 330 C ARG A 25 2.719 1.642 4.076 1.00 0.00 C ATOM 331 O ARG A 25 2.538 2.812 4.409 1.00 0.00 O ATOM 332 CB ARG A 25 4.919 0.571 3.590 1.00 0.00 C ATOM 333 CG ARG A 25 6.334 0.631 4.168 1.00 0.00 C ATOM 334 CD ARG A 25 7.012 -0.739 4.101 1.00 0.00 C ATOM 335 NE ARG A 25 7.977 -0.881 5.214 1.00 0.00 N ATOM 336 CZ ARG A 25 8.542 -2.041 5.575 1.00 0.00 C ATOM 337 NH1 ARG A 25 8.243 -3.167 4.912 1.00 0.00 N ATOM 338 NH2 ARG A 25 9.407 -2.076 6.598 1.00 0.00 N ATOM 0 H ARG A 25 3.902 -1.242 4.964 1.00 0.00 H new ATOM 0 HA ARG A 25 4.338 1.400 5.482 1.00 0.00 H new ATOM 0 HB2 ARG A 25 4.746 -0.408 3.143 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.816 1.308 2.794 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.926 1.361 3.616 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.294 0.971 5.203 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.262 -1.528 4.156 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.526 -0.853 3.146 1.00 0.00 H new ATOM 0 HE ARG A 25 8.228 -0.043 5.739 1.00 0.00 H new ATOM 0 HH11 ARG A 25 7.585 -3.141 4.133 1.00 0.00 H new ATOM 0 HH12 ARG A 25 8.673 -4.050 5.187 1.00 0.00 H new ATOM 0 HH21 ARG A 25 9.635 -1.219 7.102 1.00 0.00 H new ATOM 0 HH22 ARG A 25 9.837 -2.959 6.872 1.00 0.00 H new ATOM 352 N ILE A 26 1.970 0.985 3.203 1.00 0.00 N ATOM 353 CA ILE A 26 0.839 1.628 2.555 1.00 0.00 C ATOM 354 C ILE A 26 0.022 2.389 3.601 1.00 0.00 C ATOM 355 O ILE A 26 -0.233 3.582 3.446 1.00 0.00 O ATOM 356 CB ILE A 26 0.023 0.604 1.763 1.00 0.00 C ATOM 357 CG1 ILE A 26 0.868 -0.034 0.658 1.00 0.00 C ATOM 358 CG2 ILE A 26 -1.259 1.232 1.213 1.00 0.00 C ATOM 359 CD1 ILE A 26 0.147 -1.232 0.039 1.00 0.00 C ATOM 0 H ILE A 26 2.124 0.015 2.929 1.00 0.00 H new ATOM 0 HA ILE A 26 1.184 2.360 1.825 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.275 -0.194 2.442 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.081 0.705 -0.114 1.00 0.00 H new ATOM 0 HG13 ILE A 26 1.827 -0.354 1.067 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.820 0.483 0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -1.867 1.600 2.039 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.004 2.061 0.553 1.00 0.00 H new ATOM 0 HD11 ILE A 26 0.769 -1.667 -0.743 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.043 -1.980 0.809 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.800 -0.905 -0.391 1.00 0.00 H new ATOM 371 N SER A 27 -0.366 1.667 4.642 1.00 0.00 N ATOM 372 CA SER A 27 -1.149 2.259 5.713 1.00 0.00 C ATOM 373 C SER A 27 -0.327 3.332 6.430 1.00 0.00 C ATOM 374 O SER A 27 -0.868 4.351 6.857 1.00 0.00 O ATOM 375 CB SER A 27 -1.615 1.194 6.708 1.00 0.00 C ATOM 376 OG SER A 27 -3.033 1.174 6.843 1.00 0.00 O ATOM 0 H SER A 27 -0.153 0.677 4.766 1.00 0.00 H new ATOM 0 HA SER A 27 -2.034 2.720 5.275 1.00 0.00 H new ATOM 0 HB2 SER A 27 -1.268 0.214 6.379 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.161 1.383 7.681 1.00 0.00 H new ATOM 0 HG SER A 27 -3.291 0.480 7.485 1.00 0.00 H new ATOM 382 N GLN A 28 0.966 3.066 6.542 1.00 0.00 N ATOM 383 CA GLN A 28 1.867 3.997 7.200 1.00 0.00 C ATOM 384 C GLN A 28 1.866 5.342 6.471 1.00 0.00 C ATOM 385 O GLN A 28 1.444 6.354 7.028 1.00 0.00 O ATOM 386 CB GLN A 28 3.282 3.421 7.286 1.00 0.00 C ATOM 387 CG GLN A 28 3.331 2.227 8.242 1.00 0.00 C ATOM 388 CD GLN A 28 4.599 2.260 9.096 1.00 0.00 C ATOM 389 OE1 GLN A 28 5.326 3.239 9.137 1.00 0.00 O ATOM 390 NE2 GLN A 28 4.824 1.138 9.774 1.00 0.00 N ATOM 0 H GLN A 28 1.411 2.219 6.188 1.00 0.00 H new ATOM 0 HA GLN A 28 1.512 4.158 8.218 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.613 3.112 6.295 1.00 0.00 H new ATOM 0 HB3 GLN A 28 3.973 4.193 7.626 1.00 0.00 H new ATOM 0 HG2 GLN A 28 2.453 2.238 8.888 1.00 0.00 H new ATOM 0 HG3 GLN A 28 3.296 1.299 7.672 1.00 0.00 H new ATOM 0 HE21 GLN A 28 4.175 0.355 9.695 1.00 0.00 H new ATOM 0 HE22 GLN A 28 5.646 1.060 10.373 1.00 0.00 H new ATOM 399 N ALA A 29 2.345 5.310 5.236 1.00 0.00 N ATOM 400 CA ALA A 29 2.404 6.514 4.425 1.00 0.00 C ATOM 401 C ALA A 29 1.070 7.256 4.521 1.00 0.00 C ATOM 402 O ALA A 29 1.042 8.481 4.632 1.00 0.00 O ATOM 403 CB ALA A 29 2.762 6.143 2.984 1.00 0.00 C ATOM 0 H ALA A 29 2.696 4.469 4.777 1.00 0.00 H new ATOM 0 HA ALA A 29 3.181 7.185 4.792 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.806 7.047 2.376 1.00 0.00 H new ATOM 0 HB2 ALA A 29 3.732 5.646 2.966 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.003 5.472 2.582 1.00 0.00 H new ATOM 409 N THR A 30 -0.005 6.482 4.476 1.00 0.00 N ATOM 410 CA THR A 30 -1.340 7.050 4.558 1.00 0.00 C ATOM 411 C THR A 30 -1.503 7.847 5.853 1.00 0.00 C ATOM 412 O THR A 30 -2.203 8.858 5.881 1.00 0.00 O ATOM 413 CB THR A 30 -2.349 5.909 4.415 1.00 0.00 C ATOM 414 OG1 THR A 30 -2.452 5.710 3.008 1.00 0.00 O ATOM 415 CG2 THR A 30 -3.761 6.320 4.838 1.00 0.00 C ATOM 0 H THR A 30 0.022 5.467 4.384 1.00 0.00 H new ATOM 0 HA THR A 30 -1.517 7.762 3.752 1.00 0.00 H new ATOM 0 HB THR A 30 -2.023 5.059 5.015 1.00 0.00 H new ATOM 0 HG1 THR A 30 -1.807 5.028 2.726 1.00 0.00 H new ATOM 0 HG21 THR A 30 -4.438 5.474 4.717 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.752 6.631 5.883 1.00 0.00 H new ATOM 0 HG23 THR A 30 -4.101 7.148 4.216 1.00 0.00 H new ATOM 423 N ALA A 31 -0.843 7.362 6.895 1.00 0.00 N ATOM 424 CA ALA A 31 -0.906 8.017 8.191 1.00 0.00 C ATOM 425 C ALA A 31 -0.109 9.321 8.138 1.00 0.00 C ATOM 426 O ALA A 31 -0.525 10.331 8.704 1.00 0.00 O ATOM 427 CB ALA A 31 -0.391 7.062 9.271 1.00 0.00 C ATOM 0 H ALA A 31 -0.262 6.524 6.868 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.936 8.270 8.443 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -0.438 7.553 10.243 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.009 6.164 9.287 1.00 0.00 H new ATOM 0 HB3 ALA A 31 0.641 6.788 9.052 1.00 0.00 H new ATOM 433 N GLN A 32 1.023 9.258 7.452 1.00 0.00 N ATOM 434 CA GLN A 32 1.882 10.422 7.318 1.00 0.00 C ATOM 435 C GLN A 32 1.118 11.573 6.661 1.00 0.00 C ATOM 436 O GLN A 32 1.180 12.710 7.127 1.00 0.00 O ATOM 437 CB GLN A 32 3.147 10.082 6.526 1.00 0.00 C ATOM 438 CG GLN A 32 4.290 9.686 7.463 1.00 0.00 C ATOM 439 CD GLN A 32 4.932 8.370 7.018 1.00 0.00 C ATOM 440 OE1 GLN A 32 4.295 7.331 6.949 1.00 0.00 O ATOM 441 NE2 GLN A 32 6.224 8.471 6.722 1.00 0.00 N ATOM 0 H GLN A 32 1.365 8.419 6.983 1.00 0.00 H new ATOM 0 HA GLN A 32 2.190 10.738 8.315 1.00 0.00 H new ATOM 0 HB2 GLN A 32 2.939 9.265 5.835 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.446 10.941 5.925 1.00 0.00 H new ATOM 0 HG2 GLN A 32 5.042 10.475 7.479 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.913 9.585 8.481 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.697 9.371 6.801 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.743 7.648 6.415 1.00 0.00 H new ATOM 450 N ILE A 33 0.414 11.239 5.589 1.00 0.00 N ATOM 451 CA ILE A 33 -0.362 12.231 4.864 1.00 0.00 C ATOM 452 C ILE A 33 -1.394 12.853 5.806 1.00 0.00 C ATOM 453 O ILE A 33 -1.596 14.067 5.798 1.00 0.00 O ATOM 454 CB ILE A 33 -0.972 11.616 3.603 1.00 0.00 C ATOM 455 CG1 ILE A 33 0.087 11.434 2.514 1.00 0.00 C ATOM 456 CG2 ILE A 33 -2.163 12.442 3.112 1.00 0.00 C ATOM 457 CD1 ILE A 33 0.032 10.022 1.926 1.00 0.00 C ATOM 0 H ILE A 33 0.365 10.295 5.205 1.00 0.00 H new ATOM 0 HA ILE A 33 0.282 13.040 4.517 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.349 10.625 3.854 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.070 12.167 1.723 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.077 11.620 2.930 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.578 11.984 2.215 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -2.927 12.476 3.889 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.833 13.455 2.882 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.795 9.919 1.154 1.00 0.00 H new ATOM 0 HD12 ILE A 33 0.213 9.292 2.715 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.951 9.848 1.489 1.00 0.00 H new ATOM 469 N LYS A 34 -2.021 11.994 6.597 1.00 0.00 N ATOM 470 CA LYS A 34 -3.027 12.444 7.543 1.00 0.00 C ATOM 471 C LYS A 34 -2.361 13.306 8.618 1.00 0.00 C ATOM 472 O LYS A 34 -2.917 14.320 9.038 1.00 0.00 O ATOM 473 CB LYS A 34 -3.805 11.253 8.105 1.00 0.00 C ATOM 474 CG LYS A 34 -4.724 10.648 7.042 1.00 0.00 C ATOM 475 CD LYS A 34 -5.529 9.479 7.614 1.00 0.00 C ATOM 476 CE LYS A 34 -4.989 8.141 7.107 1.00 0.00 C ATOM 477 NZ LYS A 34 -5.429 7.037 7.989 1.00 0.00 N ATOM 0 H LYS A 34 -1.851 10.988 6.602 1.00 0.00 H new ATOM 0 HA LYS A 34 -3.766 13.071 7.044 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -3.108 10.495 8.463 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -4.396 11.573 8.963 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.404 11.413 6.666 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.130 10.305 6.195 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.488 9.503 8.703 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -6.577 9.582 7.333 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -5.338 7.963 6.090 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -3.900 8.172 7.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -4.598 6.516 8.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -5.954 7.427 8.