USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 914 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: B 127 ASN : amide:sc= -0.16 X(o=-0.24,f=0.076) USER MOD Set 1.2: B 130 ASN : amide:sc= 0.182 K(o=-0.24,f=-8.6!) USER MOD Set 1.3: B 161 ASN : amide:sc= -0.266 K(o=-0.24,f=-8.6) USER MOD Set 2.1: B 117 GLN : amide:sc= -0.128 X(o=-5.3,f=-4.8) USER MOD Set 2.2: B 131 CYS SG : rot -23:sc= -0.708 USER MOD Set 2.3: B 135 MET CE :methyl -159:sc= -4.43! (180deg=-3.69!) USER MOD Set 3.1: A 39 LYS NZ :NH3+ 175:sc= 0.982 (180deg=-0.0155) USER MOD Set 3.2: B 172 SER OG : rot 180:sc= 0.486 USER MOD Set 4.1: A 17 GLN : amide:sc= 0 X(o=-3.5,f=-3.9) USER MOD Set 4.2: A 31 CYS SG : rot -160:sc= -1.44 USER MOD Set 4.3: A 35 MET CE :methyl -115:sc= -2.03 (180deg=-2.37!) USER MOD Set 5.1: A 27 ASN : amide:sc= -1.42 K(o=-2.2,f=0.54) USER MOD Set 5.2: A 30 ASN : amide:sc= -0.996! C(o=-2.2!,f=-8.4!) USER MOD Set 5.3: A 61 ASN : amide:sc= 0.173 K(o=-2.2,f=-8.4) USER MOD Single : A 22 LYS NZ :NH3+ -121:sc= -1.31 (180deg=-1.6!) USER MOD Single : A 23 MET CE :methyl 160:sc= -0.67 (180deg=-2.03) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 89:sc= 1.03 USER MOD Single : A 36 HIS : no HD1:sc= -0.148 X(o=-0.15,f=-0.0065) USER MOD Single : A 37 HIS : no HD1:sc= -0.574 K(o=-0.57,f=0.15) USER MOD Single : A 40 ASN : amide:sc= -3.09! C(o=-3.1!,f=-5.7!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -1.18 X(o=-1.2,f=-0.84) USER MOD Single : A 53 THR OG1 : rot 64:sc= 0.994 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -1.7 K(o=-1.7,f=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= 0.674 K(o=0.67,f=-3.2!) USER MOD Single : A 71 THR OG1 : rot 50:sc= 1.24 USER MOD Single : A 72 SER OG : rot 53:sc= 0.0628 USER MOD Single : B 122 LYS NZ :NH3+ -167:sc= -0.46 (180deg=-1.08!) USER MOD Single : B 123 MET CE :methyl 150:sc= -0.482 (180deg=-3.05!) USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 133 SER OG : rot 86:sc= 0.155 USER MOD Single : B 136 HIS : no HD1:sc= -0.0491 X(o=-0.049,f=0) USER MOD Single : B 137 HIS : no HD1:sc= -0.78 K(o=-0.78,f=0.22) USER MOD Single : B 139 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0127) USER MOD Single : B 140 ASN : amide:sc= -3.63! C(o=-3.6!,f=-7.1!) USER MOD Single : B 148 SER OG : rot 125:sc= 1.26 USER MOD Single : B 149 GLN : amide:sc= -0.247 X(o=-0.25,f=-0.22) USER MOD Single : B 153 THR OG1 : rot 76:sc= 1.28 USER MOD Single : B 154 SER OG : rot 180:sc= 0 USER MOD Single : B 158 ASN : amide:sc= -0.822 K(o=-0.82,f=0) USER MOD Single : B 163 LYS NZ :NH3+ -174:sc=-0.00483 (180deg=-0.0647) USER MOD Single : B 164 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 166 TYR OH : rot 180:sc= 0 USER MOD Single : B 170 HIS : no HE2:sc= 0.394 K(o=0.39,f=-1.6!) USER MOD Single : B 171 THR OG1 : rot 45:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 217 N GLY A 15 9.528 2.051 8.721 1.00 0.00 N ATOM 218 CA GLY A 15 8.249 2.600 8.260 1.00 0.00 C ATOM 219 C GLY A 15 7.571 1.745 7.183 1.00 0.00 C ATOM 220 O GLY A 15 6.532 1.133 7.438 1.00 0.00 O ATOM 0 HA2 GLY A 15 7.576 