USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 968 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 21 ASN : amide:sc= -2.61! K(o=0.49!,f=2.4) USER MOD Set 1.2: B 40 LYS NZ :NH3+ -174:sc= 1.2 (180deg=0) USER MOD Set 1.3: B 60 SER OG : rot 79:sc= 1.91 USER MOD Set 2.1: A 14 HIS : no HD1:sc= -0.0778 X(o=-1.7,f=-1.6) USER MOD Set 2.2: A 30 ASN : amide:sc= -1.61 K(o=-1.7,f=-5.8!) USER MOD Single : A 8 THR OG1 : rot 180:sc=-0.00229 USER MOD Single : A 17 THR OG1 : rot -97:sc= 1.15 USER MOD Single : A 19 SER OG : rot -7:sc= 1.04 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 128:sc= 1.55 USER MOD Single : A 27 LYS NZ :NH3+ 172:sc= 0.832 (180deg=0.485) USER MOD Single : A 33 SER OG : rot 88:sc= 0.236 USER MOD Single : A 35 ASN : amide:sc= -0.0706 X(o=-0.071,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.0463 USER MOD Single : A 60 SER OG : rot 180:sc= -0.107 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 65 GLN : amide:sc= 0.97 K(o=0.97,f=-1.6) USER MOD Single : A 66 THR OG1 : rot 90:sc= 1.3 USER MOD Single : A 67 MET CE :methyl 160:sc= -0.069 (180deg=-0.584) USER MOD Single : A 72 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.104) USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=0.97) USER MOD Single : B 8 THR OG1 : rot 30:sc= 0.256 USER MOD Single : B 14 HIS : no HD1:sc= 0.363 K(o=0.36,f=-5.5!) USER MOD Single : B 17 THR OG1 : rot -47:sc= 1.24 USER MOD Single : B 19 SER OG : rot 102:sc= 1.28 USER MOD Single : B 21 ASN : amide:sc= -2.28! K(o=-2.3!,f=0) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 THR OG1 : rot 180:sc= -0.158 USER MOD Single : B 27 LYS NZ :NH3+ -143:sc= 1.79 (180deg=0.972!) USER MOD Single : B 30 ASN : amide:sc= -1.18 K(o=-1.2,f=-0.099) USER MOD Single : B 33 SER OG : rot 178:sc= -0.379 USER MOD Single : B 35 ASN : amide:sc= -0.426 K(o=-0.43,f=-1.9) USER MOD Single : B 47 SER OG : rot -118:sc= 1.08 USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 58 THR OG1 : rot 180:sc= 0.0215 USER MOD Single : B 61 ASN : amide:sc= -0.248 K(o=-0.25,f=-1.7!) USER MOD Single : B 65 GLN : amide:sc= -0.0557 X(o=-0.056,f=0) USER MOD Single : B 66 THR OG1 : rot 74:sc= 1.23 USER MOD Single : B 67 MET CE :methyl 139:sc= -0.163 (180deg=-1.51) USER MOD Single : B 72 LYS NZ :NH3+ 177:sc= 1.78 (180deg=1.66) USER MOD Single : B 74 ASN : amide:sc= -2.55! K(o=-2.5!,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 126 N THR A 8 13.308 8.751 -16.350 1.00 0.00 N ATOM 127 CA THR A 8 14.219 8.012 -15.506 1.00 0.00 C ATOM 128 C THR A 8 13.573 7.730 -14.156 1.00 0.00 C ATOM 129 O THR A 8 12.833 8.562 -13.627 1.00 0.00 O ATOM 130 CB THR A 8 15.532 8.792 -15.301 1.00 0.00 C ATOM 131 OG1 THR A 8 15.243 10.131 -14.872 1.00 0.00 O ATOM 132 CG2 THR A 8 16.349 8.833 -16.586 1.00 0.00 C ATOM 0 HA THR A 8 14.449 7.068 -16.000 1.00 0.00 H new ATOM 0 HB THR A 8 16.116 8.280 -14.536 1.00 0.00 H new ATOM 0 HG1 THR A 8 16.082 10.621 -14.742 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.270 9.389 -16.414 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.591 7.816 -16.896 1.00 0.00 H new ATOM 0 HG23 THR A 8 15.771 9.323 -17.369 1.00 0.00 H new ATOM 140 N PHE A 9 13.826 6.549 -13.624 1.00 0.00 N ATOM 141 CA PHE A 9 13.340 6.194 -12.302 1.00 0.00 C ATOM 142 C PHE A 9 14.500 5.755 -11.418 1.00 0.00 C ATOM 143 O PHE A 9 15.193 4.780 -11.712 1.00 0.00 O ATOM 144 CB PHE A 9 12.254 5.105 -12.381 1.00 0.00 C ATOM 145 CG PHE A 9 12.604 3.918 -13.243 1.00 0.00 C ATOM 146 CD1 PHE A 9 12.432 3.971 -14.618 1.00 0.00 C ATOM 147 CD2 PHE A 9 13.092 2.748 -12.679 1.00 0.00 C ATOM 148 CE1 PHE A 9 12.743 2.885 -15.413 1.00 0.00 C ATOM 149 CE2 PHE A 9 13.405 1.660 -13.471 1.00 0.00 C ATOM 150 CZ PHE A 9 13.229 1.728 -14.839 1.00 0.00 C ATOM 0 H PHE A 9 14.366 5.818 -14.087 1.00 0.00 H new ATOM 0 HA PHE A 9 12.881 7.076 -11.855 1.00 0.00 H new ATOM 0 HB2 PHE A 9 12.040 4.752 -11.372 1.00 0.00 H new ATOM 0 HB3 PHE A 9 11.337 5.554 -12.762 1.00 0.00 H new ATOM 0 HD1 PHE A 9 12.050 4.873 -15.073 1.00 0.00 H new ATOM 0 HD2 PHE A 9 13.229 2.687 -11.609 1.00 0.00 H new ATOM 0 HE1 PHE A 9 12.606 2.941 -16.483 1.00 0.00 H new ATOM 0 HE2 PHE A 9 13.787 0.756 -13.020 1.00 0.00 H new ATOM 0 HZ PHE A 9 13.471 0.877 -15.459 1.00 0.00 H new ATOM 160 N GLU A 10 14.706 6.490 -10.341 1.00 0.00 N ATOM 161 CA GLU A 10 15.829 6.261 -9.450 1.00 0.00 C ATOM 162 C GLU A 10 15.359 5.675 -8.132 1.00 0.00 C ATOM 163 O GLU A 10 14.569 6.289 -7.422 1.00 0.00 O ATOM 164 CB GLU A 10 16.560 7.579 -9.198 1.00 0.00 C ATOM 165 CG GLU A 10 17.150 8.202 -10.450 1.00 0.00 C ATOM 166 CD GLU A 10 18.376 7.467 -10.947 1.00 0.00 C ATOM 167 OE1 GLU A 10 18.231 6.528 -11.756 1.00 0.00 O ATOM 168 OE2 GLU A 10 19.495 7.824 -10.528 1.00 0.00 O ATOM 0 H GLU A 10 14.101 7.261 -10.059 1.00 0.00 H new ATOM 0 HA GLU A 10 16.508 5.550 -9.921 1.00 0.00 H new ATOM 0 HB2 GLU A 10 15.867 8.287 -8.743 1.00 0.00 H new ATOM 0 HB3 GLU A 10 17.360 7.408 -8.477 1.00 0.00 H new ATOM 0 HG2 GLU A 10 16.395 8.213 -11.236 1.00 0.00 H new ATOM 0 HG3 GLU A 10 17.412 9.240 -10.245 1.00 0.00 H new ATOM 175 N ILE A 11 15.842 4.488 -7.811 1.00 0.00 N ATOM 176 CA ILE A 11 15.523 3.867 -6.532 1.00 0.00 C ATOM 177 C ILE A 11 16.587 4.247 -5.516 1.00 0.00 C ATOM 178 O ILE A 11 17.656 3.635 -5.466 1.00 0.00 O ATOM 179 CB ILE A 11 15.451 2.326 -6.621 1.00 0.00 C ATOM 180 CG1 ILE A 11 14.602 1.880 -7.819 1.00 0.00 C ATOM 181 CG2 ILE A 11 14.882 1.753 -5.324 1.00 0.00 C ATOM 182 CD1 ILE A 11 13.149 2.294 -7.732 1.00 0.00 C ATOM 0 H ILE A 11 16.453 3.935 -8.412 1.00 0.00 H new ATOM 0 HA ILE A 11 14.540 4.229 -6.231 1.00 0.00 H new ATOM 0 HB ILE A 11 16.462 1.945 -6.766 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.033 2.294 -8.731 1.00 0.00 H new ATOM 0 HG13 ILE A 11 14.655 0.795 -7.905 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.835 0.666 -5.396 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.524 2.034 -4.489 1.00 0.00 H new ATOM 0 HG23 ILE A 11 13.880 2.149 -5.160 1.00 0.00 H new ATOM 0 HD11 ILE A 11 12.617 1.941 -8.615 1.00 0.00 H new ATOM 0 HD12 ILE A 11 12.699 1.859 -6.840 1.00 0.00 H new ATOM 0 HD13 ILE A 11 13.083 3.381 -7.678 1.00 0.00 H new ATOM 194 N GLU A 12 16.316 5.269 -4.728 1.00 0.00 N ATOM 195 CA GLU A 12 17.307 5.789 -3.802 1.00 0.00 C ATOM 196 C GLU A 12 17.046 5.319 -2.379 1.00 0.00 C ATOM 197 O GLU A 12 17.986 5.052 -1.631 1.00 0.00 O ATOM 198 CB GLU A 12 17.362 7.327 -3.849 1.00 0.00 C ATOM 199 CG GLU A 12 16.095 8.030 -3.381 1.00 0.00 C ATOM 200 CD GLU A 12 14.921 7.783 -4.294 1.00 0.00 C ATOM 201 OE1 GLU A 12 14.745 8.547 -5.258 1.00 0.00 O ATOM 202 OE2 GLU A 12 14.193 6.809 -4.055 1.00 0.00 O ATOM 0 H GLU A 12 15.420 5.756 -4.709 1.00 0.00 H new ATOM 0 HA GLU A 12 18.274 5.397 -4.118 1.00 0.00 H new ATOM 0 HB2 GLU A 12 18.196 7.665 -3.233 1.00 0.00 H new ATOM 0 HB3 GLU A 12 17.575 7.637 -4.872 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.846 7.690 -2.376 1.00 0.00 H new ATOM 0 HG3 GLU A 12 16.282 9.102 -3.318 1.00 0.00 H new ATOM 209 N GLU A 13 15.781 5.204 -2.004 1.00 0.00 N ATOM 210 CA GLU A 13 15.446 4.926 -0.618 1.00 0.00 C ATOM 211 C GLU A 13 14.518 3.725 -0.472 1.00 0.00 C ATOM 212 O GLU A 13 13.425 3.687 -1.043 1.00 0.00 O ATOM 213 CB GLU A 13 14.808 6.160 0.013 1.00 0.00 C ATOM 214 CG GLU A 13 14.594 6.045 1.509 1.00 0.00 C ATOM 215 CD GLU A 13 14.041 7.320 2.096 1.00 0.00 C ATOM 216 OE1 GLU A 13 14.831 8.248 2.364 1.00 0.00 O ATOM 217 OE2 GLU A 13 12.813 7.416 2.281 1.00 0.00 O ATOM 0 H GLU A 13 14.981 5.297 -2.630 1.00 0.00 H new ATOM 0 HA GLU A 13 16.373 4.679 -0.100 1.00 0.00 H new ATOM 0 HB2 GLU A 13 15.439 7.026 -0.188 1.00 0.00 H new ATOM 0 HB3 GLU A 13 13.848 6.346 -0.468 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.909 5.223 1.716 1.00 0.00 H new ATOM 0 HG3 GLU A 13 15.540 5.802 1.994 1.00 0.00 H new ATOM 224 N HIS A 14 14.974 2.748 0.298 1.00 0.00 N ATOM 225 CA HIS A 14 14.150 1.607 0.673 1.00 0.00 C ATOM 226 C HIS A 14 13.491 1.881 2.019 1.00 0.00 C ATOM 227 O HIS A 14 14.174 1.949 3.041 1.00 0.00 O ATOM 228 CB HIS A 14 14.997 0.328 0.776 1.00 0.00 C ATOM 229 CG HIS A 14 15.628 -0.113 -0.511 1.00 0.00 C ATOM 230 ND1 HIS A 14 16.748 0.489 -1.041 1.00 0.00 N ATOM 231 CD2 HIS A 14 15.297 -1.104 -1.372 1.00 0.00 C ATOM 232 CE1 HIS A 14 17.072 -0.108 -2.171 1.00 0.00 C ATOM 233 NE2 HIS A 14 16.210 -1.079 -2.394 1.00 0.00 N ATOM 0 H HIS A 14 15.920 2.723 0.679 1.00 0.00 H new ATOM 0 HA HIS A 14 13.391 1.461 -0.096 1.00 0.00 H new ATOM 0 HB2 HIS A 14 15.783 0.488 1.514 1.00 0.00 H new ATOM 0 HB3 HIS A 14 14.367 -0.479 1.151 1.00 0.00 H new ATOM 0 HD2 HIS A 14 14.467 -1.788 -1.272 1.00 0.00 H new ATOM 0 HE1 HIS A 14 17.904 0.155 -2.807 1.00 0.00 H new ATOM 0 HE2 HIS A 14 16.220 -1.709 -3.196 1.00 0.00 H new ATOM 242 N LEU A 15 12.175 2.051 2.027 1.00 0.00 N ATOM 243 CA LEU A 15 11.455 2.299 3.271 1.00 0.00 C ATOM 244 C LEU A 15 11.419 1.032 4.117 1.00 0.00 C ATOM 245 O LEU A 15 11.812 1.046 5.283 1.00 0.00 O ATOM 246 CB LEU A 15 10.038 2.804 2.991 1.00 0.00 C ATOM 247 CG LEU A 15 9.963 4.187 2.340 1.00 0.00 C ATOM 248 CD1 LEU A 15 8.525 4.545 2.004 1.00 0.00 C ATOM 249 CD2 LEU A 15 10.567 5.240 3.255 1.00 0.00 C ATOM 0 H LEU A 15 11.588 2.022 1.194 1.00 0.00 H new ATOM 0 HA LEU A 15 11.982 3.075 3.826 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.534 2.086 2.344 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.485 2.830 3.930 1.00 0.00 H new ATOM 0 HG LEU A 15 10.537 4.159 1.414 1.00 0.00 H new ATOM 0 HD11 LEU A 15 8.494 5.532 1.542 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.119 3.808 1.312 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.929 4.553 2.917 1.00 0.00 H new ATOM 0 HD21 LEU A 15 10.505 6.217 2.776 1.00 0.00 H new ATOM 0 HD22 LEU A 15 10.018 5.262 4.196 1.00 0.00 H new ATOM 0 HD23 LEU A 15 11.612 4.997 3.450 1.00 0.00 H new ATOM 261 N LEU A 16 10.945 -0.057 3.519 1.00 0.00 N ATOM 262 CA LEU A 16 11.030 -1.378 4.136 1.00 0.00 C ATOM 263 C LEU A 16 10.556 -2.451 3.167 1.00 0.00 C ATOM 264 O LEU A 16 9.654 -2.223 2.356 1.00 0.00 O ATOM 265 CB LEU A 16 10.217 -1.468 5.437 1.00 0.00 C ATOM 266 CG LEU A 16 8.701 -1.349 5.283 1.00 0.00 C ATOM 267 CD1 LEU A 16 8.001 -2.437 6.079 1.00 0.00 C ATOM 268 CD2 LEU A 16 8.226 0.018 5.742 1.00 0.00 C ATOM 0 H LEU A 16 10.496 -0.051 2.603 1.00 0.00 H new ATOM 0 HA LEU A 16 12.079 -1.542 4.384 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.441 -2.420 5.918 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.558 -0.682 6.111 1.00 0.00 H new ATOM 0 HG LEU A 16 8.453 -1.470 4.229 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.922 -2.339 5.959 1.00 0.00 H new ATOM 0 HD12 LEU A 16 8.319 -3.415 5.717 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.259 -2.340 7.133 1.00 0.00 H new ATOM 0 HD21 LEU A 16 7.144 0.085 5.625 1.00 0.00 H new ATOM 0 HD22 LEU A 16 8.488 0.161 6.790 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.705 0.790 5.140 1.00 0.00 H new ATOM 280 N THR A 17 11.183 -3.609 3.243 1.00 0.00 N ATOM 281 CA THR A 17 10.747 -4.764 2.486 1.00 0.00 C ATOM 282 C THR A 17 9.737 -5.561 3.310 1.00 0.00 C ATOM 283 O THR A 17 10.048 -6.018 4.414 1.00 0.00 O ATOM 284 CB THR A 17 11.944 -5.660 2.103 1.00 0.00 C ATOM 285 OG1 THR A 17 12.880 -4.904 1.319 1.00 0.00 O ATOM 286 CG2 THR A 17 11.488 -6.886 1.321 1.00 0.00 C ATOM 0 H THR A 17 12.003 -3.774 3.827 1.00 0.00 H new ATOM 0 HA THR A 17 10.277 -4.419 1.565 1.00 0.00 H new ATOM 0 HB THR A 17 12.423 -6.002 3.021 1.00 0.00 H new ATOM 0 HG1 THR A 17 12.725 -5.078 0.367 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.354 -7.497 1.066 1.00 0.00 H new ATOM 0 HG22 THR A 17 10.798 -7.470 1.930 1.00 0.00 H new ATOM 0 HG23 THR A 17 10.986 -6.569 0.407 1.00 0.00 H new ATOM 294 N LEU A 18 8.526 -5.702 2.788 1.00 0.00 N ATOM 295 CA LEU A 18 7.463 -6.392 3.506 1.00 0.00 C ATOM 296 C LEU A 18 7.726 -7.888 3.553 1.00 0.00 C ATOM 297 O LEU A 18 8.120 -8.422 4.589 1.00 0.00 O ATOM 298 CB LEU A 18 6.099 -6.122 2.862 1.00 0.00 C ATOM 299 CG LEU A 18 5.628 -4.670 2.916 1.00 0.00 C ATOM 300 CD1 LEU A 18 4.324 -4.513 2.153 1.00 0.00 C ATOM 301 CD2 LEU A 18 5.451 -4.221 4.358 1.00 0.00 C ATOM 0 H LEU A 18 8.255 -5.348 1.870 1.00 0.00 H new ATOM 0 HA LEU A 18 7.448 -6.006 4.525 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.140 -6.435 1.819 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.353 -6.747 3.353 1.00 0.00 H new ATOM 0 HG LEU A 18 6.386 -4.042 2.449 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.999 -3.474 2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.474 -4.801 1.112 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.562 -5.152 2.599 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.115 -3.184 4.378 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.709 -4.852 4.847 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.402 -4.304 4.884 1.00 0.00 H new ATOM 313 N SER A 19 7.531 -8.558 2.424 1.00 0.00 N ATOM 314 CA SER A 19 7.676 -10.011 2.361 1.00 0.00 C ATOM 315 C SER A 19 7.782 -10.495 0.921 1.00 0.00 C ATOM 316 O SER A 19 7.397 -9.788 -0.014 1.00 0.00 O ATOM 317 CB SER A 19 6.477 -10.705 3.027 1.00 0.00 C ATOM 318 OG SER A 19 6.428 -10.451 4.422 1.00 0.00 O ATOM 0 H SER A 19 7.272 -8.121 1.539 1.00 0.00 H new ATOM 0 HA SER A 19 8.593 -10.266 2.892 1.00 0.00 H new ATOM 0 HB2 SER A 19 5.553 -10.360 2.562 1.00 0.00 H new ATOM 0 HB3 SER A 19 6.538 -11.780 2.855 1.00 0.00 H new ATOM 0 HG SER A 19 7.240 -9.976 4.697 1.00 0.00 H new ATOM 324 N GLU A 20 8.327 -11.690 0.751 1.00 0.00 N ATOM 325 CA GLU A 20 8.248 -12.389 -0.517 1.00 0.00 C ATOM 326 C GLU A 20 6.989 -13.242 -0.507 1.00 0.00 C ATOM 327 O GLU A 20 6.943 -14.286 0.147 1.00 0.00 O ATOM 328 CB GLU A 20 9.484 -13.264 -0.745 1.00 0.00 C ATOM 329 CG GLU A 20 9.444 -14.030 -2.055 1.00 0.00 C ATOM 330 CD GLU A 20 10.668 -14.895 -2.266 1.00 0.00 C ATOM 331 OE1 GLU A 20 10.784 -15.943 -1.593 1.00 0.00 O ATOM 332 OE2 GLU A 20 11.511 -14.537 -3.114 1.00 0.00 O ATOM 0 H GLU A 20 8.830 -12.195 1.480 1.00 0.00 H new ATOM 0 HA GLU A 20 8.211 -11.666 -1.332 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.374 -12.635 -0.727 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.577 -13.972 0.079 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.553 -14.658 -2.077 1.00 0.00 H new ATOM 0 HG3 GLU A 20 9.357 -13.324 -2.881 1.00 0.00 H new ATOM 339 N ASN A 21 5.965 -12.787 -1.207 1.00 0.00 N ATOM 340 CA ASN A 21 4.644 -13.370 -1.069 1.00 0.00 C ATOM 341 C ASN A 21 4.490 -14.626 -1.917 1.00 0.00 C ATOM 342 O ASN A 21 4.692 -14.603 -3.136 1.00 0.00 O ATOM 343 CB ASN A 21 3.578 -12.338 -1.449 1.00 0.00 C ATOM 344 CG ASN A 21 2.167 -12.758 -1.069 1.00 0.00 C ATOM 345 OD1 ASN A 21 1.202 -12.418 -1.756 1.00 0.00 O ATOM 346 ND2 ASN A 21 2.027 -13.475 0.037 1.00 0.00 N ATOM 0 H ASN A 21 6.023 -12.018 -1.875 1.00 0.00 H new ATOM 0 HA ASN A 21 4.512 -13.661 -0.027 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.810 -11.391 -0.962 1.00 0.00 H new ATOM 0 HB3 ASN A 21 3.620 -12.163 -2.524 1.00 0.00 H new ATOM 0 HD21 ASN A 21 1.098 -13.763 0.344 1.00 0.00 H new ATOM 0 HD22 ASN A 21 2.848 -13.739 0.581 1.00 0.00 H new ATOM 353 N GLU A 22 4.138 -15.709 -1.225 1.00 0.00 N ATOM 354 CA GLU A 22 3.752 -16.999 -1.808 1.00 0.00 C ATOM 355 C GLU A 22 4.635 -17.457 -2.975 1.00 0.00 C ATOM 356 O GLU A 22 5.613 -18.175 -2.773 1.00 0.00 O ATOM 357 CB GLU A 22 2.282 -16.972 -2.231 1.00 0.00 C ATOM 358 CG GLU A 22 1.337 -16.554 -1.114 1.00 0.00 C ATOM 359 CD GLU A 22 1.603 -17.290 0.189 1.00 0.00 C ATOM 360 OE1 GLU A 22 1.435 -18.523 0.226 1.00 0.00 O ATOM 361 OE2 GLU A 22 1.982 -16.636 1.184 1.00 0.00 O ATOM 0 H GLU A 22 4.112 -15.715 -0.205 1.00 0.00 H new ATOM 0 HA GLU A 22 3.902 -17.736 -1.019 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.166 -16.286 -3.070 1.00 0.00 H new ATOM 0 HB3 GLU A 22 1.996 -17.962 -2.587 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.432 -15.481 -0.946 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.309 -16.738 -1.426 1.00 0.00 H new ATOM 368 N LYS A 23 4.287 -17.045 -4.189 1.00 0.00 N ATOM 369 CA LYS A 23 4.944 -17.549 -5.391 1.00 0.00 C ATOM 370 C LYS A 23 6.167 -16.716 -5.774 1.00 0.00 C ATOM 371 O LYS A 23 6.585 -16.704 -6.933 1.00 0.00 O ATOM 372 CB LYS A 23 3.948 -17.591 -6.551 1.00 0.00 C ATOM 373 CG LYS A 23 2.867 -18.647 -6.381 1.00 0.00 C ATOM 374 CD LYS A 23 3.460 -20.046 -6.324 1.00 0.00 C ATOM 375 CE LYS A 23 2.404 -21.096 -6.022 1.00 0.00 C ATOM 376 NZ LYS A 23 2.972 -22.469 -6.054 1.00 0.00 N ATOM 0 H LYS A 23 3.551 -16.361 -4.368 1.00 0.00 H new ATOM 0 HA LYS A 23 5.296 -18.558 -5.174 1.00 0.00 H new ATOM 0 HB2 LYS A 23 3.477 -16.613 -6.652 1.00 0.00 H new ATOM 0 HB3 LYS A 23 4.489 -17.781 -7.478 1.00 0.00 H new ATOM 0 HG2 LYS A 23 2.306 -18.451 -5.467 1.00 0.00 H new ATOM 0 HG3 LYS A 23 2.161 -18.583 -7.209 1.00 0.00 H new ATOM 0 HD2 LYS A 23 3.940 -20.276 -7.275 1.00 0.00 H new ATOM 0 HD3 LYS A 23 4.236 -20.081 -5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 23 1.970 -20.904 -5.041 1.00 0.00 H new ATOM 0 HE3 LYS A 23 1.595 -21.019 -6.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 2.223 -23.159 -5.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 3.364 -22.661 -6.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 3.727 -22.549 -5.343 1.00 0.00 H new ATOM 390 N GLY A 24 6.741 -16.035 -4.798 1.00 0.00 N ATOM 391 CA GLY A 24 7.979 -15.316 -5.022 1.00 0.00 C ATOM 392 C GLY A 24 7.768 -13.860 -5.364 1.00 0.00 C ATOM 393 O GLY A 24 8.729 -13.138 -5.628 1.00 0.00 O ATOM 0 H GLY A 24 6.372 -15.966 -3.850 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.599 -15.386 -4.128 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.529 -15.796 -5.831 1.00 0.00 H new ATOM 397 N TRP A 25 6.521 -13.420 -5.353 1.00 0.00 N ATOM 398 CA TRP A 25 6.219 -12.030 -5.649 1.00 0.00 C ATOM 399 C TRP A 25 6.549 -11.174 -4.449 1.00 0.00 C ATOM 400 O TRP A 25 5.875 -11.242 -3.422 1.00 0.00 O ATOM 401 CB TRP A 25 4.753 -11.857 -6.038 1.00 0.00 C ATOM 402 CG TRP A 25 4.476 -12.230 -7.460 1.00 0.00 C ATOM 403 CD1 TRP A 25 4.509 -13.480 -8.005 1.00 0.00 C ATOM 404 CD2 TRP A 25 4.121 -11.337 -8.523 1.00 0.00 C ATOM 405 NE1 TRP A 25 4.204 -13.421 -9.340 1.00 0.00 N ATOM 406 CE2 TRP A 25 3.954 -12.115 -9.681 1.00 0.00 C ATOM 407 CE3 TRP A 25 3.922 -9.955 -8.605 1.00 0.00 C ATOM 408 CZ2 TRP A 25 3.607 -11.556 -10.910 1.00 0.00 C ATOM 409 CZ3 TRP A 25 3.577 -9.401 -9.822 1.00 0.00 C ATOM 410 CH2 TRP A 25 3.419 -10.201 -10.959 1.00 0.00 C ATOM 0 H TRP A 25 5.708 -13.999 -5.144 1.00 0.00 H new ATOM 0 HA TRP A 25 6.828 -11.715 -6.496 1.00 0.00 H new ATOM 0 HB2 TRP A 25 4.134 -12.468 -5.381 1.00 0.00 H new ATOM 0 HB3 TRP A 25 4.460 -10.819 -5.877 1.00 0.00 H new ATOM 0 HD1 TRP A 25 4.742 -14.385 -7.463 1.00 0.00 H new ATOM 0 HE1 TRP A 25 4.169 -14.217 -9.976 1.00 0.00 H new ATOM 0 HE3 TRP A 25 4.036 -9.331 -7.731 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 3.491 -12.170 -11.791 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 3.427 -8.334 -9.897 1.00 0.00 H new ATOM 0 HH2 TRP A 25 3.143 -9.739 -11.896 1.00 0.00 H new ATOM 421 N THR A 26 7.580 -10.371 -4.574 1.00 0.00 N ATOM 422 CA THR A 26 8.061 -9.607 -3.452 1.00 0.00 C ATOM 423 C THR A 26 7.299 -8.303 -3.315 1.00 0.00 C ATOM 424 O THR A 26 7.017 -7.622 -4.303 1.00 0.00 O ATOM 425 CB THR A 26 9.562 -9.315 -3.605 1.00 0.00 C ATOM 426 OG1 THR A 26 9.884 -9.185 -4.995 1.00 0.00 O ATOM 427 CG2 THR A 26 10.401 -10.421 -2.987 1.00 0.00 C ATOM 0 H THR A 26 8.099 -10.232 -5.441 1.00 0.00 H new ATOM 0 HA THR A 26 7.901 -10.200 -2.552 1.00 0.00 H new ATOM 0 HB THR A 26 9.787 -8.385 -3.083 1.00 0.00 H new ATOM 0 HG1 THR A 26 10.362 -8.342 -5.143 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.459 -10.188 -3.110 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.169 -10.504 -1.925 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.178 -11.366 -3.482 1.00 0.00 H new ATOM 435 N LYS A 27 6.961 -7.973 -2.083 1.00 0.00 N ATOM 436 CA LYS A 27 6.300 -6.726 -1.782 1.00 0.00 C ATOM 437 C LYS A 27 7.221 -5.855 -0.962 1.00 0.00 C ATOM 438 O LYS A 27 7.606 -6.215 0.155 1.00 0.00 O ATOM 439 CB LYS A 27 4.997 -6.958 -1.025 1.00 0.00 C ATOM 440 CG LYS A 27 3.756 -6.535 -1.795 1.00 0.00 C ATOM 441 CD LYS A 27 3.443 -7.481 -2.946 1.00 0.00 C ATOM 442 CE LYS A 27 3.135 -8.893 -2.473 1.00 0.00 C ATOM 443 NZ LYS A 27 2.017 -8.929 -1.490 1.00 0.00 N ATOM 0 H LYS A 27 7.138 -8.562 -1.269 1.00 0.00 H new ATOM 0 HA LYS A 27 6.059 -6.229 -2.722 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.916 -8.016 -0.776 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.033 -6.411 -0.083 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.904 -6.498 -1.116 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.898 -5.527 -2.184 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.592 -7.096 -3.507 1.00 0.00 H new ATOM 0 HD3 LYS A 27 4.291 -7.508 -3.631 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.881 -9.514 -3.332 1.00 0.00 H new ATOM 0 HE3 LYS A 27 4.028 -9.325 -2.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.754 -9.917 -1.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.318 -8.474 -0.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.197 -8.421 -1.878 1.00 0.00 H new ATOM 457 N GLU A 28 7.595 -4.729 -1.535 1.00 0.00 N ATOM 458 CA GLU A 28 8.490 -3.796 -0.887 1.00 0.00 C ATOM 459 C GLU A 28 7.931 -2.391 -0.999 1.00 0.00 C ATOM 460 O GLU A 28 7.273 -2.057 -1.984 1.00 0.00 O ATOM 461 CB GLU A 28 9.872 -3.847 -1.535 1.00 0.00 C ATOM 462 CG GLU A 28 10.457 -5.245 -1.611 1.00 0.00 C ATOM 463 CD GLU A 28 11.849 -5.259 -2.196 1.00 0.00 C ATOM 464 OE1 GLU A 28 12.811 -5.029 -1.439 1.00 0.00 O ATOM 465 OE2 GLU A 28 11.989 -5.497 -3.416 1.00 0.00 O ATOM 0 H GLU A 28 7.287 -4.436 -2.462 1.00 0.00 H new ATOM 0 HA GLU A 28 8.582 -4.071 0.164 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.807 -3.434 -2.542 1.00 0.00 H new ATOM 0 HB3 GLU A 28 10.552 -3.208 -0.972 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.482 -5.680 -0.612 1.00 0.00 H new ATOM 0 HG3 GLU A 28 9.806 -5.875 -2.216 1.00 0.00 H new ATOM 472 N ILE A 29 8.179 -1.578 0.008 1.00 0.00 N ATOM 473 CA ILE A 29 7.741 -0.195 -0.007 1.00 0.00 C ATOM 474 C ILE A 29 8.954 0.720 -0.099 1.00 0.00 C ATOM 475 O ILE A 29 9.829 0.697 0.771 1.00 0.00 O ATOM 476 CB ILE A 29 6.909 0.142 1.247 1.00 0.00 C ATOM 477 CG1 ILE A 29 5.747 -0.850 1.384 1.00 0.00 C ATOM 478 CG2 ILE A 29 6.391 1.573 1.168 1.00 0.00 C ATOM 479 CD1 ILE A 29 4.924 -0.665 2.640 1.00 0.00 C ATOM 0 H ILE A 29 8.684 -1.852 0.851 1.00 0.00 H new ATOM 0 HA ILE A 29 7.103 -0.043 -0.877 1.00 0.00 H new ATOM 0 HB ILE A 29 7.544 0.058 2.129 1.00 0.00 H new ATOM 0 HG12 ILE A 29 5.094 -0.751 0.517 1.00 0.00 H new ATOM 0 HG13 ILE A 29 6.145 -1.865 1.369 1.00 0.00 H new ATOM 0 HG21 ILE A 29 5.805 1.798 2.059 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.233 2.262 1.104 1.00 0.00 H new ATOM 0 HG23 ILE A 29 5.763 1.684 0.284 1.00 0.00 H new ATOM 0 HD11 ILE A 29 4.123 -1.404 2.662 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.561 -0.794 3.515 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.494 0.337 2.649 1.00 0.00 H new ATOM 491 N ASN A 30 9.022 1.501 -1.163 1.00 0.00 N ATOM 492 CA ASN A 30 10.194 2.324 -1.432 1.00 0.00 C ATOM 493 C ASN A 30 9.784 3.704 -1.908 1.00 0.00 C ATOM 494 O ASN A 30 8.594 4.006 -2.031 1.00 0.00 O ATOM 495 CB ASN A 30 11.081 1.673 -2.507 1.00 0.00 C ATOM 496 CG ASN A 30 11.511 0.257 -2.165 1.00 0.00 C ATOM 497 OD1 ASN A 30 12.509 0.046 -1.480 1.00 0.00 O ATOM 498 ND2 ASN A 30 10.775 -0.724 -2.663 1.00 0.00 N ATOM 0 H ASN A 30 8.279 1.584 -1.857 1.00 0.00 H new ATOM 0 HA ASN A 30 10.754 2.412 -0.501 1.00 0.00 H new ATOM 0 HB2 ASN A 30 10.541 1.661 -3.454 1.00 0.00 H new ATOM 0 HB3 ASN A 30 11.969 2.288 -2.655 1.00 0.00 H new ATOM 0 HD21 ASN A 30 11.030 -1.695 -2.482 1.00 0.00 H new ATOM 0 HD22 ASN A 30 9.953 -0.509 -3.227 1.00 0.00 H new ATOM 505 N ARG A 31 10.776 4.543 -2.153 1.00 0.00 N ATOM 506 CA ARG A 31 10.564 5.804 -2.830 1.00 0.00 C ATOM 507 C ARG A 31 11.299 5.772 -4.156 1.00 0.00 C ATOM 508 O ARG A 31 12.206 4.952 -4.342 1.00 0.00 O ATOM 509 CB ARG A 31 11.031 6.994 -1.984 1.00 0.00 C ATOM 510 CG ARG A 31 10.161 7.251 -0.763 1.00 0.00 C ATOM 511 CD ARG A 31 10.353 8.659 -0.225 1.00 0.00 C ATOM 512 NE ARG A 31 11.684 8.876 0.335 1.00 0.00 N ATOM 513 CZ ARG A 31 12.426 9.952 0.090 1.00 0.00 C ATOM 514 NH1 ARG A 31 11.993 10.888 -0.748 1.00 0.00 N ATOM 515 NH2 ARG A 31 13.609 10.095 0.675 1.00 0.00 N ATOM 0 H ARG A 31 11.745 4.368 -1.888 1.00 0.00 H new ATOM 0 HA ARG A 31 9.495 5.937 -2.996 1.00 0.00 H new ATOM 0 HB2 ARG A 31 12.056 6.818 -1.659 1.00 0.00 H new ATOM 0 HB3 ARG A 31 11.043 7.889 -2.606 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.113 7.100 -1.024 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.403 6.527 0.015 1.00 0.00 H new ATOM 0 HD2 ARG A 31 10.181 9.376 -1.028 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.605 8.854 0.543 1.00 0.00 H new ATOM 0 HE ARG A 31 12.068 8.159 0.951 1.00 0.00 H new ATOM 0 HH11 ARG A 31 11.088 10.783 -1.206 1.00 0.00 H new ATOM 0 HH12 ARG A 31 12.566 11.712 -0.933 1.00 0.00 H new ATOM 0 HH21 ARG A 31 13.952 9.378 1.315 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.175 10.922 0.485 1.00 0.00 H new ATOM 529 N VAL A 32 10.885 6.620 -5.088 1.00 0.00 N ATOM 530 CA VAL A 32 11.504 6.659 -6.407 1.00 0.00 C ATOM 531 C VAL A 32 11.530 8.083 -6.958 1.00 0.00 C ATOM 532 O VAL A 32 10.489 8.738 -7.047 1.00 0.00 O ATOM 533 CB VAL A 32 10.739 5.778 -7.430 1.00 0.00 C ATOM 534 CG1 VAL A 32 11.511 5.673 -8.737 1.00 0.00 C ATOM 535 CG2 VAL A 32 10.435 4.394 -6.879 1.00 0.00 C ATOM 0 H VAL A 32 10.126 7.288 -4.956 1.00 0.00 H new ATOM 0 HA VAL A 32 12.517 6.279 -6.277 1.00 0.00 H new ATOM 0 HB VAL A 32 9.785 6.268 -7.624 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.956 5.051 -9.439 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.645 6.668 -9.162 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.487 5.225 -8.548 1.00 0.00 H new ATOM 0 HG21 VAL A 32 9.899 3.813 -7.630 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.368 3.889 -6.628 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.820 4.486 -5.984 1.00 0.00 H new ATOM 545 N SER A 33 12.713 8.562 -7.318 1.00 0.00 N ATOM 546 CA SER A 33 12.832 9.818 -8.041 1.00 0.00 C ATOM 547 C SER A 33 12.534 9.589 -9.518 1.00 0.00 C ATOM 548 O SER A 33 13.067 8.662 -10.131 1.00 0.00 O ATOM 549 CB SER A 33 14.235 10.412 -7.875 1.00 0.00 C ATOM 550 OG SER A 33 14.511 10.708 -6.517 1.00 0.00 O ATOM 0 H SER A 33 13.601 8.100 -7.121 1.00 0.00 H new ATOM 0 HA SER A 33 12.111 10.525 -7.630 1.00 0.00 H new ATOM 0 HB2 SER A 33 14.977 9.709 -8.254 1.00 0.00 H new ATOM 0 HB3 SER A 33 14.321 11.320 -8.472 1.00 0.00 H new ATOM 0 HG SER A 33 14.897 9.919 -6.082 1.00 0.00 H new ATOM 556 N PHE A 34 11.674 10.419 -10.083 1.00 0.00 N ATOM 557 CA PHE A 34 11.292 10.287 -11.481 1.00 0.00 C ATOM 558 C PHE A 34 11.769 11.489 -12.282 1.00 0.00 C ATOM 559 O PHE A 34 12.008 12.558 -11.725 1.00 0.00 O ATOM 560 CB PHE A 34 9.773 10.147 -11.622 1.00 0.00 C ATOM 561 CG PHE A 34 9.214 8.883 -11.034 1.00 0.00 C ATOM 562 CD1 PHE A 34 9.288 7.689 -11.733 1.00 0.00 C ATOM 563 CD2 PHE A 34 8.605 8.891 -9.790 1.00 0.00 C ATOM 564 CE1 PHE A 34 8.765 6.526 -11.205 1.00 0.00 C ATOM 565 CE2 PHE A 34 8.082 7.730 -9.253 1.00 0.00 C ATOM 566 CZ PHE A 34 8.162 6.546 -9.962 1.00 0.00 C ATOM 0 H PHE A 34 11.225 11.194 -9.595 1.00 0.00 H new ATOM 0 HA PHE A 34 11.766 9.386 -11.871 1.00 0.00 H new ATOM 0 HB2 PHE A 34 9.295 11.000 -11.142 1.00 0.00 H new ATOM 0 HB3 PHE A 34 9.512 10.189 -12.679 1.00 0.00 H new ATOM 0 HD1 PHE A 34 9.761 7.668 -12.704 1.00 0.00 H new ATOM 0 HD2 PHE A 34 8.538 9.814 -9.234 1.00 0.00 H new ATOM 0 HE1 PHE A 34 8.827 5.603 -11.762 1.00 0.00 H new ATOM 0 HE2 PHE A 34 7.612 7.748 -8.281 1.00 0.00 H new ATOM 0 HZ PHE A 34 7.754 5.637 -9.545 1.00 0.00 H new ATOM 576 N ASN A 35 11.943 11.298 -13.580 1.00 0.00 N ATOM 577 CA ASN A 35 12.255 12.403 -14.481 1.00 0.00 C ATOM 578 C ASN A 35 11.168 13.469 -14.401 1.00 0.00 C ATOM 579 O ASN A 35 10.062 13.277 -14.910 1.00 0.00 O ATOM 580 CB ASN A 35 12.382 11.902 -15.921 1.00 0.00 C ATOM 581 CG ASN A 35 12.683 13.015 -16.911 1.00 0.00 C ATOM 582 OD1 ASN A 35 13.842 13.341 -17.164 1.00 0.00 O ATOM 583 ND2 ASN A 35 11.642 13.603 -17.480 1.00 0.00 N ATOM 0 H ASN A 35 11.874 10.388 -14.036 1.00 0.00 H new ATOM 0 HA ASN A 35 13.207 12.838 -14.175 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.173 11.154 -15.971 1.00 0.00 H new ATOM 0 HB3 ASN A 35 11.456 11.406 -16.211 1.00 0.00 H new ATOM 0 HD21 ASN A 35 11.786 14.355 -18.154 1.00 0.00 H new ATOM 0 HD22 ASN A 35 10.696 13.304 -17.244 1.00 0.00 H new ATOM 590 N GLY A 36 11.481 14.574 -13.739 1.00 0.00 N ATOM 591 CA GLY A 36 10.526 15.654 -13.603 1.00 0.00 C ATOM 592 C GLY A 36 9.615 15.475 -12.405 1.00 0.00 C ATOM 593 O GLY A 36 8.588 16.141 -12.298 1.00 0.00 O ATOM 0 H GLY A 36 12.383 14.742 -13.292 1.00 0.00 H new ATOM 0 HA2 GLY A 36 11.062 16.599 -13.510 1.00 0.00 H new ATOM 0 HA3 GLY A 36 9.922 15.717 -14.508 1.00 0.00 H new ATOM 597 N ALA A 37 9.992 14.584 -11.499 1.00 0.00 N ATOM 598 CA ALA A 37 9.194 14.324 -10.308 1.00 0.00 C ATOM 599 C ALA A 37 10.087 13.968 -9.122 1.00 0.00 C ATOM 600 O ALA A 37 11.065 13.237 -9.273 1.00 0.00 O ATOM 601 CB ALA A 37 8.198 13.203 -10.573 1.00 0.00 C ATOM 0 H ALA A 37 10.845 14.029 -11.565 1.00 0.00 H new ATOM 0 HA ALA A 37 8.644 15.232 -10.062 1.00 0.00 H new ATOM 0 HB1 ALA A 37 7.609 13.020 -9.674 1.00 0.00 H new ATOM 0 HB2 ALA A 37 7.535 13.491 -11.389 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.736 12.295 -10.845 1.00 0.00 H new ATOM 607 N PRO A 38 9.770 14.493 -7.928 1.00 0.00 N ATOM 608 CA PRO A 38 10.519 14.177 -6.706 1.00 0.00 C ATOM 609 C PRO A 38 10.353 12.714 -6.298 1.00 0.00 C ATOM 610 O PRO A 38 9.471 12.021 -6.808 1.00 0.00 O ATOM 611 CB PRO A 38 9.897 15.104 -5.654 1.00 0.00 C ATOM 612 CG PRO A 38 8.538 15.417 -6.176 1.00 0.00 C ATOM 613 CD PRO A 38 8.667 15.436 -7.673 1.00 0.00 C ATOM 0 HA PRO A 38 11.592 14.321 -6.832 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.844 14.617 -4.680 1.00 0.00 H new ATOM 0 HB3 PRO A 38 10.489 16.010 -5.526 1.00 0.00 H new ATOM 0 HG2 PRO A 38 7.814 14.668 -5.856 1.00 0.00 H new ATOM 0 HG3 PRO A 38 8.188 16.379 -5.802 1.00 0.00 H new ATOM 0 HD2 PRO A 38 7.745 15.119 -8.161 1.00 0.00 H new ATOM 0 HD3 PRO A 38 8.897 16.435 -8.045 1.00 0.00 H new ATOM 621 N ALA A 39 11.201 12.254 -5.384 1.00 0.00 N ATOM 622 CA ALA A 39 11.147 10.876 -4.908 1.00 0.00 C ATOM 623 C ALA A 39 9.858 10.614 -4.132 1.00 0.00 C ATOM 624 O ALA A 39 9.764 10.902 -2.934 1.00 0.00 O ATOM 625 CB ALA A 39 12.363 10.557 -4.051 1.00 0.00 C ATOM 0 H ALA A 39 11.936 12.817 -4.957 1.00 0.00 H new ATOM 0 HA ALA A 39 11.156 10.219 -5.777 1.00 0.00 H new ATOM 0 HB1 ALA A 39 12.304 9.525 -3.706 1.00 0.00 H new ATOM 0 HB2 ALA A 39 13.269 10.691 -4.641 1.00 0.00 H new ATOM 0 HB3 ALA A 39 12.388 11.226 -3.191 1.00 0.00 H new ATOM 631 N LYS A 40 8.866 10.081 -4.834 1.00 0.00 N ATOM 632 CA LYS A 40 7.565 9.798 -4.248 1.00 0.00 C ATOM 633 C LYS A 40 7.496 8.346 -3.790 1.00 0.00 C ATOM 634 O LYS A 40 8.423 7.575 -4.024 1.00 0.00 O ATOM 635 CB LYS A 40 6.453 10.099 -5.255 1.00 0.00 C ATOM 636 CG LYS A 40 6.313 11.579 -5.574 1.00 0.00 C ATOM 637 CD LYS A 40 5.270 11.835 -6.650 1.00 0.00 C ATOM 638 CE LYS A 40 4.999 13.323 -6.810 1.00 0.00 C ATOM 639 NZ LYS A 40 4.072 13.609 -7.938 1.00 0.00 N ATOM 0 H LYS A 40 8.941 9.834 -5.821 1.00 0.00 H new ATOM 0 HA LYS A 40 7.425 10.440 -3.378 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.651 9.553 -6.177 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.506 9.728 -4.862 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.040 12.120 -4.668 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.276 11.972 -5.902 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.613 11.421 -7.598 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.345 11.320 -6.393 1.00 0.00 H new ATOM 0 HE2 LYS A 40 4.575 13.714 -5.885 1.00 0.00 H new ATOM 0 HE3 LYS A 40 5.941 13.846 -6.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 3.917 14.635 -8.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.487 13.260 -8.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 3.163 13.132 -7.770 1.00 0.00 H new ATOM 653 N PHE A 41 6.395 7.978 -3.146 1.00 0.00 N ATOM 654 CA PHE A 41 6.262 6.652 -2.557 1.00 0.00 C ATOM 655 C PHE A 41 5.687 5.660 -3.562 1.00 0.00 C ATOM 656 O PHE A 41 4.816 6.007 -4.359 1.00 0.00 O ATOM 657 CB PHE A 41 5.360 6.715 -1.321 1.00 0.00 C ATOM 658 CG PHE A 41 5.800 7.726 -0.299 1.00 0.00 C ATOM 659 CD1 PHE A 41 6.766 7.408 0.639 1.00 0.00 C ATOM 660 CD2 PHE A 41 5.241 8.995 -0.274 1.00 0.00 C ATOM 661 CE1 PHE A 41 7.169 8.332 1.583 1.00 0.00 C ATOM 662 CE2 PHE A 41 5.641 9.924 0.667 1.00 0.00 C ATOM 663 CZ PHE A 41 6.606 9.592 1.598 1.00 0.00 C ATOM 0 H PHE A 41 5.581 8.580 -3.019 1.00 0.00 H new ATOM 0 HA PHE A 41 7.255 6.311 -2.266 1.00 0.00 H new ATOM 0 HB2 PHE A 41 4.343 6.950 -1.636 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.330 5.730 -0.854 1.00 0.00 H new ATOM 0 HD1 PHE A 41 7.211 6.424 0.633 1.00 0.00 H new ATOM 0 HD2 PHE A 41 4.485 9.260 -0.998 1.00 0.00 H new ATOM 0 HE1 PHE A 41 7.924 8.069 2.309 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.199 10.910 0.675 1.00 0.00 H new ATOM 0 HZ PHE A 41 6.919 10.316 2.335 1.00 0.00 H new ATOM 673 N ASP A 42 6.180 4.430 -3.517 1.00 0.00 N ATOM 674 CA ASP A 42 5.697 3.376 -4.403 1.00 0.00 C ATOM 675 C ASP A 42 5.543 2.064 -3.638 1.00 0.00 C ATOM 676 O ASP A 42 6.484 1.602 -2.984 1.00 0.00 O ATOM 677 CB ASP A 42 6.663 3.184 -5.581 1.00 0.00 C ATOM 678 CG ASP A 42 6.194 2.134 -6.576 1.00 0.00 C ATOM 679 OD1 ASP A 42 6.430 0.930 -6.341 1.00 0.00 O ATOM 680 OD2 ASP A 42 5.620 2.510 -7.624 1.00 0.00 O ATOM 0 H ASP A 42 6.916 4.135 -2.875 1.00 0.00 H new ATOM 0 HA ASP A 42 4.722 3.673 -4.790 1.00 0.00 H new ATOM 0 HB2 ASP A 42 6.788 4.135 -6.098 1.00 0.00 H new ATOM 0 HB3 ASP A 42 7.642 2.899 -5.197 1.00 0.00 H new ATOM 685 N ILE A 43 4.348 1.488 -3.692 1.00 0.00 N ATOM 686 CA ILE A 43 4.101 0.176 -3.112 1.00 0.00 C ATOM 687 C ILE A 43 4.352 -0.869 -4.188 1.00 0.00 C ATOM 688 O ILE A 43 3.552 -1.018 -5.112 1.00 0.00 O ATOM 689 CB ILE A 43 2.655 0.039 -2.585 1.00 0.00 C ATOM 690 CG1 ILE A 43 2.298 1.208 -1.660 1.00 0.00 C ATOM 691 CG2 ILE A 43 2.475 -1.285 -1.857 1.00 0.00 C ATOM 692 CD1 ILE A 43 3.166 1.312 -0.422 1.00 0.00 C ATOM 0 H ILE A 43 3.532 1.912 -4.134 1.00 0.00 H new ATOM 0 HA ILE A 43 4.769 0.036 -2.262 1.00 0.00 H new ATOM 0 HB ILE A 43 1.980 0.061 -3.440 1.00 0.00 H new ATOM 0 HG12 ILE A 43 2.376 2.138 -2.223 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.257 1.108 -1.352 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.451 -1.364 -1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.681 -2.108 -2.542 1.00 0.00 H new ATOM 0 HG23 ILE A 43 3.164 -1.333 -1.014 1.00 0.00 H new ATOM 0 HD11 ILE A 43 2.846 2.165 0.176 1.00 0.00 H new ATOM 0 HD12 ILE A 43 3.071 0.400 0.167 1.00 0.00 H new ATOM 0 HD13 ILE A 43 4.207 1.446 -0.717 1.00 0.00 H new ATOM 704 N ARG A 44 5.449 -1.595 -4.072 1.00 0.00 N ATOM 705 CA ARG A 44 5.958 -2.351 -5.200 1.00 0.00 C ATOM 706 C ARG A 44 5.825 -3.854 -5.021 1.00 0.00 C ATOM 707 O ARG A 44 6.330 -4.437 -4.061 1.00 0.00 O ATOM 708 CB ARG A 44 7.424 -1.976 -5.446 1.00 0.00 C ATOM 709 CG ARG A 44 8.058 -2.666 -6.645 1.00 0.00 C ATOM 710 CD ARG A 44 7.288 -2.400 -7.930 1.00 0.00 C ATOM 711 NE ARG A 44 7.036 -0.976 -8.146 1.00 0.00 N ATOM 712 CZ ARG A 44 7.130 -0.374 -9.328 1.00 0.00 C ATOM 713 NH1 ARG A 44 7.561 -1.044 -10.393 1.00 0.00 N ATOM 714 NH2 ARG A 44 6.805 0.904 -9.438 1.00 0.00 N ATOM 0 H ARG A 44 5.999 -1.677 -3.217 1.00 0.00 H new ATOM 0 HA ARG A 44 5.349 -2.088 -6.065 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.492 -0.897 -5.586 1.00 0.00 H new ATOM 0 HB3 ARG A 44 8.003 -2.219 -4.555 1.00 0.00 H new ATOM 0 HG2 ARG A 44 9.085 -2.321 -6.760 1.00 0.00 H new ATOM 0 HG3 ARG A 44 8.101 -3.740 -6.464 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.849 -2.799 -8.775 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.338 -2.933 -7.898 1.00 0.00 H new ATOM 0 HE ARG A 44 6.772 -0.409 -7.340 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.822 -2.026 -10.306 1.00 0.00 H new ATOM 0 HH12 ARG A 44 7.630 -0.576 -11.296 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.485 1.421 -8.619 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.875 1.372 -10.342 1.00 0.00 H new ATOM 728 N ALA A 45 5.122 -4.455 -5.970 1.00 0.00 N ATOM 729 CA ALA A 45 5.064 -5.897 -6.110 1.00 0.00 C ATOM 730 C ALA A 45 5.675 -6.291 -7.444 1.00 0.00 C ATOM 731 O ALA A 45 5.124 -5.965 -8.498 1.00 0.00 O ATOM 732 CB ALA A 45 3.631 -6.390 -6.037 1.00 0.00 C ATOM 0 H ALA A 45 4.574 -3.950 -6.667 1.00 0.00 H new ATOM 0 HA ALA A 45 5.623 -6.354 -5.293 1.00 0.00 H new ATOM 0 HB1 ALA A 45 3.613 -7.475 -6.145 1.00 0.00 H new ATOM 0 HB2 ALA A 45 3.200 -6.114 -5.075 1.00 0.00 H new ATOM 0 HB3 ALA A 45 3.049 -5.936 -6.839 1.00 0.00 H new ATOM 738 N TRP A 46 6.815 -6.955 -7.408 1.00 0.00 N ATOM 739 CA TRP A 46 7.477 -7.358 -8.634 1.00 0.00 C ATOM 740 C TRP A 46 7.711 -8.861 -8.659 1.00 0.00 C ATOM 741 O TRP A 46 7.900 -9.495 -7.617 1.00 0.00 O ATOM 742 CB TRP A 46 8.786 -6.575 -8.847 1.00 0.00 C ATOM 743 CG TRP A 46 9.793 -6.688 -7.737 1.00 0.00 C ATOM 744 CD1 TRP A 46 9.736 -6.095 -6.504 1.00 0.00 C ATOM 745 CD2 TRP A 46 11.031 -7.406 -7.780 1.00 0.00 C ATOM 746 NE1 TRP A 46 10.856 -6.418 -5.775 1.00 0.00 N ATOM 747 CE2 TRP A 46 11.665 -7.222 -6.537 1.00 0.00 C ATOM 748 CE3 TRP A 46 11.663 -8.198 -8.745 1.00 0.00 C ATOM 749 CZ2 TRP A 46 12.897 -7.796 -6.238 1.00 0.00 C ATOM 750 CZ3 TRP A 46 12.886 -8.765 -8.447 1.00 0.00 C ATOM 751 CH2 TRP A 46 13.491 -8.563 -7.200 1.00 0.00 C ATOM 0 H TRP A 46 7.298 -7.225 -6.551 1.00 0.00 H new ATOM 0 HA TRP A 46 6.817 -7.115 -9.467 1.00 0.00 H new ATOM 0 HB2 TRP A 46 9.249 -6.920 -9.771 1.00 0.00 H new ATOM 0 HB3 TRP A 46 8.541 -5.522 -8.987 1.00 0.00 H new ATOM 0 HD1 TRP A 46 8.930 -5.466 -6.156 1.00 0.00 H new ATOM 0 HE1 TRP A 46 11.053 -6.110 -4.823 1.00 0.00 H new ATOM 0 HE3 TRP A 46 11.202 -8.363 -9.707 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 13.367 -7.640 -5.278 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 13.384 -9.374 -9.187 1.00 0.00 H new ATOM 0 HH2 TRP A 46 14.446 -9.023 -6.995 1.00 0.00 H new ATOM 762 N SER A 47 7.655 -9.425 -9.857 1.00 0.00 N ATOM 763 CA SER A 47 7.810 -10.858 -10.048 1.00 0.00 C ATOM 764 C SER A 47 9.282 -11.246 -9.953 1.00 0.00 C ATOM 765 O SER A 47 10.156 -10.467 -10.335 1.00 0.00 O ATOM 766 CB SER A 47 7.233 -11.259 -11.412 1.00 0.00 C ATOM 767 OG SER A 47 7.293 -12.663 -11.620 1.00 0.00 O ATOM 0 H SER A 47 7.501 -8.904 -10.720 1.00 0.00 H new ATOM 0 HA SER A 47 7.267 -11.387 -9.265 1.00 0.00 H new ATOM 0 HB2 SER A 47 6.197 -10.926 -11.480 1.00 0.00 H new ATOM 0 HB3 SER A 47 7.784 -10.751 -12.203 1.00 0.00 H new ATOM 0 HG SER A 47 6.915 -12.880 -12.498 1.00 0.00 H new ATOM 877 N LYS A 55 2.300 -4.808 -10.379 1.00 0.00 N ATOM 878 CA LYS A 55 1.107 -4.033 -10.052 1.00 0.00 C ATOM 879 C LYS A 55 1.409 -3.005 -8.971 1.00 0.00 C ATOM 880 O LYS A 55 0.523 -2.593 -8.221 1.00 0.00 O ATOM 881 CB LYS A 55 -0.016 -4.972 -9.609 1.00 0.00 C ATOM 882 CG LYS A 55 -0.342 -6.037 -10.643 1.00 0.00 C ATOM 883 CD LYS A 55 -0.743 -5.413 -11.972 1.00 0.00 C ATOM 884 CE LYS A 55 -0.903 -6.458 -13.066 1.00 0.00 C ATOM 885 NZ LYS A 55 -2.096 -7.321 -12.862 1.00 0.00 N ATOM 0 HA LYS A 55 0.784 -3.494 -10.943 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.270 -5.456 -8.675 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.912 -4.386 -9.404 1.00 0.00 H new ATOM 0 HG2 LYS A 55 0.524 -6.683 -10.789 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.152 -6.668 -10.276 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -1.680 -4.870 -11.850 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.011 -4.685 -12.273 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.981 -5.959 -14.032 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.010 -7.082 -13.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -2.159 -8.015 -13.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.012 -7.820 -11.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -2.953 -6.732 -12.855 1.00 0.00 H new ATOM 899 N GLY A 56 2.668 -2.591 -8.914 1.00 0.00 N ATOM 900 CA GLY A 56 3.084 -1.568 -7.973 1.00 0.00 C ATOM 901 C GLY A 56 2.350 -0.259 -8.191 1.00 0.00 C ATOM 902 O GLY A 56 2.129 0.148 -9.335 1.00 0.00 O ATOM 0 H GLY A 56 3.415 -2.949 -9.509 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.906 -1.918 -6.956 1.00 0.00 H new ATOM 0 HA3 GLY A 56 4.157 -1.402 -8.070 1.00 0.00 H new ATOM 906 N ILE A 57 1.971 0.398 -7.102 1.00 0.00 N ATOM 907 CA ILE A 57 1.178 1.618 -7.177 1.00 0.00 C ATOM 908 C ILE A 57 1.843 2.760 -6.406 1.00 0.00 C ATOM 909 O ILE A 57 2.328 2.575 -5.287 1.00 0.00 O ATOM 910 CB ILE A 57 -0.261 1.383 -6.649 1.00 0.00 C ATOM 911 CG1 ILE A 57 -1.098 2.666 -6.752 1.00 0.00 C ATOM 912 CG2 ILE A 57 -0.239 0.869 -5.214 1.00 0.00 C ATOM 913 CD1 ILE A 57 -2.544 2.486 -6.339 1.00 0.00 C ATOM 0 H ILE A 57 2.201 0.105 -6.153 1.00 0.00 H new ATOM 0 HA ILE A 57 1.118 1.902 -8.228 1.00 0.00 H new ATOM 0 HB ILE A 57 -0.726 0.621 -7.274 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.644 3.436 -6.128 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -1.066 3.029 -7.779 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.261 0.712 -4.868 1.00 0.00 H new ATOM 0 HG22 ILE A 57 0.306 -0.074 -5.174 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.253 1.600 -4.573 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.072 3.435 -6.438 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.015 1.740 -6.979 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.587 2.154 -5.302 1.00 0.00 H new ATOM 925 N THR A 58 1.874 3.937 -7.020 1.00 0.00 N ATOM 926 CA THR A 58 2.491 5.104 -6.415 1.00 0.00 C ATOM 927 C THR A 58 1.529 5.821 -5.468 1.00 0.00 C ATOM 928 O THR A 58 0.322 5.911 -5.734 1.00 0.00 O ATOM 929 CB THR A 58 2.971 6.088 -7.498 1.00 0.00 C ATOM 930 OG1 THR A 58 1.987 6.184 -8.541 1.00 0.00 O ATOM 931 CG2 THR A 58 4.299 5.645 -8.088 1.00 0.00 C ATOM 0 H THR A 58 1.475 4.106 -7.943 1.00 0.00 H new ATOM 0 HA THR A 58 3.347 4.753 -5.838 1.00 0.00 H new ATOM 0 HB THR A 58 3.109 7.064 -7.034 1.00 0.00 H new ATOM 0 HG1 THR A 58 2.297 6.812 -9.226 1.00 0.00 H new ATOM 0 HG21 THR A 58 4.614 6.358 -8.850 1.00 0.00 H new ATOM 0 HG22 THR A 58 5.050 5.600 -7.300 1.00 0.00 H new ATOM 0 HG23 THR A 58 4.186 4.659 -8.538 1.00 0.00 H new ATOM 939 N LEU A 59 2.067 6.327 -4.364 1.00 0.00 N ATOM 940 CA LEU A 59 1.279 7.064 -3.385 1.00 0.00 C ATOM 941 C LEU A 59 1.889 8.442 -3.151 1.00 0.00 C ATOM 942 O LEU A 59 3.113 8.586 -3.078 1.00 0.00 O ATOM 943 CB LEU A 59 1.207 6.305 -2.055 1.00 0.00 C ATOM 944 CG LEU A 59 0.575 4.911 -2.118 1.00 0.00 C ATOM 945 CD1 LEU A 59 0.574 4.268 -0.741 1.00 0.00 C ATOM 946 CD2 LEU A 59 -0.840 4.985 -2.660 1.00 0.00 C ATOM 0 H LEU A 59 3.054 6.239 -4.124 1.00 0.00 H new ATOM 0 HA LEU A 59 0.269 7.174 -3.779 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.218 6.208 -1.658 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.642 6.908 -1.344 1.00 0.00 H new ATOM 0 HG LEU A 59 1.171 4.298 -2.793 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.122 3.278 -0.802 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.599 4.177 -0.381 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.001 4.887 -0.051 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.269 3.984 -2.696 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.446 5.616 -2.010 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.823 5.409 -3.664 1.00 0.00 H new ATOM 958 N SER A 60 1.038 