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.045 6.391 7.456 1.00 0.00 H new ATOM 491 N ASN A 35 -1.180 12.871 9.032 1.00 0.00 N ATOM 492 CA ASN A 35 -0.432 13.590 10.049 1.00 0.00 C ATOM 493 C ASN A 35 0.039 14.929 9.479 1.00 0.00 C ATOM 494 O ASN A 35 -0.125 15.970 10.113 1.00 0.00 O ATOM 495 CB ASN A 35 0.803 12.801 10.486 1.00 0.00 C ATOM 496 CG ASN A 35 0.550 12.071 11.806 1.00 0.00 C ATOM 497 OD1 ASN A 35 -0.559 11.670 12.121 1.00 0.00 O ATOM 498 ND2 ASN A 35 1.636 11.921 12.559 1.00 0.00 N ATOM 0 H ASN A 35 -0.723 12.029 8.681 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.087 13.738 10.907 1.00 0.00 H new ATOM 0 HB2 ASN A 35 1.070 12.080 9.713 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.650 13.478 10.597 1.00 0.00 H new ATOM 0 HD21 ASN A 35 1.571 11.446 13.460 1.00 0.00 H new ATOM 0 HD22 ASN A 35 2.534 12.280 12.236 1.00 0.00 H new ATOM 505 N LEU A 36 0.616 14.859 8.288 1.00 0.00 N ATOM 506 CA LEU A 36 1.113 16.052 7.625 1.00 0.00 C ATOM 507 C LEU A 36 -0.063 16.975 7.298 1.00 0.00 C ATOM 508 O LEU A 36 0.133 18.149 6.985 1.00 0.00 O ATOM 509 CB LEU A 36 1.957 15.676 6.406 1.00 0.00 C ATOM 510 CG LEU A 36 3.264 14.937 6.697 1.00 0.00 C ATOM 511 CD1 LEU A 36 3.692 14.087 5.499 1.00 0.00 C ATOM 512 CD2 LEU A 36 4.361 15.913 7.129 1.00 0.00 C ATOM 0 H LEU A 36 0.750 13.994 7.765 1.00 0.00 H new ATOM 0 HA LEU A 36 1.780 16.606 8.286 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.351 15.055 5.747 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.193 16.588 5.857 1.00 0.00 H new ATOM 0 HG LEU A 36 3.093 14.255 7.530 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.624 13.572 5.732 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.917 13.353 5.279 1.00 0.00 H new ATOM 0 HD13 LEU A 36 3.840 14.730 4.631 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.280 15.362 7.330 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.538 16.636 6.333 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.047 16.437 8.032 1.00 0.00 H new ATOM 524 N MET A 37 -1.259 16.411 7.383 1.00 0.00 N ATOM 525 CA MET A 37 -2.466 17.169 7.100 1.00 0.00 C ATOM 526 C MET A 37 -2.809 18.106 8.260 1.00 0.00 C ATOM 527 O MET A 37 -3.040 19.296 8.053 1.00 0.00 O ATOM 528 CB MET A 37 -3.630 16.204 6.861 1.00 0.00 C ATOM 529 CG MET A 37 -4.218 16.392 5.462 1.00 0.00 C ATOM 530 SD MET A 37 -5.472 15.159 5.157 1.00 0.00 S ATOM 531 CE MET A 37 -4.470 13.869 4.438 1.00 0.00 C ATOM 0 H MET A 37 -1.418 15.438 7.644 1.00 0.00 H new ATOM 0 HA MET A 37 -2.294 17.773 6.209 1.00 0.00 H new ATOM 0 HB2 MET A 37 -3.286 15.177 6.980 1.00 0.00 H new ATOM 0 HB3 MET A 37 -4.404 16.369 7.610 1.00 0.00 H new ATOM 0 HG2 MET A 37 -4.647 17.390 5.370 1.00 0.00 H new ATOM 0 HG3 MET A 37 -3.430 16.314 4.713 1.00 0.00 H new ATOM 0 HE1 MET A 37 -4.800 13.678 3.417 1.00 0.00 H new ATOM 0 HE2 MET A 37 -3.426 14.182 4.429 1.00 0.00 H new ATOM 0 HE3 MET A 37 -4.571 12.958 5.028 1.00 0.00 H new ATOM 541 N SER A 38 -2.831 17.534 9.455 1.00 0.00 N ATOM 542 CA SER A 38 -3.142 18.304 10.647 1.00 0.00 C ATOM 543 C SER A 38 -2.223 19.524 10.737 1.00 0.00 C ATOM 544 O SER A 38 -2.667 20.615 11.089 1.00 0.00 O ATOM 545 CB SER A 38 -3.009 17.445 11.907 1.00 0.00 C ATOM 546 OG SER A 38 -4.257 17.282 12.575 1.00 0.00 O ATOM 0 H SER A 38 -2.639 16.547 9.623 1.00 0.00 H new ATOM 0 HA SER A 38 -4.176 18.641 10.577 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.611 16.467 11.639 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.292 17.906 12.586 1.00 0.00 H new ATOM 0 HG SER A 38 -4.131 16.727 13.373 1.00 0.00 H new ATOM 755 N ASN A 52 6.391 16.405 0.676 1.00 0.00 N ATOM 756 CA ASN A 52 6.454 15.137 1.382 1.00 0.00 C ATOM 757 C ASN A 52 5.195 14.323 1.074 1.00 0.00 C ATOM 758 O ASN A 52 5.267 13.110 0.883 1.00 0.00 O ATOM 759 CB ASN A 52 6.519 15.351 2.896 1.00 0.00 C ATOM 760 CG ASN A 52 7.816 14.782 3.475 1.00 0.00 C ATOM 761 OD1 ASN A 52 8.351 13.790 3.010 1.00 0.00 O ATOM 762 ND2 ASN A 52 8.290 15.465 4.513 1.00 0.00 N ATOM 0 HA ASN A 52 7.351 14.613 1.053 1.00 0.00 H new ATOM 0 HB2 ASN A 52 6.453 16.416 3.120 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.663 14.872 3.372 1.00 0.00 H new ATOM 0 HD21 ASN A 52 9.152 15.166 4.970 1.00 0.00 H new ATOM 0 HD22 ASN A 52 7.792 16.288 4.852 1.00 0.00 H new ATOM 769 N LEU A 53 4.071 15.024 1.036 1.00 0.00 N ATOM 770 CA LEU A 53 2.798 14.382 0.754 1.00 0.00 C ATOM 771 C LEU A 53 2.901 13.613 -0.565 1.00 0.00 C ATOM 772 O LEU A 53 2.708 12.398 -0.595 1.00 0.00 O ATOM 773 CB LEU A 53 1.663 15.408 0.780 1.00 0.00 C ATOM 774 CG LEU A 53 1.592 16.297 2.024 1.00 0.00 C ATOM 775 CD1 LEU A 53 0.525 17.382 1.861 1.00 0.00 C ATOM 776 CD2 LEU A 53 1.369 15.459 3.284 1.00 0.00 C ATOM 0 H LEU A 53 4.015 16.030 1.196 1.00 0.00 H new ATOM 0 HA LEU A 53 2.558 13.655 1.530 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.759 16.050 -0.096 1.00 0.00 H new ATOM 0 HB3 LEU A 53 0.717 14.876 0.683 1.00 0.00 H new ATOM 0 HG LEU A 53 2.551 16.802 2.139 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.495 18.000 2.758 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.768 18.004 1.000 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.448 16.915 1.709 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.322 16.115 4.154 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.432 14.909 3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 53 2.193 14.756 3.404 1.00 0.00 H new ATOM 788 N GLN A 54 3.204 14.351 -1.622 1.00 0.00 N ATOM 789 CA GLN A 54 3.335 13.753 -2.940 1.00 0.00 C ATOM 790 C GLN A 54 4.410 12.665 -2.925 1.00 0.00 C ATOM 791 O GLN A 54 4.419 11.785 -3.784 1.00 0.00 O ATOM 792 CB GLN A 54 3.645 14.816 -3.996 1.00 0.00 C ATOM 793 CG GLN A 54 2.420 15.691 -4.269 1.00 0.00 C ATOM 794 CD GLN A 54 2.362 16.109 -5.740 1.00 0.00 C ATOM 795 OE1 GLN A 54 3.369 16.361 -6.380 1.00 0.00 O ATOM 796 NE2 GLN A 54 1.130 16.168 -6.237 1.00 0.00 N ATOM 0 H GLN A 54 3.363 15.358 -1.593 1.00 0.00 H new ATOM 0 HA GLN A 54 2.383 13.292 -3.205 1.00 0.00 H new ATOM 0 HB2 GLN A 54 4.473 15.439 -3.658 1.00 0.00 H new ATOM 0 HB3 GLN A 54 3.965 14.334 -4.920 1.00 0.00 H new ATOM 0 HG2 GLN A 54 1.513 15.146 -4.006 1.00 0.00 H new ATOM 0 HG3 GLN A 54 2.454 16.578 -3.636 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.330 15.944 -5.645 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.985 16.437 -7.210 1.00 0.00 H new ATOM 805 N GLN A 55 5.291 12.762 -1.940 1.00 0.00 N ATOM 806 CA GLN A 55 6.368 11.796 -1.802 1.00 0.00 C ATOM 807 C GLN A 55 5.887 10.573 -1.018 1.00 0.00 C ATOM 808 O GLN A 55 6.413 9.475 -1.191 1.00 0.00 O ATOM 809 CB GLN A 55 7.590 12.430 -1.134 1.00 0.00 C ATOM 810 CG GLN A 55 7.968 11.679 0.144 1.00 0.00 C ATOM 811 CD GLN A 55 9.363 12.082 0.625 1.00 0.00 C ATOM 812 OE1 GLN A 55 10.146 11.270 1.090 1.00 0.00 O ATOM 813 NE2 GLN A 55 9.629 13.378 0.488 1.00 0.00 N ATOM 0 H GLN A 55 5.281 13.494 -1.230 1.00 0.00 H new ATOM 0 HA GLN A 55 6.667 11.470 -2.798 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.432 12.423 -1.826 1.00 0.00 H new ATOM 0 HB3 GLN A 55 7.380 13.473 -0.898 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.236 11.889 0.924 1.00 0.00 H new ATOM 0 HG3 GLN A 55 7.939 10.605 -0.039 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.928 14.003 0.091 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.534 13.747 0.780 1.00 0.00 H new ATOM 822 N LEU A 56 4.894 10.804 -0.173 1.00 0.00 N ATOM 823 CA LEU A 56 4.336 9.735 0.638 1.00 0.00 C ATOM 824 C LEU A 56 3.286 8.978 -0.177 1.00 0.00 C ATOM 825 O LEU A 56 3.046 7.795 0.060 1.00 0.00 O ATOM 826 CB LEU A 56 3.807 10.287 1.963 1.00 0.00 C ATOM 827 CG LEU A 56 4.853 10.546 3.048 1.00 0.00 C ATOM 828 CD1 LEU A 56 4.465 11.749 3.909 1.00 0.00 C ATOM 829 CD2 LEU A 56 5.090 9.291 3.891 1.00 0.00 C ATOM 0 H LEU A 56 4.461 11.717 -0.032 1.00 0.00 H new ATOM 0 HA LEU A 56 5.110 9.016 0.906 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.283 11.221 1.761 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.070 9.587 2.357 1.00 0.00 H new ATOM 0 HG LEU A 56 5.797 10.791 2.561 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.226 11.911 4.672 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.387 12.636 3.281 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.505 11.559 4.389 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.838 9.502 4.655 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.157 8.992 4.369 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.444 8.484 3.250 1.00 0.00 H new ATOM 841 N GLN A 57 2.688 9.690 -1.120 1.00 0.00 N ATOM 842 CA GLN A 57 1.669 9.100 -1.971 1.00 0.00 C ATOM 843 C GLN A 57 2.316 8.211 -3.035 1.00 0.00 C ATOM 844 O GLN A 57 1.948 7.046 -3.183 1.00 0.00 O ATOM 845 CB GLN A 57 0.799 10.182 -2.615 1.00 0.00 C ATOM 846 CG GLN A 57 -0.037 10.912 -1.563 1.00 0.00 C ATOM 847 CD GLN A 57 -0.722 12.141 -2.163 1.00 0.00 C ATOM 848 OE1 GLN A 57 -1.532 12.052 -3.071 1.00 0.00 O ATOM 849 NE2 GLN A 57 -0.354 13.292 -1.606 1.00 0.00 N ATOM 0 H GLN A 57 2.890 10.671 -1.314 1.00 0.00 H new ATOM 0 HA GLN A 57 1.021 8.479 -1.352 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.432 10.896 -3.142 1.00 0.00 H new ATOM 0 HB3 GLN A 57 0.141 9.730 -3.358 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.788 10.235 -1.156 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.601 11.216 -0.733 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.330 13.297 -0.849 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -0.755 14.170 -1.936 1.00 0.00 H new ATOM 858 N HIS A 58 3.267 8.794 -3.749 1.00 0.00 N ATOM 859 CA HIS A 58 3.969 8.068 -4.795 1.00 0.00 C ATOM 860 C HIS A 58 4.499 6.747 -4.236 1.00 0.00 C ATOM 861 O HIS A 58 4.168 5.676 -4.743 1.00 0.00 O ATOM 862 CB HIS A 58 5.068 8.934 -5.413 1.00 0.00 C ATOM 863 CG HIS A 58 5.618 8.394 -6.711 1.00 0.00 C ATOM 864 ND1 HIS A 58 5.909 9.201 -7.797 1.00 0.00 N ATOM 865 CD2 HIS A 58 5.929 7.119 -7.085 1.00 0.00 C ATOM 866 CE1 HIS A 58 6.372 8.437 -8.775 1.00 0.00 C ATOM 867 NE2 HIS A 58 6.383 7.147 -8.332 1.00 0.00 N ATOM 0 H HIS A 58 3.568 9.760 -3.624 1.00 0.00 H new ATOM 0 HA HIS A 58 3.278 7.829 -5.603 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.673 9.935 -5.586 1.00 0.00 H new ATOM 0 HB3 HIS A 58 5.884 9.033 -4.697 1.00 0.00 H new ATOM 0 HD1 HIS A 58 5.787 10.213 -7.837 1.00 0.00 H new ATOM 0 HD2 HIS A 58 5.824 6.237 -6.471 1.00 0.00 H new ATOM 0 HE1 HIS A 58 6.686 8.776 -9.751 1.00 0.00 H new ATOM 875 N SER A 59 5.314 6.865 -3.198 1.00 0.00 N ATOM 876 CA SER A 59 5.894 5.693 -2.564 1.00 0.00 C ATOM 877 C SER A 59 4.832 4.603 -2.410 1.00 0.00 C ATOM 