2.698 9.112 1.00 0.00 H new ATOM 0 HA3 GLY A 15 8.414 3.603 7.867 1.00 0.00 H new ATOM 224 N PRO A 16 8.141 1.676 5.976 1.00 0.00 N ATOM 225 CA PRO A 16 7.578 0.873 4.892 1.00 0.00 C ATOM 226 C PRO A 16 7.757 -0.662 5.118 1.00 0.00 C ATOM 227 O PRO A 16 6.936 -1.473 4.662 1.00 0.00 O ATOM 228 CB PRO A 16 8.354 1.380 3.664 1.00 0.00 C ATOM 229 CG PRO A 16 9.659 1.813 4.210 1.00 0.00 C ATOM 230 CD PRO A 16 9.347 2.415 5.547 1.00 0.00 C ATOM 0 HA PRO A 16 6.498 0.985 4.797 1.00 0.00 H new ATOM 0 HB2 PRO A 16 8.476 0.595 2.918 1.00 0.00 H new ATOM 0 HB3 PRO A 16 7.833 2.204 3.177 1.00 0.00 H new ATOM 0 HG2 PRO A 16 10.344 0.971 4.308 1.00 0.00 H new ATOM 0 HG3 PRO A 16 10.139 2.539 3.554 1.00 0.00 H new ATOM 0 HD2 PRO A 16 10.170 2.285 6.249 1.00 0.00 H new ATOM 0 HD3 PRO A 16 9.158 3.486 5.472 1.00 0.00 H new ATOM 238 N GLN A 17 8.796 -1.047 5.855 1.00 0.00 N ATOM 239 CA GLN A 17 9.064 -2.464 6.145 1.00 0.00 C ATOM 240 C GLN A 17 7.984 -3.044 7.044 1.00 0.00 C ATOM 241 O GLN A 17 7.400 -4.094 6.754 1.00 0.00 O ATOM 242 CB GLN A 17 10.426 -2.617 6.794 1.00 0.00 C ATOM 243 CG GLN A 17 10.723 -4.023 7.275 1.00 0.00 C ATOM 244 CD GLN A 17 12.113 -4.165 7.827 1.00 0.00 C ATOM 245 OE1 GLN A 17 12.668 -3.232 8.388 1.00 0.00 O ATOM 246 NE2 GLN A 17 12.693 -5.314 7.650 1.00 0.00 N ATOM 0 H GLN A 17 9.470 -0.401 6.265 1.00 0.00 H new ATOM 0 HA GLN A 17 9.058 -3.014 5.204 1.00 0.00 H new ATOM 0 HB2 GLN A 17 11.193 -2.318 6.080 1.00 0.00 H new ATOM 0 HB3 GLN A 17 10.494 -1.932 7.640 1.00 0.00 H new ATOM 0 HG2 GLN A 17 10.001 -4.300 8.043 1.00 0.00 H new ATOM 0 HG3 GLN A 17 10.592 -4.721 6.448 1.00 0.00 H new ATOM 0 HE21 GLN A 17 12.196 -6.069 7.177 1.00 0.00 H new ATOM 0 HE22 GLN A 17 13.645 -5.461 7.984 1.00 0.00 H new ATOM 255 N ASP A 18 7.711 -2.343 8.116 1.00 0.00 N ATOM 256 CA ASP A 18 6.666 -2.713 9.053 1.00 0.00 C ATOM 257 C ASP A 18 5.324 -2.646 8.365 1.00 0.00 C ATOM 258 O ASP A 18 4.377 -3.361 8.730 1.00 0.00 O ATOM 259 CB ASP A 18 6.699 -1.825 10.299 1.00 0.00 C ATOM 260 CG ASP A 18 5.637 -2.168 11.308 1.00 0.00 C ATOM 261 OD1 ASP A 18 5.651 -3.280 11.844 1.00 0.00 O ATOM 262 OD2 ASP A 18 4.767 -1.324 11.584 1.00 0.00 O ATOM 0 H ASP A 18 8.210 -1.490 8.370 1.00 0.00 H new ATOM 0 HA ASP A 18 6.838 -3.736 9.387 1.00 0.00 H new ATOM 0 HB2 ASP A 18 7.678 -1.910 10.770 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.580 -0.784 9.997 1.00 0.00 H new ATOM 267 N PHE A 19 5.245 -1.779 7.342 1.00 0.00 N ATOM 268 CA PHE A 19 4.021 -1.576 6.606 1.00 0.00 C ATOM 269 C PHE A 19 3.645 -2.859 5.883 1.00 0.00 C ATOM 270 O PHE A 19 2.477 -3.179 5.746 1.00 0.00 O ATOM 271 CB PHE A 19 4.183 -0.430 5.617 1.00 0.00 C ATOM 272 CG PHE A 19 2.897 0.130 5.145 1.00 0.00 C ATOM 273 CD1 PHE A 19 2.080 0.791 6.041 1.00 0.00 C ATOM 274 CD2 PHE A 19 2.492 0.010 3.826 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.889 1.325 5.648 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.289 0.550 3.429 1.00 0.00 C ATOM 277 CZ PHE A 19 0.491 1.209 4.349 1.00 0.00 C ATOM 0 H PHE A 19 6.028 -1.212 7.017 1.00 0.00 H new ATOM 0 HA PHE A 19 