9.449 -3.053 1.00 0.00 N ATOM 959 CA SER A 60 1.487 10.799 -2.759 1.00 0.00 C ATOM 960 C SER A 60 1.629 10.980 -1.247 1.00 0.00 C ATOM 961 O SER A 60 1.244 10.097 -0.478 1.00 0.00 O ATOM 962 CB SER A 60 0.499 11.819 -3.341 1.00 0.00 C ATOM 963 OG SER A 60 0.964 13.148 -3.171 1.00 0.00 O ATOM 0 H SER A 60 0.029 9.357 -3.173 1.00 0.00 H new ATOM 0 HA SER A 60 2.461 10.965 -3.220 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.349 11.618 -4.402 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.470 11.707 -2.855 1.00 0.00 H new ATOM 0 HG SER A 60 0.314 13.774 -3.553 1.00 0.00 H new ATOM 969 N ASN A 61 2.178 12.117 -0.828 1.00 0.00 N ATOM 970 CA ASN A 61 2.390 12.396 0.593 1.00 0.00 C ATOM 971 C ASN A 61 1.073 12.323 1.361 1.00 0.00 C ATOM 972 O ASN A 61 0.982 11.652 2.388 1.00 0.00 O ATOM 973 CB ASN A 61 3.032 13.776 0.778 1.00 0.00 C ATOM 974 CG ASN A 61 3.251 14.133 2.241 1.00 0.00 C ATOM 975 OD1 ASN A 61 2.384 14.721 2.888 1.00 0.00 O ATOM 976 ND2 ASN A 61 4.420 13.796 2.767 1.00 0.00 N ATOM 0 H ASN A 61 2.485 12.863 -1.452 1.00 0.00 H new ATOM 0 HA ASN A 61 3.065 11.638 0.991 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.988 13.800 0.256 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.397 14.532 0.315 1.00 0.00 H new ATOM 0 HD21 ASN A 61 4.626 14.023 3.740 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.113 13.309 2.199 1.00 0.00 H new ATOM 983 N GLU A 62 0.063 13.011 0.840 1.00 0.00 N ATOM 984 CA GLU A 62 -1.279 13.013 1.420 1.00 0.00 C ATOM 985 C GLU A 62 -1.778 11.591 1.664 1.00 0.00 C ATOM 986 O GLU A 62 -2.149 11.225 2.783 1.00 0.00 O ATOM 987 CB GLU A 62 -2.234 13.731 0.463 1.00 0.00 C ATOM 988 CG GLU A 62 -3.663 13.850 0.961 1.00 0.00 C ATOM 989 CD GLU A 62 -4.596 14.379 -0.110 1.00 0.00 C ATOM 990 OE1 GLU A 62 -4.323 15.470 -0.659 1.00 0.00 O ATOM 991 OE2 GLU A 62 -5.594 13.702 -0.425 1.00 0.00 O ATOM 0 H GLU A 62 0.150 13.585 0.001 1.00 0.00 H new ATOM 0 HA GLU A 62 -1.243 13.529 2.379 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.847 14.731 0.269 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.239 13.201 -0.489 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.013 12.873 1.296 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.691 14.513 1.826 1.00 0.00 H new ATOM 998 N GLU A 63 -1.753 10.794 0.608 1.00 0.00 N ATOM 999 CA GLU A 63 -2.288 9.443 0.638 1.00 0.00 C ATOM 1000 C GLU A 63 -1.477 8.550 1.577 1.00 0.00 C ATOM 1001 O GLU A 63 -2.035 7.812 2.391 1.00 0.00 O ATOM 1002 CB GLU A 63 -2.273 8.861 -0.778 1.00 0.00 C ATOM 1003 CG GLU A 63 -2.850 9.806 -1.822 1.00 0.00 C ATOM 1004 CD GLU A 63 -2.689 9.287 -3.234 1.00 0.00 C ATOM 1005 OE1 GLU A 63 -1.549 8.954 -3.625 1.00 0.00 O ATOM 1006 OE2 GLU A 63 -3.695 9.202 -3.964 1.00 0.00 O ATOM 0 H GLU A 63 -1.361 11.066 -0.294 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.311 9.482 1.011 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.247 8.612 -1.050 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.840 7.930 -0.787 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -3.909 9.965 -1.616 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.360 10.776 -1.738 1.00 0.00 H new ATOM 1013 N PHE A 64 -0.158 8.642 1.469 1.00 0.00 N ATOM 1014 CA PHE A 64 0.741 7.780 2.223 1.00 0.00 C ATOM 1015 C PHE A 64 0.663 8.083 3.718 1.00 0.00 C ATOM 1016 O PHE A 64 0.603 7.170 4.543 1.00 0.00 O ATOM 1017 CB PHE A 64 2.171 7.962 1.716 1.00 0.00 C ATOM 1018 CG PHE A 64 3.083 6.812 2.032 1.00 0.00 C ATOM 1019 CD1 PHE A 64 3.081 5.677 1.240 1.00 0.00 C ATOM 1020 CD2 PHE A 64 3.946 6.870 3.111 1.00 0.00 C ATOM 1021 CE1 PHE A 64 3.922 4.620 1.517 1.00 0.00 C ATOM 1022 CE2 PHE A 64 4.790 5.816 3.395 1.00 0.00 C ATOM 1023 CZ PHE A 64 4.777 4.690 2.597 1.00 0.00 C ATOM 0 H PHE A 64 0.315 9.311 0.861 1.00 0.00 H new ATOM 0 HA PHE A 64 0.437 6.744 2.076 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.147 8.107 0.636 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.586 8.871 2.150 1.00 0.00 H new ATOM 0 HD1 PHE A 64 2.412 5.618 0.394 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.960 7.749 3.738 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.911 3.740 0.890 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.460 5.872 4.240 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.436 3.864 2.818 1.00 0.00 H new ATOM 1033 N GLN A 65 0.648 9.369 4.060 1.00 0.00 N ATOM 1034 CA GLN A 65 0.570 9.789 5.457 1.00 0.00 C ATOM 1035 C GLN A 65 -0.755 9.349 6.074 1.00 0.00 C ATOM 1036 O GLN A 65 -0.798 8.889 7.220 1.00 0.00 O ATOM 1037 CB GLN A 65 0.722 11.310 5.569 1.00 0.00 C ATOM 1038 CG GLN A 65 0.721 11.829 7.001 1.00 0.00 C ATOM 1039 CD GLN A 65 1.856 11.259 7.829 1.00 0.00 C ATOM 1040 OE1 GLN A 65 2.950 11.815 7.872 1.00 0.00 O ATOM 1041 NE2 GLN A 65 1.601 10.142 8.493 1.00 0.00 N ATOM 0 H GLN A 65 0.689 10.137 3.390 1.00 0.00 H new ATOM 0 HA GLN A 65 1.385 9.314 6.003 1.00 0.00 H new ATOM 0 HB2 GLN A 65 1.652 11.608 5.086 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -0.090 11.787 5.020 1.00 0.00 H new ATOM 0 HG2 GLN A 65 0.795 12.916 6.989 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -0.229 11.579 7.473 1.00 0.00 H new ATOM 0 HE21 GLN A 65 0.679 9.711 8.431 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.327 9.713 9.067 1.00 0.00 H new ATOM 1050 N THR A 66 -1.827 9.487 5.299 1.00 0.00 N ATOM 1051 CA THR A 66 -3.151 9.048 5.727 1.00 0.00 C ATOM 1052 C THR A 66 -3.137 7.557 6.066 1.00 0.00 C ATOM 1053 O THR A 66 -3.653 7.143 7.105 1.00 0.00 O ATOM 1054 CB THR A 66 -4.201 9.330 4.631 1.00 0.00 C ATOM 1055 OG1 THR A 66 -4.246 10.734 4.357 1.00 0.00 O ATOM 1056 CG2 THR A 66 -5.583 8.845 5.045 1.00 0.00 C ATOM 0 H THR A 66 -1.804 9.901 4.367 1.00 0.00 H new ATOM 0 HA THR A 66 -3.421 9.610 6.621 1.00 0.00 H new ATOM 0 HB THR A 66 -3.907 8.786 3.734 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.606 10.949 3.646 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.297 9.060 4.250 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.553 7.770 5.225 1.00 0.00 H new ATOM 0 HG23 THR A 66 -5.890 9.357 5.957 1.00 0.00 H new ATOM 1064 N MET A 67 -2.520 6.769 5.189 1.00 0.00 N ATOM 1065 CA MET A 67 -2.403 5.324 5.379 1.00 0.00 C ATOM 1066 C MET A 67 -1.738 4.997 6.715 1.00 0.00 C ATOM 1067 O MET A 67 -2.291 4.265 7.535 1.00 0.00 O ATOM 1068 CB MET A 67 -1.579 4.707 4.240 1.00 0.00 C ATOM 1069 CG MET A 67 -1.338 3.214 4.398 1.00 0.00 C ATOM 1070 SD MET A 67 -0.186 2.549 3.182 1.00 0.00 S ATOM 1071 CE MET A 67 1.340 3.328 3.710 1.00 0.00 C ATOM 0 H MET A 67 -2.089 7.111 4.330 1.00 0.00 H new ATOM 0 HA MET A 67 -3.409 4.904 5.376 1.00 0.00 H new ATOM 0 HB2 MET A 67 -2.092 4.885 3.295 1.00 0.00 H new ATOM 0 HB3 MET A 67 -0.617 5.217 4.182 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.953 3.018 5.399 1.00 0.00 H new ATOM 0 HG3 MET A 67 -2.289 2.688 4.314 1.00 0.00 H new ATOM 0 HE1 MET A 67 2.189 2.772 3.312 1.00 0.00 H new ATOM 0 HE2 MET A 67 1.372 4.353 3.340 1.00 0.00 H new ATOM 0 HE3 MET A 67 1.388 3.334 4.799 1.00 0.00 H new ATOM 1081 N VAL A 68 -0.559 5.571 6.922 1.00 0.00 N ATOM 1082 CA VAL A 68 0.272 5.267 8.081 1.00 0.00 C ATOM 1083 C VAL A 68 -0.463 5.467 9.406 1.00 0.00 C ATOM 1084 O VAL A 68 -0.610 4.526 10.190 1.00 0.00 O ATOM 1085 CB VAL A 68 1.550 6.132 8.076 1.00 0.00 C ATOM 1086 CG1 VAL A 68 2.321 5.979 9.384 1.00 0.00 C ATOM 1087 CG2 VAL A 68 2.429 5.765 6.890 1.00 0.00 C ATOM 0 H VAL A 68 -0.152 6.261 6.291 1.00 0.00 H new ATOM 0 HA VAL A 68 0.533 4.212 8.000 1.00 0.00 H new ATOM 0 HB VAL A 68 1.255 7.177 7.982 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.217 6.599 9.353 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.691 6.292 10.216 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.607 4.936 9.518 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.327 6.382 6.898 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.710 4.714 6.957 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.880 5.935 5.964 1.00 0.00 H new ATOM 1097 N ASP A 69 -0.935 6.683 9.643 1.00 0.00 N ATOM 1098 CA ASP A 69 -1.483 7.037 10.947 1.00 0.00 C ATOM 1099 C ASP A 69 -2.823 6.348 11.197 1.00 0.00 C ATOM 1100 O ASP A 69 -3.166 6.033 12.342 1.00 0.00 O ATOM 1101 CB ASP A 69 -1.629 8.550 11.070 1.00 0.00 C ATOM 1102 CG ASP A 69 -1.982 8.980 12.479 1.00 0.00 C ATOM 1103 OD1 ASP A 69 -1.228 8.651 13.418 1.00 0.00 O ATOM 1104 OD2 ASP A 69 -3.006 9.674 12.653 1.00 0.00 O ATOM 0 H ASP A 69 -0.950 7.437 8.956 1.00 0.00 H new ATOM 0 HA ASP A 69 -0.784 6.688 11.707 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.697 9.029 10.769 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -2.401 8.896 10.383 1.00 0.00 H new ATOM 1109 N ALA A 70 -3.568 6.092 10.127 1.00 0.00 N ATOM 1110 CA ALA A 70 -4.846 5.405 10.241 1.00 0.00 C ATOM 1111 C ALA A 70 -4.648 4.009 10.821 1.00 0.00 C ATOM 1112 O ALA A 70 -5.212 3.674 11.859 1.00 0.00 O ATOM 1113 CB ALA A 70 -5.539 5.325 8.890 1.00 0.00 C ATOM 0 H ALA A 70 -3.309 6.350 9.175 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.482 5.977 10.917 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.492 4.808 9.000 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -5.714 6.332 8.511 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -4.908 4.778 8.189 1.00 0.00 H new ATOM 1119 N PHE A 71 -3.815 3.211 10.165 1.00 0.00 N ATOM 1120 CA PHE A 71 -3.564 1.845 10.609 1.00 0.00 C ATOM 1121 C PHE A 71 -2.821 1.829 11.937 1.00 0.00 C ATOM 1122 O PHE A 71 -2.982 0.901 12.734 1.00 0.00 O ATOM 1123 CB PHE A 71 -2.773 1.075 9.561 1.00 0.00 C ATOM 1124 CG PHE A 71 -3.521 0.875 8.278 1.00 0.00 C ATOM 1125 CD1 PHE A 71 -4.708 0.163 8.255 1.00 0.00 C ATOM 1126 CD2 PHE A 71 -3.037 1.398 7.098 1.00 0.00 C ATOM 1127 CE1 PHE A 71 -5.394 -0.025 7.072 1.00 0.00 C ATOM 1128 CE2 PHE A 71 -3.716 1.215 5.915 1.00 0.00 C ATOM 1129 CZ PHE A 71 -4.896 0.506 5.901 1.00 0.00 C ATOM 0 H PHE A 71 -3.303 3.484 9.326 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.530 1.359 10.748 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -1.845 1.608 9.353 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.497 0.102 9.967 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -5.101 -0.250 9.172 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.114 1.958 7.102 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.317 -0.586 7.064 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -3.323 1.628 4.998 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.431 0.366 4.973 1.00 0.00 H new ATOM 1139 N LYS A 72 -2.017 2.862 12.167 1.00 0.00 N ATOM 1140 CA LYS A 72 -1.298 3.025 13.423 1.00 0.00 C ATOM 1141 C LYS A 72 -2.264 2.971 14.605 1.00 0.00 C ATOM 1142 O LYS A 72 -1.978 2.347 15.628 1.00 0.00 O ATOM 1143 CB LYS A 72 -0.537 4.357 13.417 1.00 0.00 C ATOM 1144 CG LYS A 72 0.231 4.645 14.695 1.00 0.00 C ATOM 1145 CD LYS A 72 0.906 6.008 14.637 1.00 0.00 C ATOM 1146 CE LYS A 72 1.654 6.325 15.921 1.00 0.00 C ATOM 1147 NZ LYS A 72 2.271 7.680 15.883 1.00 0.00 N ATOM 0 H LYS A 72 -1.847 3.606 11.490 1.00 0.00 H new ATOM 0 HA LYS A 72 -0.584 2.208 13.528 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.161 4.359 12.580 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.246 5.166 13.243 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.448 4.609 15.547 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.982 3.871 14.853 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.600 6.034 13.797 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.156 6.777 14.455 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.968 6.262 16.766 1.00 0.00 H new ATOM 0 HE3 LYS A 72 2.430 5.577 16.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.502 7.984 16.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 3.140 7.650 15.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.602 8.354 15.459 1.00 0.00 H new ATOM 1161 N GLY A 73 -3.416 3.612 14.447 1.00 0.00 N ATOM 1162 CA GLY A 73 -4.414 3.603 15.499 1.00 0.00 C ATOM 1163 C GLY A 73 -5.450 2.507 15.330 1.00 0.00 C ATOM 1164 O GLY A 73 -6.018 2.025 16.310 1.00 0.00 O ATOM 0 H GLY A 73 -3.676 4.136 13.612 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.917 3.479 16.461 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -4.917 4.570 15.522 1.00 0.00 H new ATOM 1168 N ASN A 74 -5.699 2.108 14.088 1.00 0.00 N ATOM 1169 CA ASN A 74 -6.746 1.129 13.794 1.00 0.00 C ATOM 1170 C ASN A 74 -6.251 -0.311 13.896 1.00 0.00 C ATOM 1171 O ASN A 74 -6.694 -1.054 14.771 1.00 0.00 O ATOM 1172 CB ASN A 74 -7.341 1.369 12.404 1.00 0.00 C ATOM 1173 CG ASN A 74 -8.363 2.490 12.391 1.00 0.00 C ATOM 1174 OD1 ASN A 74 -8.026 3.663 12.231 1.00 0.00 O ATOM 1175 ND2 ASN A 74 -9.625 2.135 12.556 1.00 0.00 N ATOM 0 H ASN A 74 -5.193 2.445 13.269 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.517 1.268 14.552 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.538 1.606 11.706 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -7.810 0.451 12.050 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -10.359 2.844 12.554 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -9.866 1.152 12.686 1.00 0.00 H new ATOM 1182 N LEU A 75 -5.341 -0.708 13.007 1.00 0.00 N ATOM 1183 CA LEU A 75 -4.931 -2.111 12.916 1.00 0.00 C ATOM 1184 C LEU A 75 -4.142 -2.543 14.145 1.00 0.00 C ATOM 1185 O LEU A 75 -4.284 -3.673 14.613 1.00 0.00 O ATOM 1186 CB LEU A 75 -4.105 -2.384 11.651 1.00 0.00 C ATOM 1187 CG LEU A 75 -3.797 -3.869 11.405 1.00 0.00 C ATOM 1188 CD1 LEU A 75 -5.083 -4.660 11.265 1.00 0.00 C ATOM 1189 CD2 LEU A 75 -2.930 -4.058 10.169 1.00 0.00 C ATOM 0 H LEU A 75 -4.877 -0.086 12.345 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.848 -2.698 12.863 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.642 -1.989 10.789 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.165 -1.837 11.720 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.243 -4.240 12.267 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.847 -5.710 11.091 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.669 -4.566 12.179 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.658 -4.273 10.424 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.731 -5.120 10.023 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.450 -3.663 9.296 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.988 -3.527 10.301 1.00 0.00 H new ATOM 1201 N GLU A 76 -3.308 -1.657 14.667 1.00 0.00 N ATOM 1202 CA GLU A 76 -2.531 -1.992 15.843 1.00 0.00 C ATOM 1203 C GLU A 76 -3.378 -1.854 17.096 1.00 0.00 C ATOM 1204 O GLU A 76 -3.590 -0.753 17.607 1.00 0.00 O ATOM 1205 CB GLU A 76 -1.273 -1.133 15.957 1.00 0.00 C ATOM 1206 CG GLU