878 O SER A 59 4.980 3.507 -2.948 1.00 0.00 O ATOM 879 CB SER A 59 6.496 6.044 -1.202 1.00 0.00 C ATOM 880 OG SER A 59 7.830 5.560 -1.067 1.00 0.00 O ATOM 0 H SER A 59 5.587 7.755 -2.780 1.00 0.00 H new ATOM 0 HA SER A 59 6.697 5.322 -3.201 1.00 0.00 H new ATOM 0 HB2 SER A 59 6.488 7.126 -1.070 1.00 0.00 H new ATOM 0 HB3 SER A 59 5.875 5.622 -0.412 1.00 0.00 H new ATOM 0 HG SER A 59 8.179 5.806 -0.185 1.00 0.00 H new ATOM 886 N THR A 60 3.785 4.941 -1.671 1.00 0.00 N ATOM 887 CA THR A 60 2.699 4.004 -1.439 1.00 0.00 C ATOM 888 C THR A 60 2.091 3.553 -2.768 1.00 0.00 C ATOM 889 O THR A 60 1.790 2.374 -2.948 1.00 0.00 O ATOM 890 CB THR A 60 1.689 4.674 -0.505 1.00 0.00 C ATOM 891 OG1 THR A 60 2.436 4.946 0.677 1.00 0.00 O ATOM 892 CG2 THR A 60 0.594 3.712 -0.040 1.00 0.00 C ATOM 0 H THR A 60 3.666 5.851 -1.225 1.00 0.00 H new ATOM 0 HA THR A 60 3.057 3.095 -0.956 1.00 0.00 H new ATOM 0 HB THR A 60 1.234 5.524 -1.013 1.00 0.00 H new ATOM 0 HG1 THR A 60 2.862 5.825 0.600 1.00 0.00 H new ATOM 0 HG21 THR A 60 -0.096 4.238 0.620 1.00 0.00 H new ATOM 0 HG22 THR A 60 0.051 3.333 -0.906 1.00 0.00 H new ATOM 0 HG23 THR A 60 1.046 2.878 0.497 1.00 0.00 H new ATOM 900 N ASN A 61 1.928 4.514 -3.665 1.00 0.00 N ATOM 901 CA ASN A 61 1.361 4.230 -4.972 1.00 0.00 C ATOM 902 C ASN A 61 1.983 2.946 -5.525 1.00 0.00 C ATOM 903 O ASN A 61 1.269 2.021 -5.908 1.00 0.00 O ATOM 904 CB ASN A 61 1.657 5.362 -5.958 1.00 0.00 C ATOM 905 CG ASN A 61 0.407 5.732 -6.759 1.00 0.00 C ATOM 906 OD1 ASN A 61 -0.357 6.611 -6.395 1.00 0.00 O ATOM 907 ND2 ASN A 61 0.242 5.015 -7.867 1.00 0.00 N ATOM 0 H ASN A 61 2.179 5.491 -3.512 1.00 0.00 H new ATOM 0 HA ASN A 61 0.282 4.125 -4.856 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.018 6.236 -5.416 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.452 5.058 -6.638 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.562 5.186 -8.470 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.920 4.294 -8.113 1.00 0.00 H new ATOM 914 N GLN A 62 3.308 2.931 -5.549 1.00 0.00 N ATOM 915 CA GLN A 62 4.034 1.776 -6.048 1.00 0.00 C ATOM 916 C GLN A 62 3.821 0.575 -5.124 1.00 0.00 C ATOM 917 O GLN A 62 3.347 -0.473 -5.561 1.00 0.00 O ATOM 918 CB GLN A 62 5.523 2.090 -6.205 1.00 0.00 C ATOM 919 CG GLN A 62 5.729 3.433 -6.907 1.00 0.00 C ATOM 920 CD GLN A 62 6.641 3.281 -8.126 1.00 0.00 C ATOM 921 OE1 GLN A 62 6.858 2.195 -8.639 1.00 0.00 O ATOM 922 NE2 GLN A 62 7.161 4.426 -8.560 1.00 0.00 N ATOM 0 H GLN A 62 3.897 3.700 -5.231 1.00 0.00 H new ATOM 0 HA GLN A 62 3.644 1.524 -7.034 1.00 0.00 H new ATOM 0 HB2 GLN A 62 5.999 2.111 -5.225 1.00 0.00 H new ATOM 0 HB3 GLN A 62 6.007 1.298 -6.777 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.765 3.836 -7.218 1.00 0.00 H new ATOM 0 HG3 GLN A 62 6.164 4.149 -6.210 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.938 5.300 -8.084 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.783 4.430 -9.369 1.00 0.00 H new ATOM 931 N LEU A 63 4.182 0.767 -3.864 1.00 0.00 N ATOM 932 CA LEU A 63 4.036 -0.287 -2.875 1.00 0.00 C ATOM 933 C LEU A 63 2.718 -1.026 -3.114 1.00 0.00 C ATOM 934 O LEU A 63 2.648 -2.245 -2.959 1.00 0.00 O ATOM 935 CB LEU A 63 4.175 0.281 -1.461 1.00 0.00 C ATOM 936 CG LEU A 63 5.579 0.238 -0.856 1.00 0.00 C ATOM 937 CD1 LEU A 63 5.683 1.168 0.355 1.00 0.00 C ATOM 938 CD2 LEU A 63 5.985 -1.197 -0.513 1.00 0.00 C ATOM 0 H LEU A 63 4.575 1.637 -3.505 1.00 0.00 H new ATOM 0 HA LEU A 63 4.836 -1.020 -2.979 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.837 1.317 -1.472 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.500 -0.267 -0.803 1.00 0.00 H new ATOM 0 HG LEU A 63 6.284 0.602 -1.603 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.691 1.119 0.766 1.00 0.00 H new ATOM 0 HD12 LEU A 63 5.466 2.191 0.048 1.00 0.00 H new ATOM 0 HD13 LEU A 63 4.966 0.858 1.115 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.987 -1.199 -0.085 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.281 -1.612 0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 63 5.976 -1.804 -1.418 1.00 0.00 H new ATOM 950 N ALA A 64 1.705 -0.258 -3.488 1.00 0.00 N ATOM 951 CA ALA A 64 0.393 -0.825 -3.749 1.00 0.00 C ATOM 952 C ALA A 64 0.469 -1.727 -4.983 1.00 0.00 C ATOM 953 O ALA A 64 0.293 -2.940 -4.880 1.00 0.00 O ATOM 954 CB ALA A 64 -0.627 0.304 -3.915 1.00 0.00 C ATOM 0 H ALA A 64 1.766 0.752 -3.616 1.00 0.00 H new ATOM 0 HA ALA A 64 0.066 -1.440 -2.910 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -1.611 -0.121 -4.111 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.663 0.899 -3.002 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -0.333 0.940 -4.750 1.00 0.00 H new ATOM 960 N LYS A 65 0.730 -1.100 -6.120 1.00 0.00 N ATOM 961 CA LYS A 65 0.831 -1.831 -7.372 1.00 0.00 C ATOM 962 C LYS A 65 1.735 -3.050 -7.174 1.00 0.00 C ATOM 963 O LYS A 65 1.413 -4.147 -7.629 1.00 0.00 O ATOM 964 CB LYS A 65 1.289 -0.904 -8.499 1.00 0.00 C ATOM 965 CG LYS A 65 2.811 -0.936 -8.652 1.00 0.00 C ATOM 966 CD LYS A 65 3.259 -0.098 -9.851 1.00 0.00 C ATOM 967 CE LYS A 65 3.525 1.351 -9.439 1.00 0.00 C ATOM 968 NZ LYS A 65 3.635 2.217 -10.634 1.00 0.00 N ATOM 0 H LYS A 65 0.875 -0.094 -6.201 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.147 -2.204 -7.675 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.820 -1.205 -9.436 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.962 0.115 -8.292 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.279 -0.557 -7.744 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.146 -1.966 -8.778 1.00 0.00 H new ATOM 0 HD2 LYS A 65 4.162 -0.529 -10.283 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.492 -0.125 -10.625 1.00 0.00 H new ATOM 0 HE2 LYS A 65 2.719 1.707 -8.798 1.00 0.00 H new ATOM 0 HE3 LYS A 65 4.444 1.407 -8.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.816 3.197 -10.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.419 1.886 -11.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 2.747 2.177 -11.175 1.00 0.00 H new ATOM 982 N GLU A 66 2.848 -2.818 -6.493 1.00 0.00 N ATOM 983 CA GLU A 66 3.800 -3.883 -6.230 1.00 0.00 C ATOM 984 C GLU A 66 3.096 -5.074 -5.576 1.00 0.00 C ATOM 985 O GLU A 66 3.336 -6.222 -5.949 1.00 0.00 O ATOM 986 CB GLU A 66 4.954 -3.383 -5.359 1.00 0.00 C ATOM 987 CG GLU A 66 6.213 -3.150 -6.197 1.00 0.00 C ATOM 988 CD GLU A 66 7.462 -3.635 -5.458 1.00 0.00 C ATOM 989 OE1 GLU A 66 7.661 -3.170 -4.315 1.00 0.00 O ATOM 990 OE2 GLU A 66 8.188 -4.460 -6.053 1.00 0.00 O ATOM 0 H GLU A 66 3.111 -1.908 -6.116 1.00 0.00 H new ATOM 0 HA GLU A 66 4.221 -4.211 -7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.665 -2.456 -4.864 1.00 0.00 H new ATOM 0 HB3 GLU A 66 5.164 -4.111 -4.575 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.123 -3.674 -7.149 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.311 -2.089 -6.426 1.00 0.00 H new ATOM 997 N THR A 67 2.242 -4.761 -4.613 1.00 0.00 N ATOM 998 CA THR A 67 1.501 -5.791 -3.905 1.00 0.00 C ATOM 999 C THR A 67 0.630 -6.587 -4.879 1.00 0.00 C ATOM 1000 O THR A 67 0.581 -7.814 -4.812 1.00 0.00 O ATOM 1001 CB THR A 67 0.703 -5.116 -2.788 1.00 0.00 C ATOM 1002 OG1 THR A 67 1.650 -4.261 -2.152 1.00 0.00 O ATOM 1003 CG2 THR A 67 0.289 -6.097 -1.689 1.00 0.00 C ATOM 0 H THR A 67 2.046 -3.808 -4.306 1.00 0.00 H new ATOM 0 HA THR A 67 2.173 -6.519 -3.450 1.00 0.00 H new ATOM 0 HB THR A 67 -0.186 -4.647 -3.210 1.00 0.00 H new ATOM 0 HG1 THR A 67 1.563 -3.353 -2.510 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.274 -5.567 -0.921 1.00 0.00 H new ATOM 0 HG22 THR A 67 -0.333 -6.883 -2.118 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.179 -6.541 -1.244 1.00 0.00 H new ATOM 1011 N ASN A 68 -0.035 -5.856 -5.761 1.00 0.00 N ATOM 1012 CA ASN A 68 -0.902 -6.478 -6.747 1.00 0.00 C ATOM 1013 C ASN A 68 -0.111 -7.535 -7.520 1.00 0.00 C ATOM 1014 O ASN A 68 -0.623 -8.618 -7.799 1.00 0.00 O ATOM 1015 CB ASN A 68 -1.422 -5.448 -7.752 1.00 0.00 C ATOM 1016 CG ASN A 68 -2.696 -5.945 -8.437 1.00 0.00 C ATOM 1017 OD1 ASN A 68 -2.986 -7.129 -8.483 1.00 0.00 O ATOM 1018 ND2 ASN A 68 -3.439 -4.977 -8.964 1.00 0.00 N ATOM 0 H ASN A 68 0.009 -4.838 -5.813 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.745 -6.925 -6.220 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -1.623 -4.506 -7.242 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -0.656 -5.247 -8.502 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.310 -5.206 -9.442 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.138 -4.005 -8.890 1.00 0.00 H new ATOM 1025 N GLU A 69 1.125 -7.184 -7.844 1.00 0.00 N ATOM 1026 CA GLU A 69 1.992 -8.089 -8.579 1.00 0.00 C ATOM 1027 C GLU A 69 2.305 -9.327 -7.736 1.00 0.00 C ATOM 1028 O GLU A 69 2.322 -10.444 -8.250 1.00 0.00 O ATOM 1029 CB GLU A 69 3.278 -7.384 -9.015 1.00 0.00 C ATOM 1030 CG GLU A 69 3.176 -6.905 -10.465 1.00 0.00 C ATOM 1031 CD GLU A 69 4.255 -7.554 -11.333 1.00 0.00 C ATOM 1032 OE1 GLU A 69 4.124 -8.771 -11.586 1.00 0.00 O ATOM 1033 OE2 GLU A 69 5.187 -6.819 -11.724 1.00 0.00 O ATOM 0 H GLU A 69 1.547 -6.285 -7.611 1.00 0.00 H new ATOM 0 HA GLU A 69 1.469 -8.409 -9.480 1.00 0.00 H new ATOM 0 HB2 GLU A 69 3.471 -6.534 -8.360 1.00 0.00 H new ATOM 0 HB3 GLU A 69 4.123 -8.065 -8.912 1.00 0.00 H new ATOM 0 HG2 GLU A 69 2.190 -7.146 -10.863 1.00 0.00 H new ATOM 0 HG3 GLU A 69 3.278 -5.820 -10.502 1.00 0.00 H new ATOM 1040 N LEU A 70 2.543 -9.086 -6.455 1.00 0.00 N ATOM 1041 CA LEU A 70 2.854 -10.167 -5.535 1.00 0.00 C ATOM 1042 C LEU A 70 1.593 -10.997 -5.285 1.00 0.00 C ATOM 1043 O LEU A 70 1.644 -12.226 -5.287 1.00 0.00 O ATOM 1044 CB LEU A 70 3.492 -9.618 -4.258 1.00 0.00 C ATOM 1045 CG LEU A 70 4.866 -8.965 -4.422 1.00 0.00 C ATOM 1046 CD1 LEU A 70 5.295 -8.259 -3.134 1.00 0.00 C ATOM 1047 CD2 LEU A 70 5.906 -9.986 -4.888 1.00 0.00 C ATOM 0 H LEU A 70 2.527 -8.158 -6.032 1.00 0.00 H new ATOM 0 HA LEU A 70 3.596 -10.836 -5.971 