3.223 -1.314 7.300 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.766 0.364 6.085 1.00 0.00 H new ATOM 0 HB3 PHE A 19 4.755 -0.781 4.758 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.390 0.887 7.071 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.117 -0.505 3.112 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.263 1.838 6.363 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.968 0.460 2.402 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.452 1.633 4.036 1.00 0.00 H new ATOM 287 N LEU A 20 4.652 -3.584 5.441 1.00 0.00 N ATOM 288 CA LEU A 20 4.461 -4.881 4.817 1.00 0.00 C ATOM 289 C LEU A 20 4.043 -5.906 5.832 1.00 0.00 C ATOM 290 O LEU A 20 3.018 -6.502 5.703 1.00 0.00 O ATOM 291 CB LEU A 20 5.739 -5.369 4.168 1.00 0.00 C ATOM 292 CG LEU A 20 6.306 -4.520 3.068 1.00 0.00 C ATOM 293 CD1 LEU A 20 7.592 -5.134 2.565 1.00 0.00 C ATOM 294 CD2 LEU A 20 5.303 -4.382 1.943 1.00 0.00 C ATOM 0 H LEU A 20 5.627 -3.292 5.503 1.00 0.00 H new ATOM 0 HA LEU A 20 3.684 -4.757 4.063 1.00 0.00 H new ATOM 0 HB2 LEU A 20 6.497 -5.470 4.944 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.558 -6.367 3.768 1.00 0.00 H new ATOM 0 HG LEU A 20 6.520 -3.524 3.456 1.00 0.00 H new ATOM 0 HD11 LEU A 20 8.002 -4.516 1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.310 -5.194 3.382 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.392 -6.135 2.183 1.00 0.00 H new ATOM 0 HD21 LEU A 20 5.727 -3.764 1.152 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.065 -5.368 1.545 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.394 -3.914 2.321 1.00 0.00 H new ATOM 306 N LEU A 21 4.835 -6.054 6.876 1.00 0.00 N ATOM 307 CA LEU A 21 4.640 -7.107 7.902 1.00 0.00 C ATOM 308 C LEU A 21 3.268 -7.045 8.590 1.00 0.00 C ATOM 309 O LEU A 21 2.841 -8.011 9.228 1.00 0.00 O ATOM 310 CB LEU A 21 5.729 -7.000 8.967 1.00 0.00 C ATOM 311 CG LEU A 21 7.158 -7.159 8.487 1.00 0.00 C ATOM 312 CD1 LEU A 21 8.132 -6.849 9.609 1.00 0.00 C ATOM 313 CD2 LEU A 21 7.379 -8.565 7.993 1.00 0.00 C ATOM 0 H LEU A 21 5.640 -5.454 7.054 1.00 0.00 H new ATOM 0 HA LEU A 21 4.696 -8.060 7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.638 -6.029 9.453 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.538 -7.756 9.728 1.00 0.00 H new ATOM 0 HG LEU A 21 7.331 -6.459 7.670 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.153 -6.968 9.247 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.984 -5.823 9.946 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.959 -7.533 10.440 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.408 -8.672 7.650 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.192 -9.269 8.804 1.00 0.00 H new ATOM 0 HD23 LEU A 21 6.698 -8.772 7.168 1.00 0.00 H new ATOM 325 N LYS A 22 2.589 -5.933 8.480 1.00 0.00 N ATOM 326 CA LYS A 22 1.298 -5.787 9.107 1.00 0.00 C ATOM 327 C LYS A 22 0.175 -6.126 8.144 1.00 0.00 C ATOM 328 O LYS A 22 -1.012 -6.035 8.497 1.00 0.00 O ATOM 329 CB LYS A 22 1.113 -4.386 9.625 1.00 0.00 C ATOM 330 CG LYS A 22 1.084 -3.345 8.546 1.00 0.00 C ATOM 331 CD LYS A 22 0.727 -1.985 9.072 1.00 0.00 C ATOM 332 CE LYS A 22 1.890 -1.266 9.798 1.00 0.00 C ATOM 333 NZ LYS A 22 2.261 -1.867 11.103 1.00 0.00 N ATOM 0 H LYS A 22 2.907 -5.114 7.962 1.00 0.00 H new ATOM 0 HA LYS A 22 1.261 -6.486 9.943 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.183 -4.337 10.191 1.00 0.00 H new ATOM 0 HB3 LYS A 22 1.921 -4.155 10.319 1.00 0.00 H new ATOM 0 HG2 LYS A 22 2.060 -3.300 8.062 1.00 0.00 H new ATOM 0 HG3 LYS A 22 0.363 -3.637 7.783 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.390 -1.363 8.243 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.113 -2.082 9.760 1.00 0.00 H new ATOM 0 HE2 LYS A 22 2.765 -1.269 9.148 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.614 -0.223 9.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 2.155 -1.157 11.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 1.639 -2.677 11.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 3.249 -2.190 11.068 1.00 0.00 H new ATOM 347 N MET A 23 0.533 -6.515 6.944 1.00 0.00 N ATOM 348 CA MET A 23 -0.437 -6.834 5.940 1.00 0.00 C ATOM 349 C MET A 23 -0.849 -8.298 6.132 1.00 0.00 C ATOM 350 O MET A 23 -0.138 -9.050 6.800 1.00 0.00 O ATOM 351 CB MET A 23 0.150 -6.636 4.519 1.00 0.00 C ATOM 352 CG MET A 23 0.638 -5.221 4.208 1.00 0.00 C ATOM 353 SD MET A 23 1.216 -5.054 2.503 1.00 0.00 S ATOM 354 CE MET A 23 1.701 -3.332 2.433 1.00 0.00 C ATOM 0 H MET A 23 1.502 -6.617 6.643 1.00 0.00 H new ATOM 0 HA MET A 23 -1.298 -6.173 6.039 1.00 0.00 H new ATOM 0 HB2 MET A 23 0.982 -7.327 4.388 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.610 -6.910 3.788 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.171 -4.513 4.386 1.00 0.00 H new ATOM 0 HG3 MET A 23 1.447 -4.960 4.891 1.00 0.00 H new ATOM 0 HE1 MET A 23 2.383 -3.180 1.597 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.816 -2.710 2.297 1.00 0.00 H new ATOM 0 HE3 MET A 23 2.199 -3.056 3.363 1.00 0.00 H new ATOM 364 N PRO A 24 -2.001 -8.718 5.631 1.00 0.00 N ATOM 365 CA PRO A 24 -2.376 -10.109 5.686 1.00 0.00 C ATOM 366 C PRO A 24 -1.769 -10.865 4.508 1.00 0.00 C ATOM 367 O PRO A 24 -2.054 -10.551 3.373 1.00 0.00 O ATOM 368 CB PRO A 24 -3.910 -10.091 5.581 1.00 0.00 C ATOM 369 CG PRO A 24 -4.288 -8.722 5.088 1.00 0.00 C ATOM 370 CD PRO A 24 -3.029 -7.891 4.991 1.00 0.00 C ATOM 0 HA PRO A 24 -2.026 -10.605 6.591 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -4.261 -10.861 4.894 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.368 -10.295 6.549 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -4.775 -8.789 4.115 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -5.000 -8.256 5.769 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -2.775 -7.672 3.954 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.144 -6.934 5.500 1.00 0.00 H new ATOM 378 N GLY A 25 -0.918 -11.825 4.775 1.00 0.00 N ATOM 379 CA GLY A 25 -0.316 -12.574 3.702 1.00 0.00 C ATOM 380 C GLY A 25 1.149 -12.274 3.542 1.00 0.00 C ATOM 381 O GLY A 25 1.682 -12.309 2.439 1.00 0.00 O ATOM 0 H GLY A 25 -0.630 -12.103 5.713 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.447 -13.640 3.889 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.834 -12.348 2.770 1.00 0.00 H new ATOM 385 N VAL A 26 1.799 -11.988 4.634 1.00 0.00 N ATOM 386 CA VAL A 26 3.208 -11.672 4.616 1.00 0.00 C ATOM 387 C VAL A 26 3.907 -12.233 5.881 1.00 0.00 C ATOM 388 O VAL A 26 3.258 -12.475 6.906 1.00 0.00 O ATOM 389 CB VAL A 26 3.376 -10.131 4.518 1.00 0.00 C ATOM 390 CG1 VAL A 26 2.735 -9.463 5.686 1.00 0.00 C ATOM 391 CG2 VAL A 26 4.825 -9.697 4.342 1.00 0.00 C ATOM 0 H VAL A 26 1.374 -11.966 5.561 1.00 0.00 H new ATOM 0 HA VAL A 26 3.679 -12.137 3.750 1.00 0.00 H new ATOM 0 HB VAL A 26 2.863 -9.810 3.611 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.862 -8.384 5.602 1.00 0.00 H new ATOM 0 HG12 VAL A 26 1.672 -9.703 5.704 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.202 -9.813 6.607 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.874 -8.610 4.280 1.00 0.00 H new ATOM 0 HG22 VAL A 26 5.413 -10.039 5.193 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.226 -10.131 3.426 1.00 0.00 H new ATOM 401 N ASN A 27 5.205 -12.475 5.774 1.00 0.00 N ATOM 402 CA ASN A 27 6.059 -12.923 6.877 1.00 0.00 C ATOM 403 C ASN A 27 7.343 -12.173 6.751 1.00 0.00 C ATOM 404 O ASN A 27 7.629 -11.654 5.686 1.00 0.00 O ATOM 405 CB ASN A 27 6.409 -14.430 6.837 1.00 0.00 C ATOM 406 CG ASN A 27 5.237 -15.369 6.911 1.00 0.00 C ATOM 407 OD1 ASN A 27 4.736 -15.684 7.983 1.00 0.00 O ATOM 408 ND2 ASN A 27 4.857 -15.893 5.797 1.00 0.00 N ATOM 0 H ASN A 27 5.712 -12.364 4.896 1.00 0.00 H new ATOM 0 HA ASN A 27 5.517 -12.745 7.806 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.958 -14.633 5.917 1.00 0.00 H new ATOM 0 HB3 ASN A 27 7.082 -14.651 7.665 1.00 0.00 H new ATOM 0 HD21 ASN A 27 4.116 -16.594 5.790 1.00 0.00 H new ATOM 0 HD22 ASN A 27 5.297 -15.607 4.922 1.00 0.00 H new ATOM 415 N ALA A 28 8.148 -12.159 7.788 1.00 0.00 N ATOM 416 CA ALA A 28 9.423 -11.434 7.766 1.00 0.00 C ATOM 417 C ALA A 28 10.365 -11.978 6.697 1.00 0.00 C ATOM 418 O ALA A 28 11.105 -11.219 6.056 1.00 0.00 O ATOM 419 CB ALA A 28 10.074 -11.459 9.138 1.00 0.00 C ATOM 0 H ALA A 28 7.953 -12.640 8.666 1.00 0.00 H new ATOM 0 HA ALA A 28 9.211 -10.397 7.506 1.00 0.00 H new ATOM 0 HB1 ALA A 28 11.019 -10.916 9.102 1.00 0.00 H new ATOM 0 HB2 ALA A 28 9.412 -10.987 9.864 1.00 0.00 H new ATOM 0 HB3 ALA A 28 10.260 -12.492 9.434 1.00 0.00 H new ATOM 425 N LYS A 29 10.273 -13.265 6.455 1.00 0.00 N ATOM 426 CA LYS A 29 11.131 -13.938 5.494 1.00 0.00 C ATOM 427 C LYS A 29 10.796 -13.522 4.054 1.00 0.00 C ATOM 428 O LYS A 29 11.684 -13.189 3.227 1.00 0.00 O ATOM 429 CB LYS A 29 11.046 -15.467 5.704 1.00 0.00 C ATOM 430 CG LYS A 29 9.624 -16.050 5.662 1.00 0.00 C ATOM 431 CD LYS A 29 9.591 -17.507 6.111 1.00 0.00 C ATOM 432 CE LYS A 29 8.163 -18.033 6.150 1.00 0.00 C ATOM 433 NZ LYS A 29 8.081 -19.438 6.609 1.00 0.00 N ATOM 0 H LYS A 29 9.602 -13.880 6.916 1.00 0.00 H new ATOM 0 HA LYS A 29 12.164 -13.633 5.662 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.647 -15.958 4.938 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.495 -15.712 6.667 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.970 -15.458 6.303 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.231 -15.974 4.648 1.00 0.00 H new ATOM 0 HD2 LYS A 29 10.188 -18.115 5.431 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.043 -17.597 7.099 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.567 -17.404 6.812 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.725 -17.954 5.