A 76 -0.412 -1.510 17.155 1.00 0.00 C ATOM 1207 CD GLU A 76 0.007 -2.971 17.137 1.00 0.00 C ATOM 1208 OE1 GLU A 76 -0.846 -3.847 17.414 1.00 0.00 O ATOM 1209 OE2 GLU A 76 1.193 -3.245 16.841 1.00 0.00 O ATOM 0 H GLU A 76 -3.155 -0.717 14.301 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.214 -3.030 15.740 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -0.684 -1.235 15.045 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.560 -0.084 16.036 1.00 0.00 H new ATOM 0 HG2 GLU A 76 0.478 -0.881 17.171 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.963 -1.305 18.073 1.00 0.00 H new ATOM 1451 N THR B 8 -14.263 -15.310 -7.648 1.00 0.00 N ATOM 1452 CA THR B 8 -15.050 -14.103 -7.515 1.00 0.00 C ATOM 1453 C THR B 8 -14.548 -13.290 -6.328 1.00 0.00 C ATOM 1454 O THR B 8 -14.563 -13.760 -5.191 1.00 0.00 O ATOM 1455 CB THR B 8 -16.540 -14.438 -7.332 1.00 0.00 C ATOM 1456 OG1 THR B 8 -16.940 -15.405 -8.318 1.00 0.00 O ATOM 1457 CG2 THR B 8 -17.394 -13.191 -7.473 1.00 0.00 C ATOM 0 HA THR B 8 -14.942 -13.516 -8.427 1.00 0.00 H new ATOM 0 HB THR B 8 -16.683 -14.847 -6.332 1.00 0.00 H new ATOM 0 HG1 THR B 8 -16.175 -15.973 -8.548 1.00 0.00 H new ATOM 0 HG21 THR B 8 -18.444 -13.452 -7.340 1.00 0.00 H new ATOM 0 HG22 THR B 8 -17.102 -12.463 -6.716 1.00 0.00 H new ATOM 0 HG23 THR B 8 -17.250 -12.762 -8.464 1.00 0.00 H new ATOM 1465 N PHE B 9 -14.087 -12.082 -6.604 1.00 0.00 N ATOM 1466 CA PHE B 9 -13.523 -11.232 -5.569 1.00 0.00 C ATOM 1467 C PHE B 9 -14.502 -10.136 -5.170 1.00 0.00 C ATOM 1468 O PHE B 9 -15.010 -9.400 -6.015 1.00 0.00 O ATOM 1469 CB PHE B 9 -12.182 -10.639 -6.028 1.00 0.00 C ATOM 1470 CG PHE B 9 -12.196 -10.043 -7.413 1.00 0.00 C ATOM 1471 CD1 PHE B 9 -11.936 -10.835 -8.521 1.00 0.00 C ATOM 1472 CD2 PHE B 9 -12.457 -8.693 -7.605 1.00 0.00 C ATOM 1473 CE1 PHE B 9 -11.939 -10.296 -9.793 1.00 0.00 C ATOM 1474 CE2 PHE B 9 -12.460 -8.150 -8.877 1.00 0.00 C ATOM 1475 CZ PHE B 9 -12.202 -8.952 -9.971 1.00 0.00 C ATOM 0 H PHE B 9 -14.092 -11.668 -7.536 1.00 0.00 H new ATOM 0 HA PHE B 9 -13.337 -11.845 -4.687 1.00 0.00 H new ATOM 0 HB2 PHE B 9 -11.880 -9.868 -5.319 1.00 0.00 H new ATOM 0 HB3 PHE B 9 -11.423 -11.421 -5.992 1.00 0.00 H new ATOM 0 HD1 PHE B 9 -11.729 -11.887 -8.388 1.00 0.00 H new ATOM 0 HD2 PHE B 9 -12.660 -8.061 -6.753 1.00 0.00 H new ATOM 0 HE1 PHE B 9 -11.736 -10.925 -10.647 1.00 0.00 H new ATOM 0 HE2 PHE B 9 -12.664 -7.098 -9.015 1.00 0.00 H new ATOM 0 HZ PHE B 9 -12.206 -8.529 -10.965 1.00 0.00 H new ATOM 1485 N GLU B 10 -14.774 -10.050 -3.877 1.00 0.00 N ATOM 1486 CA GLU B 10 -15.693 -9.049 -3.355 1.00 0.00 C ATOM 1487 C GLU B 10 -15.053 -8.294 -2.200 1.00 0.00 C ATOM 1488 O GLU B 10 -14.248 -8.854 -1.452 1.00 0.00 O ATOM 1489 CB GLU B 10 -16.996 -9.705 -2.892 1.00 0.00 C ATOM 1490 CG GLU B 10 -17.705 -10.492 -3.984 1.00 0.00 C ATOM 1491 CD GLU B 10 -19.034 -11.051 -3.530 1.00 0.00 C ATOM 1492 OE1 GLU B 10 -19.056 -12.169 -2.971 1.00 0.00 O ATOM 1493 OE2 GLU B 10 -20.067 -10.378 -3.737 1.00 0.00 O ATOM 0 H GLU B 10 -14.371 -10.663 -3.168 1.00 0.00 H new ATOM 0 HA GLU B 10 -15.921 -8.344 -4.155 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -16.780 -10.372 -2.057 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -17.668 -8.933 -2.518 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -17.863 -9.846 -4.848 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -17.064 -11.310 -4.311 1.00 0.00 H new ATOM 1500 N ILE B 11 -15.404 -7.023 -2.062 1.00 0.00 N ATOM 1501 CA ILE B 11 -14.869 -6.190 -0.993 1.00 0.00 C ATOM 1502 C ILE B 11 -15.759 -6.271 0.241 1.00 0.00 C ATOM 1503 O ILE B 11 -16.885 -5.775 0.238 1.00 0.00 O ATOM 1504 CB ILE B 11 -14.740 -4.715 -1.435 1.00 0.00 C ATOM 1505 CG1 ILE B 11 -13.833 -4.607 -2.664 1.00 0.00 C ATOM 1506 CG2 ILE B 11 -14.204 -3.859 -0.293 1.00 0.00 C ATOM 1507 CD1 ILE B 11 -13.728 -3.204 -3.223 1.00 0.00 C ATOM 0 H ILE B 11 -16.060 -6.544 -2.680 1.00 0.00 H new ATOM 0 HA ILE B 11 -13.875 -6.568 -0.753 1.00 0.00 H new ATOM 0 HB ILE B 11 -15.729 -4.344 -1.702 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -12.836 -4.959 -2.400 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -14.210 -5.271 -3.442 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -14.120 -2.824 -0.623 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -14.886 -3.915 0.555 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -13.222 -4.225 0.006 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -13.069 -3.207 -4.091 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -14.717 -2.855 -3.519 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -13.322 -2.538 -2.461 1.00 0.00 H new ATOM 1519 N GLU B 12 -15.252 -6.900 1.292 1.00 0.00 N ATOM 1520 CA GLU B 12 -16.018 -7.066 2.521 1.00 0.00 C ATOM 1521 C GLU B 12 -15.984 -5.796 3.355 1.00 0.00 C ATOM 1522 O GLU B 12 -17.024 -5.261 3.738 1.00 0.00 O ATOM 1523 CB GLU B 12 -15.470 -8.213 3.367 1.00 0.00 C ATOM 1524 CG GLU B 12 -15.374 -9.542 2.646 1.00 0.00 C ATOM 1525 CD GLU B 12 -15.013 -10.667 3.593 1.00 0.00 C ATOM 1526 OE1 GLU B 12 -14.392 -10.391 4.641 1.00 0.00 O ATOM 1527 OE2 GLU B 12 -15.343 -11.835 3.291 1.00 0.00 O ATOM 0 H GLU B 12 -14.316 -7.303 1.319 1.00 0.00 H new ATOM 0 HA GLU B 12 -17.043 -7.290 2.227 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -14.479 -7.939 3.728 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -16.106 -8.336 4.244 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -16.326 -9.764 2.163 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -14.624 -9.475 1.857 1.00 0.00 H new ATOM 1534 N GLU B 13 -14.780 -5.318 3.631 1.00 0.00 N ATOM 1535 CA GLU B 13 -14.594 -4.193 4.532 1.00 0.00 C ATOM 1536 C GLU B 13 -13.906 -3.042 3.812 1.00 0.00 C ATOM 1537 O GLU B 13 -12.861 -3.222 3.173 1.00 0.00 O ATOM 1538 CB GLU B 13 -13.770 -4.629 5.749 1.00 0.00 C ATOM 1539 CG GLU B 13 -14.277 -4.073 7.075 1.00 0.00 C ATOM 1540 CD GLU B 13 -14.156 -2.566 7.175 1.00 0.00 C ATOM 1541 OE1 GLU B 13 -13.106 -2.086 7.647 1.00 0.00 O ATOM 1542 OE2 GLU B 13 -15.108 -1.858 6.795 1.00 0.00 O ATOM 0 H GLU B 13 -13.915 -5.694 3.242 1.00 0.00 H new ATOM 0 HA GLU B 13 -15.571 -3.850 4.871 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -13.767 -5.718 5.801 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -12.736 -4.314 5.606 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -15.321 -4.357 7.205 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -13.718 -4.531 7.891 1.00 0.00 H new ATOM 1549 N HIS B 14 -14.503 -1.866 3.915 1.00 0.00 N ATOM 1550 CA HIS B 14 -13.958 -0.659 3.318 1.00 0.00 C ATOM 1551 C HIS B 14 -13.140 0.092 4.364 1.00 0.00 C ATOM 1552 O HIS B 14 -13.682 0.910 5.104 1.00 0.00 O ATOM 1553 CB HIS B 14 -15.100 0.224 2.799 1.00 0.00 C ATOM 1554 CG HIS B 14 -14.674 1.314 1.869 1.00 0.00 C ATOM 1555 ND1 HIS B 14 -14.567 2.634 2.248 1.00 0.00 N ATOM 1556 CD2 HIS B 14 -14.359 1.275 0.555 1.00 0.00 C ATOM 1557 CE1 HIS B 14 -14.207 3.358 1.205 1.00 0.00 C ATOM 1558 NE2 HIS B 14 -14.073 2.556 0.167 1.00 0.00 N ATOM 0 H HIS B 14 -15.380 -1.722 4.415 1.00 0.00 H new ATOM 0 HA HIS B 14 -13.313 -0.921 2.479 1.00 0.00 H new ATOM 0 HB2 HIS B 14 -15.826 -0.408 2.288 1.00 0.00 H new ATOM 0 HB3 HIS B 14 -15.611 0.671 3.651 1.00 0.00 H new ATOM 0 HD2 HIS B 14 -14.337 0.396 -0.072 1.00 0.00 H new ATOM 0 HE1 HIS B 14 -14.049 4.426 1.202 1.00 0.00 H new ATOM 0 HE2 HIS B 14 -13.800 2.844 -0.773 1.00 0.00 H new ATOM 1567 N LEU B 15 -11.844 -0.212 4.428 1.00 0.00 N ATOM 1568 CA LEU B 15 -10.968 0.298 5.485 1.00 0.00 C ATOM 1569 C LEU B 15 -10.991 1.823 5.566 1.00 0.00 C ATOM 1570 O LEU B 15 -11.617 2.394 6.459 1.00 0.00 O ATOM 1571 CB LEU B 15 -9.534 -0.192 5.270 1.00 0.00 C ATOM 1572 CG LEU B 15 -9.350 -1.709 5.314 1.00 0.00 C ATOM 1573 CD1 LEU B 15 -7.922 -2.077 4.954 1.00 0.00 C ATOM 1574 CD2 LEU B 15 -9.707 -2.250 6.690 1.00 0.00 C ATOM 0 H LEU B 15 -11.373 -0.815 3.753 1.00 0.00 H new ATOM 0 HA LEU B 15 -11.347 -0.088 6.431 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -9.184 0.172 4.304 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -8.896 0.257 6.031 1.00 0.00 H new ATOM 0 HG LEU B 15 -10.021 -2.160 4.583 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -7.805 -3.160 4.989 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -7.697 -1.720 3.949 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -7.237 -1.615 5.665 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -9.570 -3.331 6.703 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -9.060 -1.794 7.439 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -10.747 -2.013 6.915 1.00 0.00 H new ATOM 1586 N LEU B 16 -10.309 2.481 4.636 1.00 0.00 N ATOM 1587 CA LEU B 16 -10.276 3.936 4.614 1.00 0.00 C ATOM 1588 C LEU B 16 -9.915 4.439 3.229 1.00 0.00 C ATOM 1589 O LEU B 16 -9.274 3.731 2.448 1.00 0.00 O ATOM 1590 CB LEU B 16 -9.269 4.485 5.632 1.00 0.00 C ATOM 1591 CG LEU B 16 -7.797 4.219 5.310 1.00 0.00 C ATOM 1592 CD1 LEU B 16 -6.991 5.503 5.414 1.00 0.00 C ATOM 1593 CD2 LEU B 16 -7.226 3.174 6.250 1.00 0.00 C ATOM 0 H LEU B 16 -9.775 2.032 3.892 1.00 0.00 H new ATOM 0 HA LEU B 16 -11.272 4.290 4.881 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -9.416 5.562 5.718 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -9.493 4.054 6.608 1.00 0.00 H new ATOM 0 HG LEU B 16 -7.734 3.844 4.289 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -5.946 5.297 5.182 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -7.382 6.236 4.708 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -7.066 5.899 6.427 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.178 2.998 6.005 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -7.304 3.528 7.278 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -7.785 2.244 6.143 1.00 0.00 H new ATOM 1605 N THR B 17 -10.326 5.662 2.940 1.00 0.00 N ATOM 1606 CA THR B 17 -10.004 6.306 1.684 1.00 0.00 C ATOM 1607 C THR B 17 -8.722 7.124 1.828 1.00 0.00 C ATOM 1608 O THR B 17 -8.561 7.863 2.801 1.00 0.00 O ATOM 1609 CB THR B 17 -11.157 7.231 1.239 1.00 0.00 C ATOM 1610 OG1 THR B 17 -12.386 6.490 1.184 1.00 0.00 O ATOM 1611 CG2 THR B 17 -10.871 7.845 -0.123 1.00 0.00 C ATOM 0 H THR B 17 -10.891 6.233 3.569 1.00 0.00 H new ATOM 0 HA THR B 17 -9.858 5.533 0.929 1.00 0.00 H new ATOM 0 HB THR B 17 -11.247 8.036 1.969 1.00 0.00 H new ATOM 0 HG1 THR B 17 -12.236 5.642 0.715 1.00 0.00 H new ATOM 0 HG21 THR B 17 -11.699 8.492 -0.412 1.00 0.00 H new ATOM 0 HG22 THR B 17 -9.953 8.431 -0.072 1.00 0.00 H new ATOM 0 HG23 THR B 17 -10.755 7.052 -0.862 1.00 0.00 H new ATOM 1619 N LEU B 18 -7.807 6.982 0.876 1.00 0.00 N ATOM 1620 CA LEU B 18 -6.561 7.736 0.909 1.00 0.00 C ATOM 1621 C LEU B 18 -6.758 9.099 0.269 1.00 0.00 C ATOM 1622 O LEU B 18 -6.361 10.121 0.826 1.00 0.00 O ATOM 1623 CB LEU B 18 -5.447 6.974 0.191 1.00 0.00 C ATOM 1624 CG LEU B 18 -5.140 5.585 0.751 1.00 0.00 C ATOM 1625 CD1 LEU B 18 -4.031 4.927 -0.051 1.00 0.00 C ATOM 1626 CD2 LEU B 18 -4.762 5.671 2.224 1.00 0.00 C ATOM 0 H LEU B 18 -7.904 6.356 0.077 1.00 0.00 H new ATOM 0 HA LEU B 18 -6.269 7.871 1.950 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -5.718 6.872 -0.860 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -4.537 7.572 0.229 1.00 0.00 H new ATOM 0 HG LEU B 18 -6.037 4.972 0.667 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -3.823 3.939 0.359 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.342 4.830 -1.091 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.131 5.539 0.003 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -4.547 4.672 2.603 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -3.879 6.300 2.337 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -5.589 6.103 2.787 1.00 0.00 H new ATOM 1638 N SER B 19 -7.381 9.104 -0.903 1.00 0.00 N ATOM 1639 CA SER B 19 -7.693 10.339 -1.601 1.00 0.00 C ATOM 1640 C SER B 19 -8.735 10.067 -2.683 1.00 0.00 C ATOM 1641 O SER B 19 -8.842 8.942 -3.180 1.00 0.00 O ATOM 1642 CB SER B 19 -6.422 10.938 -2.215 1.00 0.00 C ATOM 1643 OG SER B 19 -6.587 12.321 -2.476 1.00 0.00 O ATOM 0 H SER B 19 -7.681 8.259 -1.390 1.00 0.00 H new ATOM 0 HA SER B 19 -8.101 11.059 -0.891 1.00 0.00 H new ATOM 0 HB2 SER B 19 -5.582 10.790 -1.537 1.00 0.00 H new ATOM 0 HB3 SER B 19 -6.180 10.416 -3.141 1.00 0.00 H new ATOM 0 HG SER B 19 -6.143 12.842 -1.775 1.00 0.00 H new ATOM 1649 N GLU B 20 -9.504 11.084 -3.041 1.00 0.00 N ATOM 1650 CA GLU B 20 -10.548 10.932 -4.040 1.00 0.00 C ATOM 1651 C GLU B 20 -10.419 12.005 -5.117 1.00 0.00 C ATOM 1652 O GLU B 20 -10.361 13.199 -4.815 1.00 0.00 O ATOM 1653 CB GLU B 20 -11.928 10.992 -3.375 1.00 0.00 C ATOM 1654 CG GLU B 20 -13.080 10.819 -4.347 1.00 0.00 C ATOM 1655 CD GLU B 20 -14.401 10.589 -3.645 1.00 0.00 C ATOM 1656 OE1 GLU B 20 -14.933 11.543 -3.039 1.00 0.00 O ATOM 1657 OE2 GLU B 20 -14.906 9.448 -3.689 1.00 0.00 O ATOM 0 H GLU B 20 -9.424 12.024 -2.653 1.00 0.00 H new ATOM 0 HA GLU B 20 -10.436 9.959 -4.517 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -11.988 10.216 -2.612 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -12.035 11.949 -2.865 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -13.156 11.706 -4.976 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -12.871 9.977 -5.007 1.00 0.00 H new ATOM 1664 N ASN B 21 -10.341 11.571 -6.367 1.00 0.00 N ATOM 1665 CA ASN B 21 -10.204 12.478 -7.501 1.00 0.00 C ATOM 1666 C ASN B 21 -11.429 12.414 -8.404 1.00 0.00 C ATOM 1667 O ASN B 21 -12.091 11.372 -8.505 1.00 0.00 O ATOM 1668 CB ASN B 21 -8.952 12.141 -8.318 1.00 0.00 C ATOM 1669 CG ASN B 21 -7.682 12.761 -7.759 1.00 0.00 C ATOM 1670 OD1 ASN B 21 -6.735 13.025 -8.500 1.00 0.00 O ATOM 1671 ND2 ASN B 21 -7.649 13.004 -6.460 1.00 0.00 N ATOM 0 H ASN B 21 -10.371 10.584 -6.625 1.00 0.00 H new ATOM 0 HA ASN B 21 -10.111 13.488 -7.103 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -8.833 11.058 -8.356 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -9.093 12.482 -9.343 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -6.819 13.424 -6.041 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -8.453 12.772 -5.877 1.00 0.00 H new ATOM 1678 N GLU B 22 -11.719 13.539 -9.055 1.00 0.00 N ATOM 1679 CA GLU B 22 -12.797 13.644 -10.024 1.00 0.00 C ATOM 1680 C GLU B 22 -14.161 13.429 -9.356 1.00 0.00 C ATOM 1681 O GLU B 22 -14.725 14.357 -8.778 1.00 0.00 O ATOM 1682 CB GLU B 22 -12.553 12.657 -11.172 1.00 0.00 C ATOM 1683 CG GLU B 22 -13.445 12.880 -12.370 1.00 0.00 C ATOM 1684 CD GLU B 22 -13.241 14.244 -12.986 1.00 0.00 C ATOM 1685 OE1 GLU B 22 -12.076 14.625 -13.239 1.00 0.00 O ATOM 1686 OE2 GLU B 22 -14.242 14.953 -13.198 1.00 0.00 O ATOM 0 H GLU B 22 -11.204 14.409 -8.920 1.00 0.00 H new ATOM 0 HA GLU B 22 -12.811 14.651 -10.440 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -11.512 12.731 -11.487 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -12.703 11.642 -10.804 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -13.246 12.112 -13.117 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -14.487 12.770 -12.070 1.00 0.00 H new ATOM 1693 N LYS B 23 -14.675 12.208 -9.435 1.00 0.00 N ATOM 1694 CA LYS B 23 -15.916 11.830 -8.766 1.00 0.00 C ATOM 1695 C LYS B 23 -16.039 10.313 -8.775 1.00 0.00 C ATOM 1696 O LYS B 23 -17.127 9.754 -8.631 1.00 0.00 O ATOM 1697 CB LYS B 23 -17.136 12.463 -9.453 1.00 0.00 C ATOM 1698 CG LYS B 23 -17.312 12.055 -10.909 1.00 0.00 C ATOM 1699 CD LYS B 23 -18.671 12.485 -11.446 1.00 0.00 C ATOM 1700 CE LYS B 23 -19.805 11.846 -10.657 1.00 0.00 C ATOM 1701 NZ LYS B 23 -21.139 12.237 -11.183 1.00 0.00 N ATOM 0 H LYS B 23 -14.244 11.451 -9.965 1.00 0.00 H new ATOM 0 HA LYS B 23 -15.888 12.197 -7.740 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -18.034 12.189 -8.899 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -17.047 13.548 -9.399 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -16.522 12.503 -11.512 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -17.208 10.974 -11.001 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -18.757 13.570 -11.396 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -18.754 12.206 -12.497 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -19.705 10.761 -10.693 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -19.728 12.139 -9.610 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -21.883 11.780 -10.617 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -21.246 13.270 -11.126 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -21.223 11.935 -12.175 1.00 0.00 H new ATOM 1715 N GLY B 24 -14.899 9.656 -8.912 1.00 0.00 N ATOM 1716 CA GLY B 24 -14.885 8.222 -9.098 1.00 0.00 C ATOM 1717 C GLY B 24 -13.480 7.662 -9.098 1.00 0.00 C ATOM 1718 O GLY B 24 -13.282 6.481 -8.827 1.00 0.00 O ATOM 0 H GLY B 24 -13.978 10.094 -8.898 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -15.464 7.748 -8.305 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -15.374 7.974 -10.040 1.00 0.00 H new ATOM 1722 N TRP B 25 -12.499 8.508 -9.407 1.00 0.00 N ATOM 1723 CA TRP B 25 -11.102 8.102 -9.360 1.00 0.00 C ATOM 1724 C TRP B 25 -10.612 8.152 -7.928 1.00 0.00 C ATOM 1725 O TRP B 25 -10.008 9.132 -7.497 1.00 0.00 O ATOM 1726 CB TRP B 25 -10.234 9.007 -10.242 1.00 0.00 C ATOM 1727 CG TRP B 25 -10.529 8.878 -11.705 1.00 0.00 C ATOM 1728 CD1 TRP B 25 -11.572 9.433 -12.392 1.00 0.00 C ATOM 1729 CD2 TRP B 25 -9.761 8.148 -12.661 1.00 0.00 C ATOM 1730 NE1 TRP B 25 -11.501 9.082 -13.718 1.00 0.00 N ATOM 1731 CE2 TRP B 25 -10.394 8.293 -13.908 1.00 0.00 C ATOM 1732 CE3 TRP B 25 -8.594 7.383 -12.580 1.00 0.00 C ATOM 1733 CZ2 TRP B 25 -9.898 7.701 -15.066 1.00 0.00 C ATOM 1734 CZ3 TRP B 25 -8.104 6.793 -13.726 1.00 0.00 C ATOM 1735 CH2 TRP B 25 -8.754 6.954 -14.957 1.00 0.00 C ATOM 0 H TRP B 25 -12.649 9.476 -9.692 1.00 0.00 H new ATOM 0 HA TRP B 25 -11.023 7.084 -9.741 1.00 0.00 H new ATOM 0 HB2 TRP B 25 -10.381 10.044 -9.940 1.00 0.00 H new ATOM 0 HB3 TRP B 25 -9.184 8.770 -10.069 1.00 0.00 H new ATOM 0 HD1 TRP B 25 -12.339 10.056 -11.956 1.00 0.00 H new ATOM 0 HE1 TRP B 25 -12.162 9.362 -14.443 1.00 0.00 H new ATOM 0 HE3 TRP B 25 -8.085 7.256 -11.636 1.00 0.00 H new ATOM 0 HZ2 TRP B 25 -10.396 7.826 -16.016 1.00 0.00 H new ATOM 0 HZ3 TRP B 25 -7.205 6.197 -13.674 1.00 0.00 H new ATOM 0 HH2 TRP B 25 -8.345 6.480 -15.837 1.00 0.00 H new ATOM 1746 N THR B 26 -10.912 7.113 -7.181 1.00 0.00 N ATOM 1747 CA THR B 26 -10.588 7.082 -5.775 1.00 0.00 C ATOM 1748 C THR B 26 -9.465 6.087 -5.507 1.00 0.00 C ATOM 1749 O THR B 26 -9.442 4.992 -6.070 1.00 0.00 O ATOM 1750 CB THR B 26 -11.836 6.706 -4.951 1.00 0.00 C ATOM 1751 OG1 THR B 26 -12.934 7.558 -5.317 1.00 0.00 O ATOM 1752 CG2 THR B 26 -11.574 6.837 -3.460 1.00 0.00 C ATOM 0 H THR B 26 -11.382 6.276 -7.527 1.00 0.00 H new ATOM 0 HA THR B 26 -10.251 8.074 -5.476 1.00 0.00 H new ATOM 0 HB THR B 26 -12.081 5.666 -5.168 1.00 0.00 H new ATOM 0 HG1 THR B 26 -13.725 7.315 -4.793 1.00 0.00 H new ATOM 0 HG21 THR B 26 -12.473 6.565 -2.907 1.00 0.00 H new ATOM 0 HG22 THR B 26 -10.758 6.174 -3.174 1.00 0.00 H new ATOM 0 HG23 THR B 26 -11.303 7.867 -3.227 1.00 0.00 H new ATOM 1760 N LYS B 27 -8.530 6.481 -4.656 1.00 0.00 N ATOM 1761 CA LYS B 27 -7.448 5.606 -4.256 1.00 0.00 C ATOM 1762 C LYS B 27 -7.572 5.326 -2.772 1.00 0.00 C ATOM 1763 O LYS B 27 -7.624 6.255 -1.960 1.00 0.00 O ATOM 1764 CB LYS B 27 -6.087 6.237 -4.555 1.00 0.00 C ATOM 1765 CG LYS B 27 -4.920 5.283 -4.349 1.00 0.00 C ATOM 1766 CD LYS B 27 -3.581 6.002 -4.410 1.00 0.00 C ATOM 1767 CE LYS B 27 -3.337 6.655 -5.762 1.00 0.00 C ATOM 1768 NZ LYS B 27 -2.061 7.421 -5.781 1.00 0.00 N ATOM 0 H LYS B 27 -8.502 7.407 -4.229 1.00 0.00 H new ATOM 0 HA LYS B 27 -7.516 4.677 -4.823 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -6.078 6.593 -5.585 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -5.951 7.109 -3.916 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -5.022 4.788 -3.383 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -4.949 4.504 -5.111 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -3.544 6.762 -3.630 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -2.780 5.292 -4.202 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -3.313 5.889 -6.537 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -4.166 7.322 -5.999 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -2.182 8.284 -6.349 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -1.798 7.681 -4.809 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -1.310 6.835 -6.198 1.00 0.00 H new ATOM 1782 N GLU B 28 -7.639 4.059 -2.414 1.00 0.00 N ATOM 1783 CA GLU B 28 -7.872 3.677 -1.035 1.00 0.00 C ATOM 1784 C GLU B 28 -7.466 2.236 -0.783 1.00 0.00 C ATOM 1785 O GLU B 28 -6.902 1.575 -1.658 1.00 0.00 O ATOM 1786 CB GLU B 28 -9.346 3.892 -0.687 1.00 0.00 C ATOM 1787 CG GLU B 28 -10.314 3.344 -1.725 1.00 0.00 C ATOM 1788 CD GLU B 28 -11.749 3.716 -1.422 1.00 0.00 C ATOM 1789 OE1 GLU B 28 -11.972 4.607 -0.577 1.00 0.00 O ATOM 1790 OE2 GLU B 28 -12.663 3.115 -2.021 1.00 0.00 O ATOM 0 H GLU B 28 -7.535 3.276 -3.059 1.00 0.00 H new ATOM 0 HA GLU B 28 -7.255 4.305 -0.392 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -9.554 3.421 0.273 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -9.528 4.960 -0.564 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -10.042 3.725 -2.709 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -10.223 2.259 -1.767 1.00 0.00 H new ATOM 1797 N ILE B 29 -7.743 1.764 0.424 1.00 0.00 N ATOM 1798 CA ILE B 29 -7.374 0.418 0.826 1.00 0.00 C ATOM 1799 C ILE B 29 -8.597 -0.322 1.360 1.00 0.00 C ATOM 1800 O ILE B 29 -9.361 0.221 2.164 1.00 0.00 O ATOM 1801 CB ILE B 29 -6.268 0.438 1.904 1.00 0.00 C ATOM 1802 CG1 ILE B 29 -5.108 1.332 1.452 1.00 0.00 C ATOM 1803 CG2 ILE B 29 -5.775 -0.978 2.185 1.00 0.00 C ATOM 1804 CD1 ILE B 29 -4.021 1.501 2.489 1.00 0.00 C ATOM 0 H ILE B 29 -8.226 2.299 1.146 1.00 0.00 H new ATOM 0 HA ILE B 29 -6.988 -0.100 -0.052 1.00 0.00 H new ATOM 0 HB ILE B 29 -6.683 0.846 2.826 1.00 0.00 H new ATOM 0 HG12 ILE B 29 -4.670 0.911 0.547 1.00 0.00 H new ATOM 0 HG13 ILE B 29 -5.501 2.314 1.189 1.00 0.00 H new ATOM 0 HG21 ILE B 29 -4.996 -0.948 2.947 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -6.605 -1.589 2.539 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -5.371 -1.411 1.270 1.00 0.00 H new ATOM 0 HD11 ILE B 29 -3.237 2.147 2.093 1.00 0.00 H new ATOM 0 HD12 ILE B 29 -4.442 1.951 3.388 1.00 0.00 H new ATOM 0 HD13 ILE B 29 -3.599 0.527 2.735 1.00 0.00 H new ATOM 1816 N ASN B 30 -8.782 -1.550 0.909 1.00 0.00 N ATOM 1817 CA ASN B 30 -9.948 -2.339 1.274 1.00 0.00 C ATOM 1818 C ASN B 30 -9.569 -3.798 1.516 1.00 0.00 C ATOM 1819 O ASN B 30 -8.418 -4.185 1.329 1.00 0.00 O ATOM 1820 CB ASN B 30 -11.006 -2.243 0.167 1.00 0.00 C ATOM 1821 CG ASN B 30 -10.398 -2.278 -1.228 1.00 0.00 C ATOM 1822 OD1 ASN B 30 -10.138 -1.237 -1.824 1.00 0.00 O ATOM 1823 ND2 ASN B 30 -10.160 -3.468 -1.754 1.00 0.00 N ATOM 0 H ASN B 30 -8.133 -2.027 0.283 1.00 0.00 H new ATOM 0 HA ASN B 30 -10.359 -1.940 2.201 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -11.712 -3.066 0.272 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -11.572 -1.320 0.290 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -9.747 -3.541 -2.684 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -10.389 -4.312 -1.230 1.00 0.00 H new ATOM 1830 N ARG B 31 -10.536 -4.595 1.960 1.00 0.00 N ATOM 1831 CA ARG B 31 -10.329 -6.032 2.133 1.00 0.00 C ATOM 1832 C ARG B 31 -11.158 -6.807 1.118 1.00 0.00 C ATOM 1833 O ARG B 31 -12.352 -6.547 0.952 1.00 0.00 O ATOM 1834 CB ARG B 31 -10.691 -6.484 3.551 1.00 0.00 C ATOM 1835 CG ARG B 31 -9.780 -5.924 4.630 1.00 0.00 C ATOM 1836 CD ARG B 31 -10.037 -6.589 5.975 1.00 0.00 C ATOM 1837 NE ARG B 31 -9.710 -8.017 5.957 1.00 0.00 N ATOM 1838 CZ ARG B 31 -10.257 -8.916 6.778 1.00 0.00 C ATOM 1839 NH1 ARG B 31 -11.152 -8.536 7.682 1.00 0.00 N ATOM 1840 NH2 ARG B 31 -9.907 -10.193 6.687 1.00 0.00 N ATOM 0 H ARG B 31 -11.471 -4.272 2.207 1.00 0.00 H new ATOM 0 HA ARG B 31 -9.271 -6.237 1.971 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -11.717 -6.186 3.765 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -10.660 -7.573 3.593 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -8.739 -6.072 4.342 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -9.936 -4.849 4.718 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -9.445 -6.092 6.743 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -11.085 -6.461 6.247 1.00 0.00 H new ATOM 0 HE ARG B 31 -9.024 -8.344 5.277 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -11.423 -7.555 7.750 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -11.569 -9.225 8.308 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -9.221 -10.486 5.991 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -10.324 -10.882 7.313 1.00 0.00 H new ATOM 1854 N VAL B 32 -10.526 -7.760 0.445 1.00 0.00 N ATOM 1855 CA VAL B 32 -11.175 -8.508 -0.625 1.00 0.00 C ATOM 1856 C VAL B 32 -11.063 -10.015 -0.400 1.00 0.00 C ATOM 1857 O VAL B 32 -9.985 -10.527 -0.083 1.00 0.00 O ATOM 1858 CB VAL B 32 -10.555 -8.160 -2.000 1.00 0.00 C ATOM 1859 CG1 VAL B 32 -11.235 -8.933 -3.117 1.00 0.00 C ATOM 1860 CG2 VAL B 32 -10.637 -6.671 -2.276 1.00 0.00 C ATOM 0 H VAL B 32 -9.560 -8.034 0.622 1.00 0.00 H new ATOM 0 HA VAL B 32 -12.227 -8.223 -0.617 1.00 0.00 H new ATOM 0 HB VAL B 32 -9.505 -8.449 -1.966 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -10.780 -8.669 -4.072 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -11.118 -10.003 -2.943 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -12.296 -8.683 -3.139 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -10.194 -6.456 -3.248 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -11.681 -6.358 -2.276 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -10.095 -6.127 -1.502 1.00 0.00 H new ATOM 1870 N SER B 33 -12.180 -10.713 -0.566 1.00 0.00 N ATOM 1871 CA SER B 33 -12.204 -12.166 -0.476 1.00 0.00 C ATOM 1872 C SER B 33 -12.355 -12.777 -1.865 1.00 0.00 C ATOM 1873 O SER B 33 -13.165 -12.312 -2.671 1.00 0.00 O ATOM 1874 CB SER B 33 -13.352 -12.630 0.420 1.00 0.00 C ATOM 1875 OG SER B 33 -13.191 -12.153 1.739 1.00 0.00 O ATOM 0 H SER B 33 -13.087 -10.291 -0.765 1.00 0.00 H new ATOM 0 HA SER B 33 -11.262 -12.498 -0.039 1.00 0.00 H new ATOM 0 HB2 SER B 33 -14.300 -12.276 0.015 1.00 0.00 H new ATOM 0 HB3 SER B 33 -13.395 -13.719 0.426 1.00 0.00 H new ATOM 0 HG SER B 33 -13.952 -12.439 2.286 1.00 0.00 H new ATOM 1881 N PHE B 34 -11.572 -13.808 -2.142 1.00 0.00 N ATOM 1882 CA PHE B 34 -11.643 -14.508 -3.416 1.00 0.00 C ATOM 1883 C PHE B 34 -12.402 -15.815 -3.235 1.00 0.00 C ATOM 1884 O PHE B 34 -11.826 -16.811 -2.791 1.00 0.00 O ATOM 1885 CB PHE B 34 -10.235 -14.782 -3.960 1.00 0.00 C ATOM 1886 CG PHE B 34 -9.415 -13.538 -4.159 1.00 0.00 C ATOM 1887 CD1 PHE B 34 -8.639 -13.028 -3.126 1.00 0.00 C ATOM 1888 CD2 PHE B 34 -9.424 -12.876 -5.375 1.00 0.00 C ATOM 1889 CE1 PHE B 34 -7.890 -11.882 -3.305 1.00 0.00 C ATOM 1890 CE2 PHE B 34 -8.675 -11.728 -5.560 1.00 0.00 C ATOM 1891 CZ PHE B 34 -7.908 -11.231 -4.524 1.00 0.00 C ATOM 0 H PHE B 34 -10.875 -14.181 -1.497 1.00 0.00 H new ATOM 0 HA PHE B 34 -12.170 -13.882 -4.136 1.00 0.00 H new ATOM 0 HB2 PHE B 34 -9.712 -15.446 -3.272 1.00 0.00 H new ATOM 0 HB3 PHE B 34 -10.318 -15.309 -4.911 1.00 0.00 H new ATOM 0 HD1 PHE B 34 -8.621 -13.534 -2.172 1.00 0.00 H new ATOM 0 HD2 PHE B 34 -10.022 -13.260 -6.188 1.00 0.00 H new ATOM 0 HE1 PHE B 34 -7.291 -11.495 -2.494 1.00 0.00 H new ATOM 0 HE2 PHE B 34 -8.690 -11.221 -6.513 1.00 0.00 H new ATOM 0 HZ PHE B 34 -7.323 -10.334 -4.667 1.00 0.00 H new ATOM 1901 N ASN B 35 -13.696 -15.788 -3.566 1.00 0.00 N ATOM 1902 CA ASN B 35 -14.621 -16.908 -3.316 1.00 0.00 C ATOM 1903 C ASN B 35 -14.893 -17.064 -1.821 1.00 0.00 C ATOM 1904 O ASN B 35 -16.042 -17.020 -1.381 1.00 0.00 O ATOM 1905 CB ASN B 35 -14.096 -18.231 -3.892 1.00 0.00 C ATOM 1906 CG ASN B 35 -13.991 -18.219 -5.402 1.00 0.00 C ATOM 1907 OD1 ASN B 35 -14.741 -17.524 -6.090 1.00 0.00 O ATOM 1908 ND2 ASN B 35 -13.055 -18.991 -5.931 1.00 0.00 N ATOM 0 H ASN B 35 -14.138 -14.987 -4.017 1.00 0.00 H new ATOM 0 HA ASN B 35 -15.553 -16.668 -3.827 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -13.115 -18.442 -3.467 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -14.757 -19.042 -3.586 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -12.934 -19.026 -6.943 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -12.454 -19.551 -5.326 1.00 0.00 H new ATOM 1915 N GLY B 36 -13.829 -17.230 -1.055 1.00 0.00 N ATOM 1916 CA GLY B 36 -13.929 -17.362 0.376 1.00 0.00 C ATOM 1917 C GLY B 36 -12.585 -17.124 1.026 1.00 0.00 C ATOM 1918 O GLY B 36 -11.753 -16.410 0.456 1.00 0.00 O ATOM 0 H GLY B 36 -12.875 -17.276 -1.413 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -14.658 -16.649 0.763 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -14.291 -18.358 0.631 1.00 0.00 H new ATOM 1922 N ALA B 37 -12.374 -17.731 2.197 1.00 0.00 N ATOM 1923 CA ALA B 37 -11.107 -17.626 2.933 1.00 0.00 C ATOM 1924 C ALA B 37 -10.930 -16.223 3.533 1.00 0.00 C ATOM 1925 O ALA B 37 -11.665 -15.298 3.183 1.00 0.00 O ATOM 1926 CB ALA B 37 -9.927 -17.996 2.031 1.00 0.00 C ATOM 0 H ALA B 37 -13.074 -18.309 2.663 1.00 0.00 H new ATOM 0 HA ALA B 37 -11.135 -18.335 