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.813 -8.885 -3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.583 -10.434 -3.541 1.00 0.00 H new ATOM 0 HG LEU A 70 4.791 -8.203 -5.198 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.275 -7.803 -3.278 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.569 -7.486 -2.884 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.348 -8.984 -2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 70 6.874 -9.496 -4.997 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.985 -10.786 -4.152 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.601 -10.404 -5.847 1.00 0.00 H new ATOM 1059 N LEU A 71 0.491 -10.291 -5.076 1.00 0.00 N ATOM 1060 CA LEU A 71 -0.781 -10.947 -4.825 1.00 0.00 C ATOM 1061 C LEU A 71 -1.147 -11.819 -6.028 1.00 0.00 C ATOM 1062 O LEU A 71 -1.955 -12.739 -5.910 1.00 0.00 O ATOM 1063 CB LEU A 71 -1.853 -9.917 -4.463 1.00 0.00 C ATOM 1064 CG LEU A 71 -1.658 -9.185 -3.134 1.00 0.00 C ATOM 1065 CD1 LEU A 71 -2.626 -8.007 -3.010 1.00 0.00 C ATOM 1066 CD2 LEU A 71 -1.777 -10.151 -1.954 1.00 0.00 C ATOM 0 H LEU A 71 0.453 -9.272 -5.075 1.00 0.00 H new ATOM 0 HA LEU A 71 -0.704 -11.609 -3.963 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -1.900 -9.175 -5.260 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -2.819 -10.421 -4.439 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.648 -8.775 -3.114 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.466 -7.504 -2.056 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -2.450 -7.305 -3.825 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -3.652 -8.372 -3.060 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.634 -9.605 -1.021 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -2.765 -10.610 -1.958 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.016 -10.927 -2.041 1.00 0.00 H new ATOM 1078 N LYS A 72 -0.534 -11.499 -7.158 1.00 0.00 N ATOM 1079 CA LYS A 72 -0.785 -12.241 -8.382 1.00 0.00 C ATOM 1080 C LYS A 72 0.198 -13.409 -8.475 1.00 0.00 C ATOM 1081 O LYS A 72 -0.158 -14.489 -8.946 1.00 0.00 O ATOM 1082 CB LYS A 72 -0.747 -11.307 -9.593 1.00 0.00 C ATOM 1083 CG LYS A 72 0.501 -11.559 -10.441 1.00 0.00 C ATOM 1084 CD LYS A 72 0.746 -10.403 -11.414 1.00 0.00 C ATOM 1085 CE LYS A 72 0.999 -10.924 -12.830 1.00 0.00 C ATOM 1086 NZ LYS A 72 -0.068 -10.467 -13.749 1.00 0.00 N ATOM 0 H LYS A 72 0.136 -10.736 -7.252 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.788 -12.668 -8.370 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.640 -11.457 -10.200 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.760 -10.270 -9.257 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.368 -11.682 -9.791 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.385 -12.489 -10.997 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.116 -9.736 -11.417 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.602 -9.817 -11.080 1.00 0.00 H new ATOM 0 HE2 LYS A 72 1.968 -10.573 -13.185 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.038 -12.013 -12.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.119 -10.829 -14.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.987 -10.823 -13.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.086 -9.427 -13.770 1.00 0.00 H new ATOM 1100 N GLU A 73 1.416 -13.154 -8.020 1.00 0.00 N ATOM 1101 CA GLU A 73 2.453 -14.171 -8.047 1.00 0.00 C ATOM 1102 C GLU A 73 2.237 -15.180 -6.917 1.00 0.00 C ATOM 1103 O GLU A 73 2.629 -16.340 -7.032 1.00 0.00 O ATOM 1104 CB GLU A 73 3.844 -13.539 -7.958 1.00 0.00 C ATOM 1105 CG GLU A 73 4.317 -13.457 -6.505 1.00 0.00 C ATOM 1106 CD GLU A 73 5.754 -12.938 -6.426 1.00 0.00 C ATOM 1107 OE1 GLU A 73 6.324 -12.675 -7.507 1.00 0.00 O ATOM 1108 OE2 GLU A 73 6.251 -12.816 -5.285 1.00 0.00 O ATOM 0 H GLU A 73 1.708 -12.258 -7.631 1.00 0.00 H new ATOM 0 HA GLU A 73 2.390 -14.700 -8.998 1.00 0.00 H new ATOM 0 HB2 GLU A 73 4.552 -14.126 -8.542 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.822 -12.540 -8.394 1.00 0.00 H new ATOM 0 HG2 GLU A 73 3.657 -12.799 -5.940 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.256 -14.442 -6.043 1.00 0.00 H new ATOM 1115 N LEU A 74 1.613 -14.701 -5.851 1.00 0.00 N ATOM 1116 CA LEU A 74 1.339 -15.546 -4.701 1.00 0.00 C ATOM 1117 C LEU A 74 0.478 -16.732 -5.139 1.00 0.00 C ATOM 1118 O LEU A 74 0.943 -17.871 -5.150 1.00 0.00 O ATOM 1119 CB LEU A 74 0.723 -14.725 -3.566 1.00 0.00 C ATOM 1120 CG LEU A 74 1.415 -14.835 -2.206 1.00 0.00 C ATOM 1121 CD1 LEU A 74 0.991 -13.693 -1.281 1.00 0.00 C ATOM 1122 CD2 LEU A 74 1.166 -16.207 -1.575 1.00 0.00 C ATOM 0 H LEU A 74 1.289 -13.738 -5.759 1.00 0.00 H new ATOM 0 HA LEU A 74 2.266 -15.955 -4.300 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.717 -13.677 -3.865 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.317 -15.029 -3.448 1.00 0.00 H new ATOM 0 HG LEU A 74 2.490 -14.741 -2.360 1.00 0.00 H new ATOM 0 HD11 LEU A 74 1.497 -13.795 -0.321 1.00 0.00 H new ATOM 0 HD12 LEU A 74 1.261 -12.739 -1.734 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.088 -13.730 -1.128 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.668 -16.260 -0.609 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.095 -16.354 -1.436 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.557 -16.985 -2.230 1.00 0.00 H new ATOM 1134 N GLY A 75 -0.762 -16.425 -5.489 1.00 0.00 N ATOM 1135 CA GLY A 75 -1.693 -17.451 -5.927 1.00 0.00 C ATOM 1136 C GLY A 75 -1.115 -18.253 -7.095 1.00 0.00 C ATOM 1137 O GLY A 75 -1.480 -19.410 -7.300 1.00 0.00 O ATOM 0 H GLY A 75 -1.144 -15.479 -5.478 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.918 -18.121 -5.097 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -2.633 -16.989 -6.228 1.00 0.00 H new ATOM 1141 N SER A 76 -0.222 -17.607 -7.830 1.00 0.00 N ATOM 1142 CA SER A 76 0.410 -18.245 -8.972 1.00 0.00 C ATOM 1143 C SER A 76 1.179 -19.487 -8.518 1.00 0.00 C ATOM 1144 O SER A 76 1.165 -20.513 -9.197 1.00 0.00 O ATOM 1145 CB SER A 76 1.347 -17.276 -9.697 1.00 0.00 C ATOM 1146 OG SER A 76 1.339 -17.480 -11.107 1.00 0.00 O ATOM 0 H SER A 76 0.079 -16.648 -7.657 1.00 0.00 H new ATOM 0 HA SER A 76 -0.371 -18.544 -9.671 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.049 -16.251 -9.477 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.361 -17.401 -9.318 1.00 0.00 H new ATOM 0 HG SER A 76 1.948 -16.841 -11.533 1.00 0.00 H new ATOM 1152 N LEU A 77 1.833 -19.354 -7.373 1.00 0.00 N ATOM 1153 CA LEU A 77 2.606 -20.452 -6.820 1.00 0.00 C ATOM 1154 C LEU A 77 1.766 -21.730 -6.855 1.00 0.00 C ATOM 1155 O LEU A 77 0.538 -21.669 -6.901 1.00 0.00 O ATOM 1156 CB LEU A 77 3.124 -20.095 -5.426 1.00 0.00 C ATOM 1157 CG LEU A 77 3.974 -18.826 -5.331 1.00 0.00 C ATOM 1158 CD1 LEU A 77 4.213 -18.434 -3.871 1.00 0.00 C ATOM 1159 CD2 LEU A 77 5.285 -18.986 -6.103 1.00 0.00 C ATOM 0 H LEU A 77 1.843 -18.501 -6.813 1.00 0.00 H new ATOM 0 HA LEU A 77 3.493 -20.636 -7.426 1.00 0.00 H new ATOM 0 HB2 LEU A 77 2.269 -19.986 -4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.714 -20.932 -5.054 1.00 0.00 H new ATOM 0 HG LEU A 77 3.423 -18.010 -5.797 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.820 -17.529 -3.832 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.256 -18.251 -3.382 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.734 -19.242 -3.358 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.870 -18.070 -6.020 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.853 -19.819 -5.688 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.067 -19.183 -7.153 1.00 0.00 H new ATOM 1171 N PRO A 78 2.479 -22.888 -6.832 1.00 0.00 N ATOM 1172 CA PRO A 78 1.813 -24.179 -6.860 1.00 0.00 C ATOM 1173 C PRO A 78 1.181 -24.500 -5.504 1.00 0.00 C ATOM 1174 O PRO A 78 1.290 -23.715 -4.563 1.00 0.00 O ATOM 1175 CB PRO A 78 2.892 -25.170 -7.263 1.00 0.00 C ATOM 1176 CG PRO A 78 4.217 -24.476 -6.993 1.00 0.00 C ATOM 1177 CD PRO A 78 3.934 -22.999 -6.778 1.00 0.00 C ATOM 0 HA PRO A 78 0.982 -24.208 -7.564 1.00 0.00 H new ATOM 0 HB2 PRO A 78 2.810 -26.092 -6.688 1.00 0.00 H new ATOM 0 HB3 PRO A 78 2.800 -25.441 -8.315 1.00 0.00 H new ATOM 0 HG2 PRO A 78 4.700 -24.904 -6.115 1.00 0.00 H new ATOM 0 HG3 PRO A 78 4.899 -24.616 -7.832 1.00 0.00 H new ATOM 0 HD2 PRO A 78 4.322 -22.657 -5.818 1.00 0.00 H new ATOM 0 HD3 PRO A 78 4.406 -22.389 -7.548 1.00 0.00 H new ATOM 1185 N LEU A 79 0.535 -25.655 -5.447 1.00 0.00 N ATOM 1186 CA LEU A 79 -0.114 -26.090 -4.222 1.00 0.00 C ATOM 1187 C LEU A 79 0.596 -27.335 -3.688 1.00 0.00 C ATOM 1188 O LEU A 79 1.116 -28.138 -4.462 1.00 0.00 O ATOM 1189 CB LEU A 79 -1.614 -26.287 -4.450 1.00 0.00 C ATOM 1190 CG LEU A 79 -2.351 -25.122 -5.113 1.00 0.00 C ATOM 1191 CD1 LEU A 79 -3.003 -25.560 -6.425 1.00 0.00 C ATOM 1192 CD2 LEU A 79 -3.362 -24.495 -4.151 1.00 0.00 C ATOM 0 H LEU A 79 0.447 -26.303 -6.230 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.031 -25.321 -3.454 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.754 -27.176 -5.065 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.084 -26.488 -3.487 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.620 -24.352 -5.359 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.520 -24.713 -6.875 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.236 -25.922 -7.109 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.719 -26.358 -6.227 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.872 -23.669 -4.647 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.093 -25.246 -3.851 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.842 -24.123 -3.268 1.00 0.00 H new ATOM 1204 N PRO A 80 0.596 -27.461 -2.333 1.00 0.00 N ATOM 1205 CA PRO A 80 1.234 -28.595 -1.687 1.00 0.00 C ATOM 1206 C PRO A 80 0.387 -29.861 -1.840 1.00 0.00 C ATOM 1207 O PRO A 80 -0.778 -29.789 -2.227 1.00 0.00 O ATOM 1208 CB PRO A 80 1.414 -28.173 -0.238 1.00 0.00 C ATOM 1209 CG PRO A 80 0.457 -27.011 -0.021 1.00 0.00 C ATOM 1210 CD PRO A 80 -0.010 -26.531 -1.385 1.00 0.00 C ATOM 0 HA PRO A 80 2.194 -28.849 -2.136 1.00 0.00 H new ATOM 0 HB2 PRO A 80 1.189 -28.996 0.440 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.444 -27.873 -0.044 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -0.393 -27.325 0.585 1.00 0.00 H new ATOM 0 HG3 PRO A 80 0.953 -26.204 0.519 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -1.097 -26.544 -1.458 1.00 0.00 H new ATOM 0 HD3 PRO A 80 0.310 -25.507 -1.575 1.00 0.00 H new ATOM 1218 N LEU A 81 1.006 -30.990 -1.527 1.00 0.00 N ATOM 1219 CA LEU A 81 0.324 -32.269 -1.625 1.00 0.00 C ATOM 1220 C LEU A 81 -0.764 -32.345 -0.552 1.00 0.00 C ATOM 1221 O LEU A 81 -1.809 -32.959 -0.765 1.00 0.00 O ATOM 1222 CB LEU A 81 1.331 -33.419 -1.562 1.00 0.00 C ATOM 1223 CG LEU A 81 2.097 -33.712 -2.854 1.00 0.00 C ATOM 1224 CD1 LEU A 81 1.543 -34.958 -3.549 1.00 0.00 C ATOM 1225 CD2 LEU A 81 2.098 -32.493 -3.779 1.00 0.00 C ATOM 0 H LEU A 81 1.972 -31.045 -1.205 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.173 -32.363 -2.591 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.054 -33.200 -0.776 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.801 -34.324 -1.264 1.00 0.00 H new ATOM 0 HG LEU A 81 3.135 -33.922 -2.596 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.105 -35.144 -4.464 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.637 -35.817 -2.885 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.492 -34.801 -3.794 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.649 -32.728 -4.690 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.072 -32.229 -4.034 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.574 -31.653 -3.273 1.00 0.00 H new ATOM 1237 N SER A 82 -0.482 -31.713 0.578 1.00 0.00 N ATOM 1238 CA SER A 82 -1.423 -31.701 1.684 1.00 0.00 C ATOM 1239 C SER A 82 -2.513 -30.658 1.433 1.00 0.00 C ATOM 1240 O SER A 82 -2.217 -29.520 1.072 1.00 0.00 O ATOM 1241 CB SER A 82 -0.713 -31.418 3.009 1.00 0.00 C ATOM 1242 OG SER A 82 -0.667 -32.570 3.847 1.00 0.00 O ATOM 0 H SER A 82 0.386 -31.205 0.751 1.00 0.00 H new ATOM 0 HA SER A 82 -1.882 -32.687 1.752 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.302 -31.074 2.810 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.227 -30.611 3.531 1.00 0.00 H new ATOM 0 HG SER A 82 -0.204 -32.349 4.682 1.00 0.00 H new ATOM 1248 N THR A 83 -3.752 -31.083 1.633 1.00 0.00 N ATOM 1249 CA THR A 83 -4.888 -30.199 1.432 1.00 0.00 C ATOM 1250 C THR A 83 -4.992 -29.195 2.582 1.00 0.00 C ATOM 1251 O THR A 83 -5.567 -28.119 2.422 1.00 0.00 O ATOM 1252 CB THR A 83 -6.138 -31.065 1.268 1.00 0.00 C ATOM 1253 OG1 THR A 83 -5.902 -31.790 0.064 1.00 0.00 O ATOM 1254 CG2 THR A 83 -7.389 -30.238 0.965 1.00 0.00 C ATOM 0 H THR A 83 -3.994 -32.028 1.932 1.00 0.00 H new ATOM 0 HA THR A 83 -4.768 -29.601 0.529 1.00 0.00 H new ATOM 0 HB THR A 83 -6.298 -31.646 2.176 1.00 0.00 H new ATOM 0 HG1 THR A 83 -6.664 -32.379 -0.118 1.00 0.00 H new ATOM 0 HG21 THR A 83 -8.247 -30.902 0.858 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.570 -29.540 1.782 1.00 0.00 H new ATOM 0 HG23 THR A 83 -7.242 -29.683 0.039 1.00 0.00 H new ATOM 1262 N SER A 84 -4.426 -29.582 3.716 1.00 0.00 N ATOM 1263 CA SER A 84 -4.448 -28.729 4.892 1.00 0.00 C ATOM 1264 C SER A 84 -3.620 -27.467 4.639 1.00 0.00 C ATOM 1265 O SER A 84 -3.957 -26.390 5.129 1.00 0.00 O ATOM 1266 CB SER A 84 -3.922 -29.472 6.121 1.00 0.00 C ATOM 1267 OG SER A 84 -2.655 -30.077 5.877 1.00 0.00 O ATOM 0 H SER A 84 -3.950 -30.475 3.845 1.00 0.00 H new ATOM 0 HA SER A 84 -5.482 -28.444 5.089 1.00 0.00 H new ATOM 0 HB2 SER A 84 -3.837 -28.777 6.956 1.00 0.00 H new ATOM 0 HB3 SER A 84 -4.639 -30.238 6.416 1.00 0.00 H new ATOM 0 HG SER A 84 -2.352 -30.540 6.686 1.00 0.00 H new ATOM 1273 N GLU A 85 -2.552 -27.643 3.875 1.00 0.00 N ATOM 1274 CA GLU A 85 -1.672 -26.532 3.552 1.00 0.00 C ATOM 1275 C GLU A 85 -2.233 -25.738 2.370 1.00 0.00 C ATOM 1276 O GLU A 85 -1.823 -24.604 2.129 1.00 0.00 O ATOM 1277 CB GLU A 85 -0.254 -27.023 3.258 1.00 0.00 C ATOM 1278 CG GLU A 85 0.428 -27.525 4.532 1.00 0.00 C ATOM 1279 CD GLU A 85 0.327 -26.488 5.653 1.00 0.00 C ATOM 1280 OE1 GLU A 85 1.135 -25.534 5.618 1.00 0.00 O ATOM 1281 OE2 GLU A 85 -0.555 -26.672 6.519 1.00 0.00 O ATOM 0 H GLU A 85 -2.276 -28.538 3.470 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.620 -25.871 4.417 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.289 -27.824 2.520 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.332 -26.214 2.822 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -0.034 -28.459 4.853 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.476 -27.743 4.326 1.00 0.00 H new ATOM 1288 N GLN A 86 -3.164 -26.365 1.665 1.00 0.00 N ATOM 1289 CA GLN A 86 -3.785 -25.731 0.515 1.00 0.00 C ATOM 1290 C GLN A 86 -4.697 -24.589 0.967 1.00 0.00 C ATOM 1291 O GLN A 86 -4.584 -23.467 0.474 1.00 0.00 O ATOM 1292 CB GLN A 86 -4.559 -26.752 -0.322 1.00 0.00 C ATOM 1293 CG GLN A 86 -3.604 -27.649 -1.112 1.00 0.00 C ATOM 1294 CD GLN A 86 -4.362 -28.789 -1.795 1.00 0.00 C ATOM 1295 OE1 GLN A 86 -5.390 -28.596 -2.424 1.00 0.00 O ATOM 1296 NE2 GLN A 86 -3.800 -29.984 -1.639 1.00 0.00 N ATOM 0 H GLN A 86 -3.503 -27.305 1.868 1.00 0.00 H new ATOM 0 HA GLN A 86 -2.999 -25.315 -0.115 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -5.183 -27.364 0.330 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -5.228 -26.233 -1.008 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -3.079 -27.056 -1.861 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -2.848 -28.060 -0.443 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -2.939 -30.076 -1.100 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -4.230 -30.808 -2.058 1.00 0.00 H new ATOM 1305 N ARG A 87 -5.580 -24.913 1.900 1.00 0.00 N ATOM 1306 CA ARG A 87 -6.511 -23.928 2.424 1.00 0.00 C ATOM 1307 C ARG A 87 -5.750 -22.786 3.100 1.00 0.00 C ATOM 1308 O ARG A 87 -5.995 -21.615 2.812 1.00 0.00 O ATOM 1309 CB ARG A 87 -7.472 -24.560 3.433 1.00 0.00 C ATOM 1310 CG ARG A 87 -6.707 -25.177 4.605 1.00 0.00 C ATOM 1311 CD ARG A 87 -7.607 -26.114 5.414 1.00 0.00 C ATOM 1312 NE ARG A 87 -7.786 -25.584 6.784 1.00 0.00 N ATOM 1313 CZ ARG A 87 -8.778 -25.952 7.608 1.00 0.00 C ATOM 1314 NH1 ARG A 87 -9.685 -26.852 7.205 1.00 0.00 N ATOM 1315 NH2 ARG A 87 -8.862 -25.419 8.834 1.00 0.00 N ATOM 0 H ARG A 87 -5.670 -25.844 2.307 1.00 0.00 H new ATOM 0 HA ARG A 87 -7.088 -23.538 1.586 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.165 -23.804 3.804 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.070 -25.327 2.940 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -5.844 -25.728 4.231 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -6.325 -24.387 5.251 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -8.576 -26.214 4.924 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -7.166 -27.110 5.455 1.00 0.00 H new ATOM 0 HE ARG A 87 -7.113 -24.896 7.123 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -9.621 -27.257 6.271 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -10.439 -27.132 7.832 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -8.172 -24.734 9.140 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -9.616 -25.699 9.461 1.00 0.00 H new ATOM 1329 N GLN A 88 -4.843 -23.166 3.987 1.00 0.00 N ATOM 1330 CA GLN A 88 -4.045 -22.188 4.707 1.00 0.00 C ATOM 1331 C GLN A 88 -3.410 -21.197 3.729 1.00 0.00 C ATOM 1332 O GLN A 88 -3.333 -20.003 4.014 1.00 0.00 O ATOM 1333 CB GLN A 88 -2.977 -22.874 5.562 1.00 0.00 C ATOM 1334 CG GLN A 88 -3.611 -23.618 6.738 1.00 0.00 C ATOM 1335 CD GLN A 88 -2.702 -23.577 7.968 1.00 0.00 C ATOM 1336 OE1 GLN A 88 -1.657 -24.204 8.021 1.00 0.00 O ATOM 1337 NE2 GLN A 88 -3.156 -22.805 8.951 1.00 0.00 N ATOM 0 H GLN A 88 -4.643 -24.138 4.224 1.00 0.00 H new ATOM 0 HA GLN A 88 -4.702 -21.636 5.379 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -2.409 -23.573 4.949 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -2.272 -22.131 5.935 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -4.575 -23.170 6.979 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -3.802 -24.654 6.457 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -4.039 -22.307 8.842 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -2.621 -22.711 9.814 1.00 0.00 H new ATOM 1346 N GLN A 89 -2.973 -21.729 2.597 1.00 0.00 N ATOM 1347 CA GLN A 89 -2.349 -20.906 1.576 1.00 0.00 C ATOM 1348 C GLN A 89 -3.329 -19.841 1.079 1.00 0.00 C ATOM 1349 O GLN A 89 -3.107 -18.648 1.276 1.00 0.00 O ATOM 1350 CB GLN A 89 -1.837 -21.764 0.417 1.00 0.00 C ATOM 1351 CG GLN A 89 -0.321 -21.951 0.501 1.00 0.00 C ATOM 1352 CD GLN A 89 0.272 -22.246 -0.878 1.00 0.00 C ATOM 1353 OE1 GLN A 89 -0.351 -22.042 -1.907 1.00 0.00 O ATOM 1354 NE2 GLN A 89 1.507 -22.738 -0.842 1.00 0.00 N ATOM 0 H GLN A 89 -3.039 -22.720 2.365 1.00 0.00 H new ATOM 0 HA GLN A 89 -1.490 -20.402 2.019 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -2.328 -22.737 0.435 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -2.097 -21.293 -0.531 1.00 0.00 H new ATOM 0 HG2 GLN A 89 0.138 -21.052 0.913 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -0.089 -22.769 1.183 1.00 0.00 H new ATOM 0 HE21 GLN A 89 1.972 -22.885 0.054 1.00 0.00 H new ATOM 0 HE22 GLN A 89 1.990 -22.969 -1.710 1.00 0.00 H new ATOM 1363 N ARG A 90 -4.392 -20.312 0.444 1.00 0.00 N ATOM 1364 CA ARG A 90 -5.407 -19.416 -0.082 1.00 0.00 C ATOM 1365 C ARG A 90 -5.970 -18.536 1.036 1.00 0.00 C ATOM 1366 O ARG A 90 -6.328 -17.382 0.803 1.00 0.00 O ATOM 1367 CB ARG A 90 -6.551 -20.199 -0.731 1.00 0.00 C ATOM 1368 CG ARG A 90 -7.168 -21.189 0.259 1.00 0.00 C ATOM 1369 CD ARG A 90 -8.251 -22.034 -0.415 1.00 0.00 C ATOM 1370 NE ARG A 90 -9.493 -21.243 -0.560 1.00 0.00 N ATOM 1371 CZ ARG A 90 -10.693 -21.773 -0.835 1.00 0.00 C ATOM 1372 NH1 ARG A 90 -10.820 -23.097 -0.996 1.00 0.00 N ATOM 