3.760 1.00 0.00 H new ATOM 0 HB1 ALA B 37 -8.998 -17.912 2.595 1.00 0.00 H new ATOM 0 HB2 ALA B 37 -10.046 -19.020 1.678 1.00 0.00 H new ATOM 0 HB3 ALA B 37 -9.896 -17.319 1.177 1.00 0.00 H new ATOM 1932 N PRO B 38 -9.990 -16.058 4.492 1.00 0.00 N ATOM 1933 CA PRO B 38 -9.679 -14.753 5.086 1.00 0.00 C ATOM 1934 C PRO B 38 -9.438 -13.673 4.034 1.00 0.00 C ATOM 1935 O PRO B 38 -8.590 -13.822 3.152 1.00 0.00 O ATOM 1936 CB PRO B 38 -8.398 -15.005 5.902 1.00 0.00 C ATOM 1937 CG PRO B 38 -7.947 -16.381 5.531 1.00 0.00 C ATOM 1938 CD PRO B 38 -9.177 -17.122 5.099 1.00 0.00 C ATOM 0 HA PRO B 38 -10.509 -14.384 5.688 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -7.632 -14.265 5.667 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -8.594 -14.932 6.972 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.211 -16.346 4.728 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -7.471 -16.876 6.378 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -8.945 -17.913 4.386 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -9.685 -17.591 5.941 1.00 0.00 H new ATOM 1946 N ALA B 39 -10.202 -12.593 4.134 1.00 0.00 N ATOM 1947 CA ALA B 39 -10.093 -11.487 3.199 1.00 0.00 C ATOM 1948 C ALA B 39 -8.749 -10.796 3.333 1.00 0.00 C ATOM 1949 O ALA B 39 -8.393 -10.316 4.413 1.00 0.00 O ATOM 1950 CB ALA B 39 -11.216 -10.489 3.432 1.00 0.00 C ATOM 0 H ALA B 39 -10.907 -12.462 4.859 1.00 0.00 H new ATOM 0 HA ALA B 39 -10.175 -11.887 2.188 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -11.123 -9.665 2.725 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -12.177 -10.983 3.289 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -11.154 -10.103 4.449 1.00 0.00 H new ATOM 1956 N LYS B 40 -8.003 -10.746 2.246 1.00 0.00 N ATOM 1957 CA LYS B 40 -6.723 -10.070 2.255 1.00 0.00 C ATOM 1958 C LYS B 40 -6.914 -8.595 1.959 1.00 0.00 C ATOM 1959 O LYS B 40 -8.010 -8.158 1.600 1.00 0.00 O ATOM 1960 CB LYS B 40 -5.746 -10.699 1.258 1.00 0.00 C ATOM 1961 CG LYS B 40 -5.254 -12.074 1.679 1.00 0.00 C ATOM 1962 CD LYS B 40 -4.013 -12.486 0.901 1.00 0.00 C ATOM 1963 CE LYS B 40 -3.458 -13.812 1.401 1.00 0.00 C ATOM 1964 NZ LYS B 40 -2.111 -14.098 0.838 1.00 0.00 N ATOM 0 H LYS B 40 -8.260 -11.163 1.351 1.00 0.00 H new ATOM 0 HA LYS B 40 -6.289 -10.181 3.249 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -6.232 -10.777 0.285 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -4.889 -10.037 1.134 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -5.031 -12.071 2.746 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -6.044 -12.808 1.521 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -4.257 -12.568 -0.158 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -3.250 -11.713 0.994 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -3.400 -13.794 2.489 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -4.142 -14.617 1.132 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -1.812 -15.053 1.121 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -2.149 -14.040 -0.200 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -1.429 -13.401 1.199 1.00 0.00 H new ATOM 1978 N PHE B 41 -5.854 -7.831 2.119 1.00 0.00 N ATOM 1979 CA PHE B 41 -5.926 -6.394 1.957 1.00 0.00 C ATOM 1980 C PHE B 41 -5.539 -6.007 0.540 1.00 0.00 C ATOM 1981 O PHE B 41 -4.702 -6.658 -0.080 1.00 0.00 O ATOM 1982 CB PHE B 41 -5.015 -5.709 2.973 1.00 0.00 C ATOM 1983 CG PHE B 41 -5.297 -6.119 4.395 1.00 0.00 C ATOM 1984 CD1 PHE B 41 -4.656 -7.214 4.954 1.00 0.00 C ATOM 1985 CD2 PHE B 41 -6.203 -5.413 5.168 1.00 0.00 C ATOM 1986 CE1 PHE B 41 -4.916 -7.596 6.256 1.00 0.00 C ATOM 1987 CE2 PHE B 41 -6.464 -5.790 6.472 1.00 0.00 C ATOM 1988 CZ PHE B 41 -5.822 -6.883 7.016 1.00 0.00 C ATOM 0 H PHE B 41 -4.928 -8.183 2.362 1.00 0.00 H new ATOM 0 HA PHE B 41 -6.950 -6.065 2.134 1.00 0.00 H new ATOM 0 HB2 PHE B 41 -3.977 -5.940 2.734 1.00 0.00 H new ATOM 0 HB3 PHE B 41 -5.130 -4.629 2.884 1.00 0.00 H new ATOM 0 HD1 PHE B 41 -3.945 -7.775 4.365 1.00 0.00 H new ATOM 0 HD2 PHE B 41 -6.712 -4.558 4.747 1.00 0.00 H new ATOM 0 HE1 PHE B 41 -4.411 -8.452 6.679 1.00 0.00 H new ATOM 0 HE2 PHE B 41 -7.171 -5.229 7.065 1.00 0.00 H new ATOM 0 HZ PHE B 41 -6.027 -7.180 8.034 1.00 0.00 H new ATOM 1998 N ASP B 42 -6.161 -4.963 0.029 1.00 0.00 N ATOM 1999 CA ASP B 42 -5.937 -4.536 -1.343 1.00 0.00 C ATOM 2000 C ASP B 42 -5.867 -3.014 -1.433 1.00 0.00 C ATOM 2001 O ASP B 42 -6.793 -2.314 -1.021 1.00 0.00 O ATOM 2002 CB ASP B 42 -7.060 -5.083 -2.232 1.00 0.00 C ATOM 2003 CG ASP B 42 -6.981 -4.612 -3.670 1.00 0.00 C ATOM 2004 OD1 ASP B 42 -6.115 -5.106 -4.421 1.00 0.00 O ATOM 2005 OD2 ASP B 42 -7.819 -3.778 -4.064 1.00 0.00 O ATOM 0 H ASP B 42 -6.829 -4.390 0.544 1.00 0.00 H new ATOM 0 HA ASP B 42 -4.982 -4.930 -1.689 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -7.028 -6.172 -2.213 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -8.021 -4.785 -1.813 1.00 0.00 H new ATOM 2010 N ILE B 43 -4.747 -2.512 -1.937 1.00 0.00 N ATOM 2011 CA ILE B 43 -4.560 -1.082 -2.132 1.00 0.00 C ATOM 2012 C ILE B 43 -4.715 -0.762 -3.609 1.00 0.00 C ATOM 2013 O ILE B 43 -3.897 -1.183 -4.428 1.00 0.00 O ATOM 2014 CB ILE B 43 -3.162 -0.620 -1.666 1.00 0.00 C ATOM 2015 CG1 ILE B 43 -2.903 -1.057 -0.220 1.00 0.00 C ATOM 2016 CG2 ILE B 43 -3.035 0.891 -1.801 1.00 0.00 C ATOM 2017 CD1 ILE B 43 -1.523 -0.695 0.288 1.00 0.00 C ATOM 0 H ILE B 43 -3.949 -3.080 -2.220 1.00 0.00 H new ATOM 0 HA ILE B 43 -5.308 -0.558 -1.537 1.00 0.00 H new ATOM 0 HB ILE B 43 -2.411 -1.089 -2.302 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -3.651 -0.599 0.428 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -3.036 -2.136 -0.147 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -2.045 1.204 -1.469 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -3.175 1.176 -2.844 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -3.794 1.376 -1.187 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -1.413 -1.036 1.317 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -0.768 -1.175 -0.335 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -1.393 0.386 0.248 1.00 0.00 H new ATOM 2029 N ARG B 44 -5.755 -0.022 -3.959 1.00 0.00 N ATOM 2030 CA ARG B 44 -6.080 0.165 -5.364 1.00 0.00 C ATOM 2031 C ARG B 44 -6.574 1.571 -5.664 1.00 0.00 C ATOM 2032 O ARG B 44 -6.978 2.314 -4.770 1.00 0.00 O ATOM 2033 CB ARG B 44 -7.153 -0.844 -5.779 1.00 0.00 C ATOM 2034 CG ARG B 44 -8.521 -0.565 -5.169 1.00 0.00 C ATOM 2035 CD ARG B 44 -9.484 -1.720 -5.398 1.00 0.00 C ATOM 2036 NE ARG B 44 -9.634 -2.063 -6.815 1.00 0.00 N ATOM 2037 CZ ARG B 44 -9.112 -3.161 -7.372 1.00 0.00 C ATOM 2038 NH1 ARG B 44 -8.364 -3.983 -6.646 1.00 0.00 N ATOM 2039 NH2 ARG B 44 -9.333 -3.436 -8.653 1.00 0.00 N ATOM 0 H ARG B 44 -6.378 0.451 -3.304 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.163 0.009 -5.932 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -7.242 -0.841 -6.865 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -6.832 -1.844 -5.488 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -8.413 -0.387 -4.099 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -8.934 0.345 -5.603 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -9.131 -2.595 -4.853 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -10.459 -1.461 -4.987 1.00 0.00 H new ATOM 0 HE ARG B 44 -10.167 -1.428 -7.410 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -8.187 -3.777 -5.663 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -7.966 -4.820 -7.071 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -9.904 -2.808 -9.218 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -8.932 -4.275 -9.071 1.00 0.00 H new ATOM 2053 N ALA B 45 -6.518 1.921 -6.939 1.00 0.00 N ATOM 2054 CA ALA B 45 -7.175 3.110 -7.447 1.00 0.00 C ATOM 2055 C ALA B 45 -8.251 2.679 -8.427 1.00 0.00 C ATOM 2056 O ALA B 45 -7.948 2.105 -9.475 1.00 0.00 O ATOM 2057 CB ALA B 45 -6.180 4.046 -8.123 1.00 0.00 C ATOM 0 H ALA B 45 -6.016 1.388 -7.649 1.00 0.00 H new ATOM 0 HA ALA B 45 -7.620 3.660 -6.618 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.703 4.928 -8.493 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -5.420 4.351 -7.403 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -5.704 3.530 -8.957 1.00 0.00 H new ATOM 2063 N TRP B 46 -9.502 2.917 -8.082 1.00 0.00 N ATOM 2064 CA TRP B 46 -10.596 2.484 -8.931 1.00 0.00 C ATOM 2065 C TRP B 46 -11.241 3.675 -9.619 1.00 0.00 C ATOM 2066 O TRP B 46 -10.956 4.826 -9.285 1.00 0.00 O ATOM 2067 CB TRP B 46 -11.631 1.665 -8.143 1.00 0.00 C ATOM 2068 CG TRP B 46 -12.219 2.365 -6.951 1.00 0.00 C ATOM 2069 CD1 TRP B 46 -11.738 2.350 -5.672 1.00 0.00 C ATOM 2070 CD2 TRP B 46 -13.413 3.154 -6.920 1.00 0.00 C ATOM 2071 NE1 TRP B 46 -12.559 3.082 -4.852 1.00 0.00 N ATOM 2072 CE2 TRP B 46 -13.588 3.591 -5.594 1.00 0.00 C ATOM 2073 CE3 TRP B 46 -14.348 3.541 -7.885 1.00 0.00 C ATOM 2074 CZ2 TRP B 46 -14.660 4.389 -5.210 1.00 0.00 C ATOM 2075 CZ3 TRP B 46 -15.410 4.334 -7.501 1.00 0.00 C ATOM 2076 CH2 TRP B 46 -15.557 4.753 -6.173 1.00 0.00 C ATOM 0 H TRP B 46 -9.784 3.402 -7.230 1.00 0.00 H new ATOM 0 HA TRP B 46 -10.186 1.829 -9.700 1.00 0.00 H new ATOM 0 HB2 TRP B 46 -12.440 1.385 -8.817 1.00 0.00 H new ATOM 0 HB3 TRP B 46 -11.161 0.740 -7.808 1.00 0.00 H new ATOM 0 HD1 TRP B 46 -10.843 1.837 -5.353 1.00 0.00 H new ATOM 0 HE1 TRP B 46 -12.424 3.223 -3.851 1.00 0.00 H new ATOM 0 HE3 TRP B 46 -14.241 3.225 -8.912 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 -14.779 4.710 -4.186 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -16.140 4.637 -8.237 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -16.397 5.377 -5.905 1.00 0.00 H new ATOM 2087 N SER B 47 -12.092 3.393 -10.591 1.00 0.00 N ATOM 2088 CA SER B 47 -12.667 4.426 -11.435 1.00 0.00 C ATOM 2089 C SER B 47 -14.029 3.970 -11.949 1.00 0.00 C ATOM 2090 O SER B 47 -14.407 2.814 -11.738 1.00 0.00 O ATOM 2091 CB SER B 47 -11.728 4.693 -12.618 1.00 0.00 C ATOM 2092 OG SER B 47 -10.391 4.854 -12.187 1.00 0.00 O ATOM 0 H SER B 47 -12.402 2.448 -10.816 1.00 0.00 H new ATOM 0 HA SER B 47 -12.793 5.342 -10.857 1.00 0.00 H new ATOM 0 HB2 SER B 47 -11.787 3.866 -13.326 1.00 0.00 H new ATOM 0 HB3 SER B 47 -12.052 5.589 -13.147 1.00 0.00 H new ATOM 0 HG SER B 47 -10.080 5.755 -12.414 1.00 0.00 H new ATOM 2202 N LYS B 55 -3.699 0.918 -10.951 1.00 0.00 N ATOM 2203 CA LYS B 55 -3.332 -0.428 -10.529 1.00 0.00 C ATOM 2204 C LYS B 55 -3.904 -0.750 -9.155 1.00 0.00 C ATOM 2205 O LYS B 55 -4.583 0.078 -8.539 1.00 0.00 O ATOM 2206 CB LYS B 55 -1.808 -0.593 -10.496 1.00 0.00 C ATOM 2207 CG LYS B 55 -1.131 -0.441 -11.847 1.00 0.00 C ATOM 2208 CD LYS B 55 0.351 -0.773 -11.752 1.00 0.00 C ATOM 2209 CE LYS B 55 1.086 -0.499 -13.054 1.00 0.00 C ATOM 2210 NZ LYS B 55 2.517 -0.898 -12.968 1.00 0.00 N ATOM 0 HA LYS B 55 -3.753 -1.122 -11.257 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -1.390 0.143 -9.809 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -1.570 -1.577 -10.093 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -1.609 -1.098 -12.574 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -1.257 0.580 -12.209 1.00 0.00 H new ATOM 0 HD2 LYS B 55 0.802 -0.186 -10.952 1.00 0.00 H new ATOM 0 HD3 LYS B 55 0.470 -1.823 -11.484 1.00 0.00 H new ATOM 0 HE2 LYS B 55 0.604 -1.043 -13.866 1.00 0.00 H new ATOM 0 HE3 LYS B 55 1.017 0.562 -13.296 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 2.988 -0.697 -13.873 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 2.982 -0.361 -12.209 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 2.582 -1.915 -12.762 1.00 0.00 H new ATOM 2224 N GLY B 56 -3.620 -1.959 -8.695 1.00 0.00 N ATOM 2225 CA GLY B 56 -4.040 -2.393 -7.383 1.00 0.00 C ATOM 2226 C GLY B 56 -3.145 -3.505 -6.883 1.00 0.00 C ATOM 2227 O GLY B 56 -2.763 -4.384 -7.658 1.00 0.00 O ATOM 0 H GLY B 56 -3.095 -2.658 -9.221 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -4.010 -1.553 -6.688 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -5.073 -2.738 -7.421 1.00 0.00 H new ATOM 2231 N ILE B 57 -2.795 -3.468 -5.608 1.00 0.00 N ATOM 2232 CA ILE B 57 -1.870 -4.443 -5.051 1.00 0.00 C ATOM 2233 C ILE B 57 -2.444 -5.108 -3.803 1.00 0.00 C ATOM 2234 O ILE B 57 -2.889 -4.439 -2.865 1.00 0.00 O ATOM 2235 CB ILE B 57 -0.500 -3.796 -4.729 1.00 0.00 C ATOM 2236 CG1 ILE B 57 0.451 -4.825 -4.111 1.00 0.00 C ATOM 2237 CG2 ILE B 57 -0.667 -2.589 -3.813 1.00 0.00 C ATOM 2238 CD1 ILE B 57 1.838 -4.286 -3.834 1.00 0.00 C ATOM 0 H ILE B 57 -3.136 -2.776 -4.940 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.720 -5.212 -5.809 1.00 0.00 H new ATOM 0 HB ILE B 57 -0.062 -3.446 -5.664 1.00 0.00 H new ATOM 0 HG12 ILE B 57 0.020 -5.190 -3.179 1.00 0.00 H new ATOM 0 HG13 ILE B 57 0.531 -5.681 -4.782 1.00 0.00 H new ATOM 0 HG21 ILE B 57 0.310 -2.154 -3.603 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -1.298 -1.846 -4.301 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -1.133 -2.903 -2.879 1.00 0.00 H new ATOM 0 HD11 ILE B 57 2.453 -5.072 -3.397 1.00 0.00 H new ATOM 0 HD12 ILE B 57 2.290 -3.948 -4.766 1.00 0.00 H new ATOM 0 HD13 ILE B 57 1.771 -3.449 -3.139 1.00 0.00 H new ATOM 2250 N THR B 58 -2.437 -6.433 -3.805 1.00 0.00 N ATOM 2251 CA THR B 58 -2.947 -7.207 -2.690 1.00 0.00 C ATOM 2252 C THR B 58 -1.848 -7.512 -1.671 1.00 0.00 C ATOM 2253 O THR B 58 -0.738 -7.930 -2.029 1.00 0.00 O ATOM 2254 CB THR B 58 -3.569 -8.524 -3.188 1.00 0.00 C ATOM 2255 OG1 THR B 58 -2.722 -9.117 -4.184 1.00 0.00 O ATOM 2256 CG2 THR B 58 -4.959 -8.289 -3.764 1.00 0.00 C ATOM 0 H THR B 58 -2.079 -6.996 -4.576 1.00 0.00 H new ATOM 0 HA THR B 58 -3.714 -6.607 -2.199 1.00 0.00 H new ATOM 0 HB THR B 58 -3.661 -9.201 -2.339 1.00 0.00 H new ATOM 0 HG1 THR B 58 -3.122 -9.956 -4.496 1.00 0.00 H new ATOM 0 HG21 THR B 58 -5.375 -9.236 -4.108 1.00 0.00 H new ATOM 0 HG22 THR B 58 -5.605 -7.867 -2.994 1.00 0.00 H new ATOM 0 HG23 THR B 58 -4.893 -7.596 -4.602 1.00 0.00 H new ATOM 2264 N LEU B 59 -2.166 -7.299 -0.403 1.00 0.00 N ATOM 2265 CA LEU B 59 -1.238 -7.549 0.688 1.00 0.00 C ATOM 2266 C LEU B 59 -1.809 -8.596 1.635 1.00 0.00 C ATOM 2267 O LEU B 59 -3.001 -8.578 1.951 1.00 0.00 O ATOM 2268 CB LEU B 59 -0.956 -6.257 1.463 1.00 0.00 C ATOM 2269 CG LEU B 59 -0.305 -5.132 0.655 1.00 0.00 C ATOM 2270 CD1 LEU B 59 -0.118 -3.901 1.523 1.00 0.00 C ATOM 2271 CD2 LEU B 59 1.029 -5.586 0.091 1.00 0.00 C ATOM 0 H LEU B 59 -3.075 -6.948 -0.102 1.00 0.00 H new ATOM 0 HA LEU B 59 -0.304 -7.918 0.263 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -1.896 -5.888 1.874 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -0.310 -6.495 2.308 1.00 0.00 H new ATOM 0 HG LEU B 59 -0.963 -4.877 -0.176 1.00 0.00 H new ATOM 0 HD11 LEU B 59 0.346 -3.109 0.936 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -1.088 -3.562 1.887 1.00 0.00 H new ATOM 0 HD13 LEU B 59 0.522 -4.147 2.370 1.00 0.00 H new ATOM 0 HD21 LEU B 59 1.478 -4.774 -0.481 1.00 0.00 H new ATOM 0 HD22 LEU B 59 1.694 -5.865 0.909 1.00 0.00 H new ATOM 0 HD23 LEU B 59 0.875 -6.446 -0.561 1.00 0.00 H new ATOM 2283 N SER B 60 -0.963 -9.513 2.073 1.00 0.00 N ATOM 2284 CA SER B 60 -1.369 -10.536 3.020 1.00 0.00 C ATOM 2285 C SER B 60 -1.398 -9.963 4.435 1.00 0.00 C ATOM 2286 O SER B 60 -0.887 -8.867 4.676 1.00 0.00 O ATOM 2287 CB SER B 60 -0.408 -11.722 2.945 1.00 0.00 C ATOM 2288 OG SER B 60 -0.239 -12.147 1.601 1.00 0.00 O ATOM 0 H SER B 60 0.014 -9.569 1.786 1.00 0.00 H new ATOM 0 HA SER B 60 -2.372 -10.879 2.766 1.00 0.00 H new ATOM 0 HB2 SER B 60 0.557 -11.442 3.367 1.00 0.00 H new ATOM 0 HB3 SER B 60 -0.792 -12.546 3.547 1.00 0.00 H new ATOM 0 HG SER B 60 0.389 -11.548 1.145 1.00 0.00 H new ATOM 2294 N ASN B 61 -1.987 -10.709 5.362 1.00 0.00 N ATOM 2295 CA ASN B 61 -2.125 -10.263 6.748 1.00 0.00 C ATOM 2296 C ASN B 61 -0.746 -9.993 7.354 1.00 0.00 C ATOM 2297 O ASN B 61 -0.519 -8.947 7.964 1.00 0.00 O ATOM 2298 CB ASN B 61 -2.880 -11.323 7.563 1.00 0.00 C ATOM 2299 CG ASN B 61 -3.294 -10.855 8.954 1.00 0.00 C ATOM 2300 OD1 ASN B 61 -2.621 -10.048 9.594 1.00 0.00 O ATOM 2301 ND2 ASN B 61 -4.418 -11.360 9.431 1.00 0.00 N ATOM 0 H ASN B 61 -2.380 -11.632 5.179 1.00 0.00 H new ATOM 0 HA ASN B 61 -2.696 -9.335 6.772 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -3.771 -11.624 7.012 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -2.251 -12.208 7.660 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -4.750 -11.083 10.355 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -4.953 -12.027 8.876 1.00 0.00 H new ATOM 2308 N GLU B 62 0.177 -10.926 7.144 1.00 0.00 N ATOM 2309 CA GLU B 62 1.537 -10.796 7.662 1.00 0.00 C ATOM 2310 C GLU B 62 2.207 -9.530 7.128 1.00 0.00 C ATOM 2311 O GLU B 62 2.831 -8.778 7.881 1.00 0.00 O ATOM 2312 CB GLU B 62 2.367 -12.015 7.266 1.00 0.00 C ATOM 2313 CG GLU B 62 1.733 -13.333 7.669 1.00 0.00 C ATOM 2314 CD GLU B 62 2.571 -14.522 7.256 1.00 0.00 C ATOM 2315 OE1 GLU B 62 2.496 -14.930 6.082 1.00 0.00 O ATOM 2316 OE2 GLU B 62 3.308 -15.058 8.111 1.00 0.00 O ATOM 0 H GLU B 62 0.009 -11.783 6.617 1.00 0.00 H new ATOM 0 HA GLU B 62 1.479 -10.729 8.748 1.00 0.00 H new ATOM 0 HB2 GLU B 62 2.517 -12.008 6.186 1.00 0.00 H new ATOM 0 HB3 GLU B 62 3.353 -11.939 7.725 1.00 0.00 H new ATOM 0 HG2 GLU B 62 1.590 -13.350 8.749 1.00 0.00 H new ATOM 0 HG3 GLU B 62 0.745 -13.412 7.215 1.00 0.00 H new ATOM 2323 N GLU B 63 2.064 -9.301 5.829 1.00 0.00 N ATOM 2324 CA GLU B 63 2.656 -8.139 5.179 1.00 0.00 C ATOM 2325 C GLU B 63 2.060 -6.853 5.737 1.00 0.00 C ATOM 2326 O GLU B 63 2.777 -5.905 6.058 1.00 0.00 O ATOM 2327 CB GLU B 63 2.401 -8.188 3.672 1.00 0.00 C ATOM 2328 CG GLU B 63 2.897 -9.454 3.000 1.00 0.00 C ATOM 2329 CD GLU B 63 2.585 -9.463 1.522 1.00 0.00 C ATOM 2330 OE1 GLU B 63 3.347 -8.860 0.749 1.00 0.00 O ATOM 2331 OE2 GLU B 63 1.553 -10.049 1.128 1.00 0.00 O ATOM 0 H GLU B 63 1.539 -9.910 5.201 1.00 0.00 H new ATOM 0 HA GLU B 63 3.729 -8.155 5.372 1.00 0.00 H new ATOM 0 HB2 GLU B 63 1.330 -8.090 3.492 1.00 0.00 H new ATOM 0 HB3 GLU B 63 2.883 -7.329 3.205 1.00 0.00 H new ATOM 0 HG2 GLU B 63 3.974 -9.545 3.145 1.00 0.00 H new ATOM 0 HG3 GLU B 63 2.437 -10.321 3.474 1.00 0.00 H new ATOM 2338 N PHE B 64 0.741 -6.849 5.861 1.00 0.00 N ATOM 2339 CA PHE B 64 0.005 -5.669 6.286 1.00 0.00 C ATOM 2340 C PHE B 64 0.326 -5.316 7.737 1.00 0.00 C ATOM 2341 O PHE B 64 0.481 -4.145 8.081 1.00 0.00 O ATOM 2342 CB PHE B 64 -1.490 -5.922 6.119 1.00 0.00 C ATOM 2343 CG PHE B 64 -2.278 -4.691 5.795 1.00 0.00 C ATOM 2344 CD1 PHE B 64 -2.230 -4.146 4.524 1.00 0.00 C ATOM 2345 CD2 PHE B 64 -3.073 -4.090 6.750 1.00 0.00 C ATOM 2346 CE1 PHE B 64 -2.964 -3.017 4.213 1.00 0.00 C ATOM 2347 CE2 PHE B 64 -3.808 -2.966 6.447 1.00 0.00 C ATOM 2348 CZ PHE B 64 -3.755 -2.430 5.174 1.00 0.00 C ATOM 0 H PHE B 64 0.153 -7.661 5.671 1.00 0.00 H new ATOM 0 HA PHE B 64 0.304 -4.824 5.665 1.00 0.00 H new ATOM 0 HB2 PHE B 64 -1.639 -6.656 5.327 1.00 0.00 H new ATOM 0 HB3 PHE B 64 -1.880 -6.360 7.038 1.00 0.00 H new ATOM 0 HD1 PHE B 64 -1.613 -4.608 3.767 1.00 0.00 H new ATOM 0 HD2 PHE B 64 -3.119 -4.506 7.746 1.00 0.00 H new ATOM 0 HE1 PHE B 64 -2.917 -2.597 3.219 1.00 0.00 H new ATOM 0 HE2 PHE B 64 -4.425 -2.504 7.203 1.00 0.00 H new ATOM 0 HZ PHE B 64 -4.334 -1.551 4.934 1.00 0.00 H new ATOM 2358 N GLN B 65 0.430 -6.338 8.580 1.00 0.00 N ATOM 2359 CA GLN B 65 0.781 -6.142 9.980 1.00 0.00 C ATOM 2360 C GLN B 65 2.185 -5.543 10.083 1.00 0.00 C ATOM 2361 O GLN B 65 2.422 -4.609 10.854 1.00 0.00 O ATOM 2362 CB GLN B 65 0.717 -7.479 10.727 1.00 0.00 C ATOM 2363 CG GLN B 65 0.026 -7.406 12.083 1.00 0.00 C ATOM 2364 CD GLN B 65 0.689 -6.438 13.043 1.00 0.00 C ATOM 2365 OE1 GLN B 65 1.600 -6.807 13.782 1.00 0.00 O ATOM 2366 NE2 GLN B 65 0.218 -5.201 13.065 1.00 0.00 N ATOM 0 H GLN B 65 0.276 -7.311 8.317 1.00 0.00 H new ATOM 0 HA GLN B 65 0.070 -5.453 10.435 1.00 0.00 H new ATOM 0 HB2 GLN B 65 0.194 -8.205 10.104 1.00 0.00 H new ATOM 0 HB3 GLN B 65 1.731 -7.852 10.869 1.00 0.00 H new ATOM 0 HG2 GLN B 65 -1.013 -7.109 11.938 1.00 0.00 H new ATOM 0 HG3 GLN B 65 0.014 -8.400 12.531 1.00 0.00 H new ATOM 0 HE21 GLN B 65 -0.539 -4.932 12.436 1.00 0.00 H new ATOM 0 HE22 GLN B 65 0.612 -4.517 13.711 1.00 0.00 H new ATOM 2375 N THR B 66 3.099 -6.079 9.279 1.00 0.00 N ATOM 2376 CA THR B 66 4.466 -5.578 9.211 1.00 0.00 C ATOM 2377 C THR B 66 4.478 -4.101 8.801 1.00 0.00 C ATOM 2378 O THR B 66 5.179 -3.283 9.398 1.00 0.00 O ATOM 2379 CB THR B 66 5.297 -6.405 8.203 1.00 0.00 C ATOM 2380 OG1 THR B 66 5.251 -7.800 8.552 1.00 0.00 O ATOM 2381 CG2 THR B 66 6.743 -5.931 8.164 1.00 0.00 C ATOM 0 H THR B 66 2.913 -6.868 8.660 1.00 0.00 H new ATOM 0 HA THR B 66 4.911 -5.674 10.201 1.00 0.00 H new ATOM 0 HB THR B 66 4.863 -6.264 7.213 1.00 0.00 H new ATOM 0 HG1 THR B 66 4.369 -8.164 8.329 1.00 0.00 H new ATOM 0 HG21 THR B 66 7.303 -6.531 7.447 1.00 0.00 H new ATOM 0 HG22 THR B 66 6.775 -4.883 7.864 1.00 0.00 H new ATOM 0 HG23 THR B 66 7.188 -6.039 9.153 1.00 0.00 H new ATOM 2389 N MET B 67 3.677 -3.781 7.789 1.00 0.00 N ATOM 2390 CA MET B 67 3.542 -2.415 7.284 1.00 0.00 C ATOM 2391 C MET B 67 3.153 -1.451 8.399 1.00 0.00 C ATOM 2392 O MET B 67 3.788 -0.412 8.592 1.00 0.00 O ATOM 2393 CB MET B 67 2.487 -2.388 6.161 1.00 0.00 C ATOM 2394 CG MET B 67 2.200 -1.004 5.588 1.00 0.00 C ATOM 2395 SD MET B 67 0.957 -0.076 6.513 1.00 0.00 S ATOM 2396 CE MET B 67 -0.542 -0.941 6.045 1.00 0.00 C ATOM 0 H MET B 67 3.101 -4.462 7.294 1.00 0.00 H new ATOM 0 HA MET B 67 4.505 -2.092 6.889 1.00 0.00 H new ATOM 0 HB2 MET B 67 2.820 -3.039 5.353 1.00 0.00 H new ATOM 0 HB3 MET B 67 1.557 -2.807 6.545 1.00 0.00 H new ATOM 0 HG2 MET B 67 3.127 -0.431 5.567 1.00 0.00 H new ATOM 0 HG3 MET B 67 1.867 -1.110 4.556 1.00 0.00 H new ATOM 0 HE1 MET B 67 -1.184 -1.054 6.918 1.00 0.00 H new ATOM 0 HE2 MET B 67 -1.067 -0.370 5.279 1.00 0.00 H new ATOM 0 HE3 MET B 67 -0.287 -1.925 5.652 1.00 0.00 H new ATOM 2406 N VAL B 68 2.125 -1.826 9.139 1.00 0.00 N ATOM 2407 CA VAL B 68 1.541 -0.960 10.153 1.00 0.00 C ATOM 2408 C VAL B 68 2.517 -0.632 11.275 1.00 0.00 C ATOM 2409 O VAL B 68 2.623 0.522 11.677 1.00 0.00 O ATOM 2410 CB VAL B 68 0.254 -1.590 10.717 1.00 0.00 C ATOM 2411 CG1 VAL B 68 -0.261 -0.844 11.939 1.00 0.00 C ATOM 2412 CG2 VAL B 68 -0.800 -1.615 9.631 1.00 0.00 C ATOM 0 H VAL B 68 1.671 -2.736 9.056 1.00 0.00 H new ATOM 0 HA VAL B 68 1.294 -0.016 9.667 1.00 0.00 H new ATOM 0 HB VAL B 68 0.483 -2.606 11.040 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -1.170 -1.324 12.302 1.00 0.00 H new ATOM 0 HG12 VAL B 68 0.497 -0.862 12.722 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -0.479 0.189 11.669 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -1.715 -2.060 10.022 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -1.004 -0.597 9.299 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -0.441 -2.206 8.789 1.00 0.00 H new ATOM 2422 N ASP B 69 3.244 -1.627 11.770 1.00 0.00 N ATOM 2423 CA ASP B 69 4.181 -1.392 12.870 1.00 0.00 C ATOM 2424 C ASP B 69 5.387 -0.587 12.394 1.00 0.00 C ATOM 2425 O ASP B 69 5.859 0.324 13.088 1.00 0.00 O ATOM 2426 CB ASP B 69 4.652 -2.710 13.495 1.00 0.00 C ATOM 2427 CG ASP B 69 5.532 -2.483 14.710 1.00 0.00 C ATOM 2428 OD1 ASP B 69 4.985 -2.346 15.827 1.00 0.00 O ATOM 2429 OD2 ASP B 69 6.769 -2.429 14.553 1.00 0.00 O ATOM 0 H ASP B 69 3.207 -2.590 11.436 1.00 0.00 H new ATOM 0 HA ASP B 69 3.650 -0.820 13.631 1.00 0.00 H new ATOM 0 HB2 ASP B 69 3.785 -3.305 13.782 1.00 0.00 H new ATOM 0 HB3 ASP B 69 5.203 -3.287 12.752 1.00 0.00 H new ATOM 2434 N ALA B 70 5.868 -0.911 11.197 1.00 0.00 N ATOM 2435 CA ALA B 70 7.032 -0.250 10.633 1.00 0.00 C ATOM 2436 C ALA B 70 6.780 1.238 10.450 1.00 0.00 C ATOM 2437 O ALA B 70 7.618 2.062 10.810 1.00 0.00 O ATOM 2438 CB ALA B 70 7.415 -0.890 9.311 1.00 0.00 C ATOM 0 H ALA B 70 5.464 -1.632 10.599 1.00 0.00 H new ATOM 0 HA ALA B 70 7.860 -0.368 11.332 1.00 0.00 H new ATOM 0 HB1 ALA B 70 8.289 -0.383 8.901 1.00 0.00 H new ATOM 0 HB2 ALA B 70 7.647 -1.943 9.470 1.00 0.00 H new ATOM 0 HB3 ALA B 70 6.584 -0.804 8.611 1.00 0.00 H new ATOM 2444 N PHE B 71 5.618 1.580 9.906 1.00 0.00 N ATOM 2445 CA PHE B 71 5.266 2.977 9.687 1.00 0.00 C ATOM 2446 C PHE B 71 4.748 3.629 10.963 1.00 0.00 C ATOM 2447 O PHE B 71 4.850 4.847 11.125 1.00 0.00 O ATOM 2448 CB PHE B 71 4.243 3.114 8.562 1.00 0.00 C ATOM 2449 CG PHE B 71 4.824 2.863 7.205 1.00 0.00 C ATOM 2450 CD1 PHE B 71 5.869 3.644 6.739 1.00 0.00 C ATOM 2451 CD2 PHE B 71 4.329 1.856 6.396 1.00 0.00 C ATOM 2452 CE1 PHE B 71 6.414 3.419 5.491 1.00 0.00 C ATOM 2453 CE2 PHE B 71 4.867 1.628 5.149 1.00 0.00 C ATOM 2454 CZ PHE B 71 5.910 2.408 4.695 1.00 0.00 C ATOM 0 H PHE B 71 4.906 0.912 9.610 1.00 0.00 H new ATOM 0 HA PHE B 71 6.176 3.499 9.390 1.00 0.00 H new ATOM 0 HB2 PHE B 71 3.425 2.414 8.736 1.00 0.00 H new ATOM 0 HB3 PHE B 71 3.816 4.116 8.588 1.00 0.00 H new ATOM 0 HD1 PHE B 71 6.261 4.437 7.358 1.00 0.00 H new ATOM 0 HD2 PHE B 71 3.512 1.242 6.746 1.00 0.00 H new ATOM 0 HE1 PHE B 71 7.231 4.031 5.138 1.00 0.00 H new ATOM 0 HE2 PHE B 71 4.472 0.839 4.527 1.00 0.00 H new ATOM 0 HZ PHE B 71 6.333 2.229 3.718 1.00 0.00 H new ATOM 2464 N LYS B 72 4.193 2.814 11.861 1.00 0.00 N ATOM 2465 CA LYS B 72 3.763 3.277 13.182 1.00 0.00 C ATOM 2466 C LYS B 72 4.867 4.092 13.835 1.00 0.00 C ATOM 2467 O LYS B 72 4.630 5.182 14.359 1.00 0.00 O ATOM 2468 CB LYS B 72 3.438 2.071 14.065 1.00 0.00 C ATOM 2469 CG LYS B 72 3.098 2.417 15.505 1.00 0.00 C ATOM 2470 CD LYS B 72 3.320 1.223 16.419 1.00 0.00 C ATOM 2471 CE LYS B 72 2.499 0.020 15.989 1.00 0.00 C ATOM 2472 NZ LYS B 72 2.856 -1.195 16.766 1.00 0.00 N ATOM 0 H LYS B 72 4.029 1.821 11.695 1.00 0.00 H new ATOM 0 HA LYS B 72 2.877 3.901 13.067 1.00 0.00 H new ATOM 0 HB2 LYS B 72 2.599 1.531 13.626 1.00 0.00 H new ATOM 0 HB3 LYS B 72 4.291 1.392 14.059 1.00 0.00 H new ATOM 0 HG2 LYS B 72 3.714 3.253 15.837 1.00 0.00 H new ATOM 0 HG3 LYS B 72 2.059 2.741 15.569 1.00 0.00 H new ATOM 0 HD2 LYS B 72 4.378 0.959 16.421 1.00 0.00 H new ATOM 0 HD3 LYS B 72 3.058 1.495 17.441 1.00 0.00 H new ATOM 0 HE2 LYS B 72 1.439 0.237 16.120 1.00 0.00 H new ATOM 0 HE3 LYS B 72 2.657 -0.168 14.927 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 2.240 -1.983 16.480 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 3.848 -1.446 16.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 2.730 -1.007 17.781 1.00 0.00 H new ATOM 2486 N GLY B 73 6.071 3.546 13.793 1.00 0.00 N ATOM 2487 CA GLY B 73 7.216 4.238 14.339 1.00 0.00 C ATOM 2488 C GLY B 73 8.103 4.816 13.255 1.00 0.00 C ATOM 2489 O GLY B 73 9.330 4.792 13.370 1.00 0.00 O ATOM 0 H GLY B 73 6.276 2.632 13.389 1.00 0.00 H new ATOM 0 HA2 GLY B 73 6.876 5.040 14.994 1.00 0.00 H new ATOM 0 HA3 GLY B 73 7.796 3.549 14.953 1.00 0.00 H new ATOM 2493 N ASN B 74 7.488 5.344 12.202 1.00 0.00 N ATOM 2494 CA ASN B 74 8.246 5.882 11.077 1.00 0.00 C ATOM 2495 C ASN B 74 7.642 7.194 10.591 1.00 0.00 C ATOM 2496 O ASN B 74 8.224 8.260 10.784 1.00 0.00 O ATOM 2497 CB ASN B 74 8.277 4.872 9.928 1.00 0.00 C ATOM 2498 CG ASN B 74 9.372 5.136 8.902 1.00 0.00 C ATOM 2499 OD1 ASN B 74 9.853 4.205 8.258 1.00 0.00 O ATOM 2500 ND2 ASN B 74 9.783 6.387 8.744 1.00 0.00 N ATOM 0 H ASN B 74 6.475 5.411 12.103 1.00 0.00 H new ATOM 0 HA ASN B 74 9.264 6.073 11.417 1.00 0.00 H new ATOM 0 HB2 ASN B 74 8.413 3.872 10.340 1.00 0.00 H new ATOM 0 HB3 ASN B 74 7.311 4.881 9.424 1.00 0.00 H new ATOM 0 HD21 ASN B 74 10.520 6.601 8.072 1.00 0.00 H new ATOM 0 HD22 ASN B 74 9.362 7.135 9.295 1.00 0.00 H new ATOM 2507 N LEU B 75 6.473 7.123 9.969 1.00 0.00 N ATOM 2508 CA LEU B 75 5.895 8.301 9.334 1.00 0.00 C ATOM 2509 C LEU B 75 4.907 8.999 10.261 1.00 0.00 C ATOM 2510 O LEU B 75 3.710 9.062 9.993 1.00 0.00 O ATOM 2511 CB LEU B 75 5.229 7.946 8.002 1.00 0.00 C ATOM 2512 CG LEU B 75 4.830 9.149 7.142 1.00 0.00 C ATOM 2513 CD1 LEU B 75 6.059 9.957 6.755 1.00 0.00 C ATOM 2514 CD2 LEU B 75 4.076 8.698 5.902 1.00 0.00 C ATOM 0 H LEU B 75 5.912 6.275 9.890 1.00 0.00 H new ATOM 0 HA LEU B 75 6.712 8.993 9.127 1.00 0.00 H new ATOM 0 HB2 LEU B 75 5.909 7.317 7.428 1.00 0.00 H new ATOM 0 HB3 LEU B 75 4.339 7.351 8.204 1.00 0.00 H new ATOM 0 HG LEU B 75 4.169 9.785 7.730 1.00 0.00 H new ATOM 0 HD11 LEU B 75 5.757 10.808 6.144 1.00 0.00 H new ATOM 0 HD12 LEU B 75 6.557 10.315 7.656 1.00 0.00 H new ATOM 0 HD13 LEU B 75 6.744 9.328 6.187 1.00 0.00 H new ATOM 0 HD21 LEU B 75 3.802 9.569 5.306 1.00 0.00 H new ATOM 0 HD22 LEU B 75 4.710 8.038 5.310 1.00 0.00 H new ATOM 0 HD23 LEU B 75 3.174 8.164 6.199 1.00 0.00 H new ATOM 2526 N GLU B 76 5.436 9.492 11.368 1.00 0.00 N ATOM 2527 CA GLU B 76 4.691 10.329 12.300 1.00 0.00 C ATOM 2528 C GLU B 76 5.670 10.842 13.338 1.00 0.00 C ATOM 2529 O GLU B 76 5.868 10.226 14.385 1.00 0.00 O ATOM 2530 CB GLU B 76 3.538 9.559 12.967 1.00 0.00 C ATOM 2531 CG GLU B 76 2.385 10.441 13.444 1.00 0.00 C ATOM 2532 CD GLU B 76 2.703 11.235 14.700 1.00 0.00 C ATOM 2533 OE1 GLU B 76 2.574 10.665 15.806 1.00 0.00 O ATOM 2534 OE2 GLU B 76 3.061 12.431 14.593 1.00 0.00 O ATOM 0 H GLU B 76 6.402 9.323 11.650 1.00 0.00 H new ATOM 0 HA GLU B 76 4.232 11.158 11.761 1.00 0.00 H new ATOM 0 HB2 GLU B 76 3.150 8.825 12.260 1.00 0.00 H new ATOM 0 HB3 GLU B 76 3.932 9.004 13.819 1.00 0.00 H new ATOM 0 HG2 GLU B 76 2.114 11.133 12.646 1.00 0.00 H new ATOM 0 HG3 GLU B 76 1.513 9.814 13.632 1.00 0.00 H new