1373 NH2 ARG A 90 -11.766 -20.978 -0.949 1.00 0.00 N ATOM 0 H ARG A 90 -4.572 -21.303 0.282 1.00 0.00 H new ATOM 0 HA ARG A 90 -4.935 -18.790 -0.839 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -7.316 -19.507 -1.084 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -6.180 -20.736 -1.604 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.391 -21.840 0.660 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.597 -20.647 1.102 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -7.907 -22.368 -1.394 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.447 -22.928 0.177 1.00 0.00 H new ATOM 0 HE ARG A 90 -9.432 -20.232 -0.443 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -10.003 -23.702 -0.909 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -11.733 -23.500 -1.205 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.669 -19.970 -0.827 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -12.679 -21.381 -1.158 1.00 0.00 H new ATOM 1387 N LEU A 91 -6.032 -19.115 2.226 1.00 0.00 N ATOM 1388 CA LEU A 91 -6.546 -18.398 3.381 1.00 0.00 C ATOM 1389 C LEU A 91 -5.655 -17.187 3.662 1.00 0.00 C ATOM 1390 O LEU A 91 -6.106 -16.046 3.573 1.00 0.00 O ATOM 1391 CB LEU A 91 -6.694 -19.343 4.575 1.00 0.00 C ATOM 1392 CG LEU A 91 -7.932 -20.242 4.570 1.00 0.00 C ATOM 1393 CD1 LEU A 91 -7.971 -21.128 5.816 1.00 0.00 C ATOM 1394 CD2 LEU A 91 -9.210 -19.415 4.414 1.00 0.00 C ATOM 0 H LEU A 91 -5.735 -20.072 2.416 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.547 -18.017 3.179 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -5.809 -19.977 4.623 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.707 -18.745 5.486 1.00 0.00 H new ATOM 0 HG LEU A 91 -7.870 -20.904 3.706 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -8.861 -21.757 5.788 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -7.082 -21.758 5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.998 -20.501 6.707 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -10.075 -20.078 4.414 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.292 -18.712 5.243 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -9.175 -18.864 3.474 1.00 0.00 H new ATOM 1406 N GLN A 92 -4.405 -17.476 3.995 1.00 0.00 N ATOM 1407 CA GLN A 92 -3.447 -16.424 4.289 1.00 0.00 C ATOM 1408 C GLN A 92 -3.552 -15.304 3.252 1.00 0.00 C ATOM 1409 O GLN A 92 -3.508 -14.125 3.600 1.00 0.00 O ATOM 1410 CB GLN A 92 -2.023 -16.982 4.351 1.00 0.00 C ATOM 1411 CG GLN A 92 -1.819 -17.826 5.611 1.00 0.00 C ATOM 1412 CD GLN A 92 -2.012 -16.983 6.873 1.00 0.00 C ATOM 1413 OE1 GLN A 92 -3.044 -17.019 7.523 1.00 0.00 O ATOM 1414 NE2 GLN A 92 -0.965 -16.225 7.182 1.00 0.00 N ATOM 0 H GLN A 92 -4.034 -18.423 4.068 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.683 -16.008 5.268 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -1.828 -17.589 3.467 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -1.306 -16.161 4.339 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.523 -18.658 5.614 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -0.818 -18.256 5.607 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -0.131 -16.243 6.594 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -0.995 -15.626 8.007 1.00 0.00 H new ATOM 1423 N LYS A 93 -3.690 -15.713 1.999 1.00 0.00 N ATOM 1424 CA LYS A 93 -3.802 -14.758 0.909 1.00 0.00 C ATOM 1425 C LYS A 93 -5.138 -14.020 1.019 1.00 0.00 C ATOM 1426 O LYS A 93 -5.175 -12.791 1.002 1.00 0.00 O ATOM 1427 CB LYS A 93 -3.593 -15.455 -0.437 1.00 0.00 C ATOM 1428 CG LYS A 93 -2.840 -14.548 -1.413 1.00 0.00 C ATOM 1429 CD LYS A 93 -3.197 -14.886 -2.861 1.00 0.00 C ATOM 1430 CE LYS A 93 -4.482 -14.175 -3.289 1.00 0.00 C ATOM 1431 NZ LYS A 93 -5.063 -14.828 -4.483 1.00 0.00 N ATOM 0 H LYS A 93 -3.727 -16.692 1.714 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.016 -14.006 0.978 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.034 -16.379 -0.289 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.558 -15.730 -0.862 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -3.084 -13.506 -1.208 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.766 -14.659 -1.264 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.379 -14.593 -3.519 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.321 -15.964 -2.967 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -5.203 -14.191 -2.472 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.270 -13.128 -3.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.935 -14.333 -4.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -4.380 -14.791 -5.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.284 -15.820 -4.263 1.00 0.00 H new ATOM 1445 N GLU A 94 -6.202 -14.802 1.128 1.00 0.00 N ATOM 1446 CA GLU A 94 -7.536 -14.238 1.241 1.00 0.00 C ATOM 1447 C GLU A 94 -7.525 -13.032 2.182 1.00 0.00 C ATOM 1448 O GLU A 94 -8.105 -11.993 1.873 1.00 0.00 O ATOM 1449 CB GLU A 94 -8.539 -15.293 1.711 1.00 0.00 C ATOM 1450 CG GLU A 94 -8.950 -16.212 0.559 1.00 0.00 C ATOM 1451 CD GLU A 94 -10.099 -15.602 -0.246 1.00 0.00 C ATOM 1452 OE1 GLU A 94 -9.885 -14.499 -0.794 1.00 0.00 O ATOM 1453 OE2 GLU A 94 -11.166 -16.252 -0.295 1.00 0.00 O ATOM 0 H GLU A 94 -6.167 -15.821 1.140 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.851 -13.900 0.254 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.100 -15.885 2.514 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.421 -14.803 2.122 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.095 -16.386 -0.095 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -9.252 -17.182 0.953 1.00 0.00 H new ATOM 1460 N ARG A 95 -6.859 -13.211 3.314 1.00 0.00 N ATOM 1461 CA ARG A 95 -6.765 -12.151 4.303 1.00 0.00 C ATOM 1462 C ARG A 95 -5.888 -11.013 3.779 1.00 0.00 C ATOM 1463 O ARG A 95 -6.256 -9.844 3.879 1.00 0.00 O ATOM 1464 CB ARG A 95 -6.181 -12.674 5.617 1.00 0.00 C ATOM 1465 CG ARG A 95 -7.254 -13.372 6.455 1.00 0.00 C ATOM 1466 CD ARG A 95 -7.883 -12.403 7.457 1.00 0.00 C ATOM 1467 NE ARG A 95 -9.144 -11.856 6.909 1.00 0.00 N ATOM 1468 CZ ARG A 95 -10.277 -12.561 6.785 1.00 0.00 C ATOM 1469 NH1 ARG A 95 -10.313 -13.844 7.168 1.00 0.00 N ATOM 1470 NH2 ARG A 95 -11.374 -11.982 6.276 1.00 0.00 N ATOM 0 H ARG A 95 -6.379 -14.075 3.568 1.00 0.00 H new ATOM 0 HA ARG A 95 -7.773 -11.780 4.489 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -5.369 -13.370 5.407 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -5.753 -11.847 6.184 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.026 -13.776 5.800 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -6.814 -14.216 6.987 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -8.079 -12.917 8.398 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -7.189 -11.591 7.675 1.00 0.00 H new ATOM 0 HE ARG A 95 -9.151 -10.882 6.607 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -9.478 -14.285 7.554 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -11.175 -14.380 7.074 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -11.346 -11.005 5.983 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -12.236 -12.518 6.181 1.00 0.00 H new ATOM 1484 N LEU A 96 -4.743 -11.395 3.232 1.00 0.00 N ATOM 1485 CA LEU A 96 -3.810 -10.421 2.692 1.00 0.00 C ATOM 1486 C LEU A 96 -4.560 -9.459 1.769 1.00 0.00 C ATOM 1487 O LEU A 96 -4.400 -8.243 1.870 1.00 0.00 O ATOM 1488 CB LEU A 96 -2.630 -11.125 2.018 1.00 0.00 C ATOM 1489 CG LEU A 96 -1.590 -11.739 2.958 1.00 0.00 C ATOM 1490 CD1 LEU A 96 -0.816 -12.859 2.261 1.00 0.00 C ATOM 1491 CD2 LEU A 96 -0.659 -10.664 3.523 1.00 0.00 C ATOM 0 H LEU A 96 -4.440 -12.366 3.151 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.379 -9.822 3.494 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -3.022 -11.914 1.376 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -2.126 -10.408 1.370 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.114 -12.187 3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.083 -13.279 2.950 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.509 -13.640 1.948 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.303 -12.458 1.387 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.070 -11.127 4.188 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.139 -10.166 2.704 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -1.244 -9.932 4.080 1.00 0.00 H new ATOM 1503 N MET A 97 -5.364 -10.039 0.889 1.00 0.00 N ATOM 1504 CA MET A 97 -6.139 -9.248 -0.051 1.00 0.00 C ATOM 1505 C MET A 97 -7.081 -8.292 0.683 1.00 0.00 C ATOM 1506 O MET A 97 -7.041 -7.083 0.460 1.00 0.00 O ATOM 1507 CB MET A 97 -6.956 -10.180 -0.950 1.00 0.00 C ATOM 1508 CG MET A 97 -6.043 -10.990 -1.872 1.00 0.00 C ATOM 1509 SD MET A 97 -5.083 -9.891 -2.900 1.00 0.00 S ATOM 1510 CE MET A 97 -5.985 -10.033 -4.434 1.00 0.00 C ATOM 0 H MET A 97 -5.495 -11.047 0.808 1.00 0.00 H new ATOM 0 HA MET A 97 -5.450 -8.657 -0.655 1.00 0.00 H new ATOM 0 HB2 MET A 97 -7.550 -10.856 -0.335 1.00 0.00 H new ATOM 0 HB3 MET A 97 -7.655 -9.595 -1.547 1.00 0.00 H new ATOM 0 HG2 MET A 97 -5.379 -11.619 -1.279 1.00 0.00 H new ATOM 0 HG3 MET A 97 -6.640 -11.656 -2.495 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.516 -9.405 -5.191 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.976 -11.071 -4.767 1.00 0.00 H new ATOM 0 HE3 MET A 97 -7.015 -9.710 -4.282 1.00 0.00 H new ATOM 1520 N ASN A 98 -7.907 -8.869 1.543 1.00 0.00 N ATOM 1521 CA ASN A 98 -8.857 -8.083 2.311 1.00 0.00 C ATOM 1522 C ASN A 98 -8.100 -7.051 3.149 1.00 0.00 C ATOM 1523 O ASN A 98 -8.594 -5.948 3.376 1.00 0.00 O ATOM 1524 CB ASN A 98 -9.660 -8.969 3.266 1.00 0.00 C ATOM 1525 CG ASN A 98 -11.131 -9.032 2.848 1.00 0.00 C ATOM 1526 OD1 ASN A 98 -12.021 -8.576 3.546 1.00 0.00 O ATOM 1527 ND2 ASN A 98 -11.335 -9.622 1.674 1.00 0.00 N ATOM 0 H ASN A 98 -7.938 -9.872 1.725 1.00 0.00 H new ATOM 0 HA ASN A 98 -9.537 -7.598 1.611 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -9.238 -9.974 3.277 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -9.583 -8.579 4.281 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -12.282 -9.714 1.307 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -10.544 -9.982 1.140 1.00 0.00 H new ATOM 1534 N ASP A 99 -6.913 -7.446 3.585 1.00 0.00 N ATOM 1535 CA ASP A 99 -6.082 -6.569 4.392 1.00 0.00 C ATOM 1536 C ASP A 99 -5.562 -5.423 3.522 1.00 0.00 C ATOM 1537 O ASP A 99 -5.795 -4.254 3.825 1.00 0.00 O ATOM 1538 CB ASP A 99 -4.875 -7.320 4.957 1.00 0.00 C ATOM 1539 CG ASP A 99 -5.140 -8.090 6.252 1.00 0.00 C ATOM 1540 OD1 ASP A 99 -5.903 -7.554 7.085 1.00 0.00 O ATOM 1541 OD2 ASP A 99 -4.574 -9.197 6.380 1.00 0.00 O ATOM 0 H ASP A 99 -6.507 -8.362 3.395 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.689 -6.192 5.215 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.516 -8.020 4.203 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -4.072 -6.605 5.135 1.00 0.00 H new ATOM 1546 N PHE A 100 -4.866 -5.799 2.459 1.00 0.00 N ATOM 1547 CA PHE A 100 -4.311 -4.817 1.543 1.00 0.00 C ATOM 1548 C PHE A 100 -5.385 -3.832 1.078 1.00 0.00 C ATOM 1549 O PHE A 100 -5.091 -2.668 0.809 1.00 0.00 O ATOM 1550 CB PHE A 100 -3.781 -5.586 0.331 1.00 0.00 C ATOM 1551 CG PHE A 100 -3.516 -4.709 -0.895 1.00 0.00 C ATOM 1552 CD1 PHE A 100 -2.525 -3.778 -0.863 1.00 0.00 C ATOM 1553 CD2 PHE A 100 -4.271 -4.861 -2.015 1.00 0.00 C ATOM 1554 CE1 PHE A 100 -2.279 -2.965 -2.001 1.00 0.00 C ATOM 1555 CE2 PHE A 100 -4.025 -4.047 -3.153 1.00 0.00 C ATOM 1556 CZ PHE A 100 -3.034 -3.116 -3.122 1.00 0.00 C ATOM 0 H PHE A 100 -4.674 -6.770 2.212 1.00 0.00 H new ATOM 0 HA PHE A 100 -3.525 -4.248 2.039 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.857 -6.091 0.610 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -4.499 -6.361 0.063 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -1.926 -3.657 0.027 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -5.058 -5.600 -2.040 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -1.492 -2.226 -1.976 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -4.625 -4.167 -4.043 1.00 0.00 H new ATOM 0 HZ PHE A 100 -2.847 -2.497 -3.987 1.00 0.00 H new ATOM 1566 N SER A 101 -6.608 -4.335 0.996 1.00 0.00 N ATOM 1567 CA SER A 101 -7.728 -3.514 0.568 1.00 0.00 C ATOM 1568 C SER A 101 -8.027 -2.446 1.622 1.00 0.00 C ATOM 1569 O SER A 101 -8.016 -1.253 1.323 1.00 0.00 O ATOM 1570 CB SER A 101 -8.970 -4.368 0.310 1.00 0.00 C ATOM 1571 OG SER A 101 -8.883 -5.642 0.943 1.00 0.00 O ATOM 0 H SER A 101 -6.848 -5.301 1.219 1.00 0.00 H new ATOM 0 HA SER A 101 -7.456 -3.025 -0.368 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.853 -3.842 0.673 1.00 0.00 H new ATOM 0 HB3 SER A 101 -9.099 -4.505 -0.764 1.00 0.00 H new ATOM 0 HG SER A 101 -8.392 -6.262 0.364 1.00 0.00 H new ATOM 1577 N ALA A 102 -8.287 -2.913 2.834 1.00 0.00 N ATOM 1578 CA ALA A 102 -8.588 -2.013 3.934 1.00 0.00 C ATOM 1579 C ALA A 102 -7.556 -0.883 3.961 1.00 0.00 C ATOM 1580 O ALA A 102 -7.911 0.282 4.130 1.00 0.00 O ATOM 1581 CB ALA A 102 -8.623 -2.801 5.245 1.00 0.00 C ATOM 0 H ALA A 102 -8.295 -3.903 3.079 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.570 -1.560 3.800 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.849 -2.125 6.070 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -9.392 -3.571 5.186 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -7.653 -3.269 5.414 1.00 0.00 H new ATOM 1587 N ALA A 103 -6.300 -1.269 3.792 1.00 0.00 N ATOM 1588 CA ALA A 103 -5.214 -0.303 3.794 1.00 0.00 C ATOM 1589 C ALA A 103 -5.297 0.554 2.530 1.00 0.00 C ATOM 1590 O ALA A 103 -4.998 1.747 2.563 1.00 0.00 O ATOM 1591 CB ALA A 103 -3.878 -1.038 3.914 1.00 0.00 C ATOM 0 H ALA A 103 -6.010 -2.237 3.653 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.296 0.366 4.651 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -3.063 -0.314 3.916 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.859 -1.608 4.843 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.759 -1.716 3.069 1.00 0.00 H new ATOM 1597 N LEU A 104 -5.703 -0.088 1.444 1.00 0.00 N ATOM 1598 CA LEU A 104 -5.828 0.601 0.171 1.00 0.00 C ATOM 1599 C LEU A 104 -6.882 1.703 0.294 1.00 0.00 C ATOM 1600 O LEU A 104 -6.570 2.884 0.150 1.00 0.00 O ATOM 1601 CB LEU A 104 -6.111 -0.398 -0.953 1.00 0.00 C ATOM 1602 CG LEU A 104 -6.724 0.184 -2.229 1.00 0.00 C ATOM 1603 CD1 LEU A 104 -5.689 0.992 -3.015 1.00 0.00 C ATOM 1604 CD2 LEU A 104 -7.360 -0.915 -3.082 1.00 0.00 C ATOM 0 H LEU A 104 -5.949 -1.077 1.420 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.888 1.086 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.176 -0.893 -1.216 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.782 -1.166 -0.569 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.520 0.871 -1.943 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.150 1.394 -3.917 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.323 1.812 -2.398 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.856 0.346 -3.291 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.788 -0.475 -3.983 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.600 -1.645 -3.361 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.146 -1.410 -2.511 1.00 0.00 H new ATOM 1616 N ASN A 105 -8.109 1.278 0.558 1.00 0.00 N ATOM 1617 CA ASN A 105 -9.211 2.214 0.701 1.00 0.00 C ATOM 1618 C ASN A 105 -8.748 3.417 1.526 1.00 0.00 C ATOM 1619 O ASN A 105 -9.093 4.556 1.216 1.00 0.00 O ATOM 1620 CB ASN A 105 -10.391 1.568 1.429 1.00 0.00 C ATOM 1621 CG ASN A 105 -11.693 2.317 1.136 1.00 0.00 C ATOM 1622 OD1 ASN A 105 -11.796 3.093 0.199 1.00 0.00 O ATOM 1623 ND2 ASN A 105 -12.678 2.043 1.986 1.00 0.00 N ATOM 0 H ASN A 105 -8.364 0.298 0.677 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.526 2.519 -0.297 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -10.488 0.527 1.119 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -10.203 1.565 2.503 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -13.587 2.492 1.875 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -12.525 1.383 2.749 1.00 0.00 H new ATOM 1630 N ASN A 106 -7.974 3.122 2.560 1.00 0.00 N ATOM 1631 CA ASN A 106 -7.461 4.165 3.432 1.00 0.00 C ATOM 1632 C ASN A 106 -6.713 5.204 2.593 1.00 0.00 C ATOM 1633 O ASN A 106 -7.053 6.386 2.614 1.00 0.00 O ATOM 1634 CB ASN A 106 -6.481 3.593 4.458 1.00 0.00 C ATOM 1635 CG ASN A 106 -6.939 3.900 5.885 1.00 0.00 C ATOM 1636 OD1 ASN A 106 -7.469 4.959 6.180 1.00 0.00 O ATOM 1637 ND2 ASN A 106 -6.706 2.918 6.751 1.00 0.00 N ATOM 0 H ASN A 106 -7.690 2.176 2.814 1.00 0.00 H new ATOM 0 HA ASN A 106 -8.307 4.615 3.952 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -6.397 2.515 4.324 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -5.489 4.013 4.292 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -6.975 3.026 7.729 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -6.258 2.057 6.437 1.00 0.00 H new ATOM 1644 N PHE A 107 -5.709 4.724 1.873 1.00 0.00 N ATOM 1645 CA PHE A 107 -4.911 5.596 1.028 1.00 0.00 C ATOM 1646 C PHE A 107 -5.802 6.428 0.102 1.00 0.00 C ATOM 1647 O PHE A 107 -5.549 7.613 -0.108 1.00 0.00 O ATOM 1648 CB PHE A 107 -4.013 4.696 0.178 1.00 0.00 C ATOM 1649 CG PHE A 107 -2.906 5.445 -0.566 1.00 0.00 C ATOM 1650 CD1 PHE A 107 -2.279 6.496 0.028 1.00 0.00 C ATOM 1651 CD2 PHE A 107 -2.548 5.060 -1.820 1.00 0.00 C ATOM 1652 CE1 PHE A 107 -1.251 7.191 -0.663 1.00 0.00 C ATOM 1653 CE2 PHE A 107 -1.521 5.756 -2.511 1.00 0.00 C ATOM 1654 CZ PHE A 107 -0.894 6.806 -1.917 1.00 0.00 C ATOM 0 H PHE A 107 -5.430 3.743 1.858 1.00 0.00 H new ATOM 0 HA PHE A 107 -4.332 6.283 1.645 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -3.559 3.942 0.821 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -4.630 4.166 -0.548 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -2.563 6.802 1.024 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -3.045 4.225 -2.291 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -0.753 8.026 -0.192 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.238 5.451 -3.508 1.00 0.00 H new ATOM 0 HZ PHE A 107 -0.112 7.335 -2.442 1.00 0.00 H new ATOM 1664 N GLN A 108 -6.825 5.773 -0.427 1.00 0.00 N ATOM 1665 CA GLN A 108 -7.755 6.437 -1.325 1.00 0.00 C ATOM 1666 C GLN A 108 -8.415 7.625 -0.622 1.00 0.00 C ATOM 1667 O GLN A 108 -8.193 8.775 -0.999 1.00 0.00 O ATOM 1668 CB GLN A 108 -8.806 5.457 -1.849 1.00 0.00 C ATOM 1669 CG GLN A 108 -8.306 4.737 -3.103 1.00 0.00 C ATOM 1670 CD GLN A 108 -9.478 4.219 -3.941 1.00 0.00 C ATOM 1671 OE1 GLN A 108 -10.511 4.854 -4.070 1.00 0.00 O ATOM 1672 NE2 GLN A 108 -9.259 3.033 -4.501 1.00 0.00 N ATOM 0 H GLN A 108 -7.030 4.790 -0.251 1.00 0.00 H new ATOM 0 HA GLN A 108 -7.196 6.812 -2.183 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -9.045 4.726 -1.076 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -9.727 5.993 -2.076 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -7.700 5.418 -3.700 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -7.663 3.905 -2.817 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -8.370 2.555 -4.352 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -9.980 2.601 -5.080 1.00 0.00 H new ATOM 1681 N ALA A 109 -9.213 7.306 0.386 1.00 0.00 N ATOM 1682 CA ALA A 109 -9.907 8.333 1.144 1.00 0.00 C ATOM 1683 C ALA A 109 -8.931 9.462 1.478 1.00 0.00 C ATOM 1684 O ALA A 109 -9.339 10.610 1.650 1.00 0.00 O ATOM 1685 CB ALA A 109 -10.529 7.711 2.396 1.00 0.00 C ATOM 0 H ALA A 109 -9.394 6.351 0.695 1.00 0.00 H new ATOM 0 HA ALA A 109 -10.718 8.762 0.555 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -11.050 8.481 2.965 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -11.237 6.935 2.104 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -9.744 7.273 3.013 1.00 0.00 H new ATOM 1691 N VAL A 110 -7.660 9.098 1.559 1.00 0.00 N ATOM 1692 CA VAL A 110 -6.622 10.066 1.869 1.00 0.00 C ATOM 1693 C VAL A 110 -6.249 10.832 0.599 1.00 0.00 C ATOM 1694 O VAL A 110 -6.066 12.048 0.633 1.00 0.00 O ATOM 1695 CB VAL A 110 -5.426 9.363 2.516 1.00 0.00 C ATOM 1696 CG1 VAL A 110 -4.173 10.239 2.449 1.00 0.00 C ATOM 1697 CG2 VAL A 110 -5.740 8.964 3.960 1.00 0.00 C ATOM 0 H VAL A 110 -7.325 8.145 1.415 1.00 0.00 H new ATOM 0 HA VAL A 110 -6.985 10.795 2.594 1.00 0.00 H new ATOM 0 HB VAL A 110 -5.228 8.451 1.952 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.338 9.716 2.916 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.932 10.450 1.407 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.355 11.175 2.977 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.874 8.466 4.397 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -5.977 9.856 4.540 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -6.593 8.285 3.973 1.00 0.00 H new ATOM 1707 N GLN A 111 -6.147 10.089 -0.494 1.00 0.00 N ATOM 1708 CA GLN A 111 -5.799 10.683 -1.773 1.00 0.00 C ATOM 1709 C GLN A 111 -6.789 11.793 -2.130 1.00 0.00 C ATOM 1710 O GLN A 111 -6.400 12.825 -2.674 1.00 0.00 O ATOM 1711 CB GLN A 111 -5.746 9.621 -2.874 1.00 0.00 C ATOM 1712 CG GLN A 111 -7.040 9.612 -3.690 1.00 0.00 C ATOM 1713 CD GLN A 111 -7.064 8.435 -4.667 1.00 0.00 C ATOM 1714 OE1 GLN A 111 -6.087 7.727 -4.850 1.00 0.00 O ATOM 1715 NE2 GLN A 111 -8.231 8.266 -5.282 1.00 0.00 N ATOM 0 H GLN A 111 -6.299 9.081 -0.519 1.00 0.00 H new ATOM 0 HA GLN A 111 -4.805 11.123 -1.689 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -4.899 9.816 -3.531 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -5.585 8.639 -2.429 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -7.897 9.550 -3.019 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -7.134 10.548 -4.240 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -9.009 8.895 -5.082 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -8.348 7.507 -5.953 1.00 0.00 H new ATOM 1724 N ARG A 112 -8.050 11.543 -1.809 1.00 0.00 N ATOM 1725 CA ARG A 112 -9.099 12.509 -2.088 1.00 0.00 C ATOM 1726 C ARG A 112 -8.898 13.770 -1.246 1.00 0.00 C ATOM 1727 O ARG A 112 -8.714 14.860 -1.787 1.00 0.00 O ATOM 1728 CB ARG A 112 -10.481 11.923 -1.793 1.00 0.00 C ATOM 1729 CG ARG A 112 -11.585 12.932 -2.113 1.00 0.00 C ATOM 1730 CD ARG A 112 -12.117 13.586 -0.836 1.00 0.00 C ATOM 1731 NE ARG A 112 -13.277 12.824 -0.323 1.00 0.00 N ATOM 1732 CZ ARG A 112 -14.510 12.891 -0.844 1.00 0.00 C ATOM 1733 NH1 ARG A 112 -14.750 13.685 -1.896 1.00 0.00 N ATOM 1734 NH2 ARG A 112 -15.502 12.164 -0.313 1.00 0.00 N ATOM 0 H ARG A 112 -8.369 10.685 -1.358 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.042 12.762 -3.147 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -10.629 11.018 -2.382 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.541 11.634 -0.744 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.198 13.699 -2.785 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -12.400 12.431 -2.636 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -11.332 13.621 -0.081 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -12.409 14.616 -1.040 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.129 12.209 0.477 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -13.994 14.238 -2.300 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -15.688 13.736 -2.293 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -15.319 11.559 0.488 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -16.440 12.215 -0.710 1.00 0.00 H new ATOM 1748 N ARG A 113 -8.939 13.581 0.065 1.00 0.00 N ATOM 1749 CA ARG A 113 -8.763 14.689 0.987 1.00 0.00 C ATOM 1750 C ARG A 113 -7.583 15.560 0.552 1.00 0.00 C ATOM 1751 O ARG A 113 -7.642 16.785 0.646 1.00 0.00 O ATOM 1752 CB ARG A 113 -8.519 14.187 2.412 1.00 0.00 C ATOM 1753 CG ARG A 113 -9.758 14.393 3.285 1.00 0.00 C ATOM 1754 CD ARG A 113 -9.502 15.451 4.361 1.00 0.00 C ATOM 1755 NE ARG A 113 -9.830 14.904 5.696 1.00 0.00 N ATOM 1756 CZ ARG A 113 -9.431 15.454 6.852 1.00 0.00 C ATOM 1757 NH1 ARG A 113 -8.686 16.568 6.841 1.00 0.00 N ATOM 1758 NH2 ARG A 113 -9.776 14.889 8.017 1.00 0.00 N ATOM 0 H ARG A 113 -9.092 12.676 0.510 1.00 0.00 H new ATOM 0 HA ARG A 113 -9.679 15.279 0.974 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -8.258 13.129 2.389 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -7.671 14.715 2.847 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -10.599 14.699 2.663 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -10.036 13.450 3.756 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -8.458 15.764 4.334 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.106 16.336 4.163 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.395 14.056 5.740 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -8.423 16.997 5.954 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.382 16.987 7.720 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -10.342 14.041 8.024 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -9.472 15.307 8.896 1.00 0.00 H new ATOM 1772 N VAL A 114 -6.537 14.894 0.085 1.00 0.00 N ATOM 1773 CA VAL A 114 -5.345 15.592 -0.366 1.00 0.00 C ATOM 1774 C VAL A 114 -5.700 16.481 -1.559 1.00 0.00 C ATOM 1775 O VAL A 114 -5.319 17.650 -1.601 1.00 0.00 O ATOM 1776 CB VAL A 114 -4.236 14.585 -0.680 1.00 0.00 C ATOM 1777 CG1 VAL A 114 -3.025 15.280 -1.303 1.00 0.00 C ATOM 1778 CG2 VAL A 114 -3.835 13.803 0.573 1.00 0.00 C ATOM 0 H VAL A 114 -6.490 13.878 0.009 1.00 0.00 H new ATOM 0 HA VAL A 114 -4.963 16.242 0.421 1.00 0.00 H new ATOM 0 HB VAL A 114 -4.625 13.874 -1.409 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -2.252 14.542 -1.516 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -3.324 15.771 -2.229 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -2.635 16.024 -0.608 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.046 13.094 0.323 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.474 14.495 1.334 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -4.700 13.262 0.957 1.00 0.00 H new ATOM 1788 N SER A 115 -6.426 15.894 -2.499 1.00 0.00 N ATOM 1789 CA SER A 115 -6.837 16.619 -3.689 1.00 0.00 C ATOM 1790 C SER A 115 -7.588 17.892 -3.294 1.00 0.00 C ATOM 1791 O SER A 115 -7.240 18.985 -3.737 1.00 0.00 O ATOM 1792 CB SER A 115 -7.710 15.746 -4.592 1.00 0.00 C ATOM 1793 OG SER A 115 -7.124 14.469 -4.829 1.00 0.00 O ATOM 0 H SER A 115 -6.740 14.924 -2.461 1.00 0.00 H new ATOM 0 HA SER A 115 -5.942 16.892 -4.248 1.00 0.00 H new ATOM 0 HB2 SER A 115 -8.690 15.616 -4.133 1.00 0.00 H new ATOM 0 HB3 SER A 115 -7.869 16.254 -5.543 1.00 0.00 H new ATOM 0 HG SER A 115 -7.080 13.968 -3.988 1.00 0.00 H new ATOM 1799 N GLU A 116 -8.604 17.707 -2.464 1.00 0.00 N ATOM 1800 CA GLU A 116 -9.408 18.827 -2.004 1.00 0.00 C ATOM 1801 C GLU A 116 -8.505 19.968 -1.530 1.00 0.00 C ATOM 1802 O GLU A 116 -8.745 21.130 -1.856 1.00 0.00 O ATOM 1803 CB GLU A 116 -10.370 18.393 -0.897 1.00 0.00 C ATOM 1804 CG GLU A 116 -11.690 17.888 -1.484 1.00 0.00 C ATOM 1805 CD GLU A 116 -12.789 17.865 -0.420 1.00 0.00 C ATOM 1806 OE1 GLU A 116 -13.419 18.928 -0.232 1.00 0.00 O ATOM 1807 OE2 GLU A 116 -12.975 16.785 0.180 1.00 0.00 O ATOM 0 H GLU A 116 -8.889 16.799 -2.098 1.00 0.00 H new ATOM 0 HA GLU A 116 -10.008 19.187 -2.840 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -9.910 17.607 -0.298 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.563 19.232 -0.228 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.993 18.529 -2.312 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.552 16.886 -1.891 1.00 0.00 H new ATOM 1814 N LYS A 117 -7.486 19.597 -0.770 1.00 0.00 N ATOM 1815 CA LYS A 117 -6.546 20.575 -0.248 1.00 0.00 C ATOM 1816 C LYS A 117 -5.898 21.325 -1.414 1.00 0.00 C ATOM 1817 O LYS A 117 -5.738 22.544 -1.360 1.00 0.00 O ATOM 1818 CB LYS A 117 -5.539 19.905 0.688 1.00 0.00 C ATOM 1819 CG LYS A 117 -4.461 20.895 1.134 1.00 0.00 C ATOM 1820 CD LYS A 117 -4.653 21.291 2.599 1.00 0.00 C ATOM 1821 CE LYS A 117 -3.454 20.857 3.445 1.00 0.00 C ATOM 1822 NZ LYS A 117 -3.731 19.566 4.113 1.00 0.00 N ATOM 0 H LYS A 117 -7.290 18.632 -0.503 1.00 0.00 H new ATOM 0 HA LYS A 117 -7.065 21.316 0.360 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -6.057 19.508 1.561 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -5.074 19.059 0.182 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.475 20.449 1.000 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -4.497 21.785 0.505 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -4.784 22.371 2.674 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -5.562 20.832 2.988 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -2.570 20.764 2.813 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -3.233 21.620 4.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -2.907 19.286 4.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -4.562 19.666 4.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -3.919 18.837 3.395 1.00 0.00 H new ATOM 1836 N GLU A 118 -5.541 20.566 -2.439 1.00 0.00 N ATOM 1837 CA GLU A 118 -4.914 21.143 -3.615 1.00 0.00 C ATOM 1838 C GLU A 118 -5.949 21.892 -4.456 1.00 0.00 C ATOM 1839 O GLU A 118 -5.592 22.675 -5.335 1.00 0.00 O ATOM 1840 CB GLU A 118 -4.208 20.068 -4.444 1.00 0.00 C ATOM 1841 CG GLU A 118 -2.799 19.801 -3.911 1.00 0.00 C ATOM 1842 CD GLU A 118 -1.810 20.849 -4.428 1.00 0.00 C ATOM 1843 OE1 GLU A 118 -1.687 20.949 -5.668 1.00 0.00 O ATOM 1844 OE2 GLU A 118 -1.201 21.525 -3.571 1.00 0.00 O ATOM 0 H GLU A 118 -5.674 19.556 -2.479 1.00 0.00 H new ATOM 0 HA GLU A 118 -4.158 21.856 -3.286 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -4.790 19.146 -4.422 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -4.153 20.385 -5.485 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -2.810 19.813 -2.821 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -2.473 18.807 -4.216 1.00 0.00 H new