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.087 -19.743 6.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.626 -20.046 5.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.473 -19.513 7.569 1.00 0.00 H new ATOM 447 N ASN A 30 9.540 -13.436 3.770 1.00 0.00 N ATOM 448 CA ASN A 30 9.140 -13.124 2.433 1.00 0.00 C ATOM 449 C ASN A 30 9.032 -11.629 2.228 1.00 0.00 C ATOM 450 O ASN A 30 8.998 -11.162 1.120 1.00 0.00 O ATOM 451 CB ASN A 30 7.888 -13.896 2.002 1.00 0.00 C ATOM 452 CG ASN A 30 6.624 -13.628 2.814 1.00 0.00 C ATOM 453 OD1 ASN A 30 6.396 -12.549 3.303 1.00 0.00 O ATOM 454 ND2 ASN A 30 5.821 -14.643 2.985 1.00 0.00 N ATOM 0 H ASN A 30 8.778 -13.575 4.434 1.00 0.00 H new ATOM 0 HA ASN A 30 9.927 -13.469 1.763 1.00 0.00 H new ATOM 0 HB2 ASN A 30 7.682 -13.661 0.958 1.00 0.00 H new ATOM 0 HB3 ASN A 30 8.108 -14.962 2.051 1.00 0.00 H new ATOM 0 HD21 ASN A 30 4.975 -14.535 3.544 1.00 0.00 H new ATOM 0 HD22 ASN A 30 6.040 -15.544 2.559 1.00 0.00 H new ATOM 461 N CYS A 31 9.022 -10.907 3.323 1.00 0.00 N ATOM 462 CA CYS A 31 9.025 -9.457 3.335 1.00 0.00 C ATOM 463 C CYS A 31 10.374 -8.939 2.833 1.00 0.00 C ATOM 464 O CYS A 31 10.430 -8.093 1.954 1.00 0.00 O ATOM 465 CB CYS A 31 8.758 -8.977 4.758 1.00 0.00 C ATOM 466 SG CYS A 31 8.804 -7.203 5.028 1.00 0.00 S ATOM 0 H CYS A 31 9.011 -11.319 4.256 1.00 0.00 H new ATOM 0 HA CYS A 31 8.246 -9.074 2.676 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.778 -9.343 5.063 1.00 0.00 H new ATOM 0 HB3 CYS A 31 9.491 -9.441 5.418 1.00 0.00 H new ATOM 0 HG CYS A 31 8.983 -6.961 6.293 1.00 0.00 H new ATOM 472 N ARG A 32 11.463 -9.479 3.370 1.00 0.00 N ATOM 473 CA ARG A 32 12.805 -9.087 2.926 1.00 0.00 C ATOM 474 C ARG A 32 13.004 -9.496 1.474 1.00 0.00 C ATOM 475 O ARG A 32 13.533 -8.736 0.652 1.00 0.00 O ATOM 476 CB ARG A 32 13.877 -9.691 3.848 1.00 0.00 C ATOM 477 CG ARG A 32 13.865 -11.205 3.942 1.00 0.00 C ATOM 478 CD ARG A 32 14.895 -11.872 3.028 1.00 0.00 C ATOM 479 NE ARG A 32 14.876 -13.323 3.220 1.00 0.00 N ATOM 480 CZ ARG A 32 15.434 -14.242 2.429 1.00 0.00 C ATOM 481 NH1 ARG A 32 16.021 -13.892 1.284 1.00 0.00 N ATOM 482 NH2 ARG A 32 15.389 -15.519 2.790 1.00 0.00 N ATOM 0 H ARG A 32 11.449 -10.184 4.107 1.00 0.00 H new ATOM 0 HA ARG A 32 12.906 -8.003 2.987 1.00 0.00 H new ATOM 0 HB2 ARG A 32 14.858 -9.372 3.497 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.747 -9.279 4.849 1.00 0.00 H new ATOM 0 HG2 ARG A 32 14.058 -11.500 4.973 1.00 0.00 H new ATOM 0 HG3 ARG A 32 12.871 -11.571 3.686 1.00 0.00 H new ATOM 0 HD2 ARG A 32 14.677 -11.633 1.987 1.00 0.00 H new ATOM 0 HD3 ARG A 32 15.890 -11.482 3.244 1.00 0.00 H new ATOM 0 HE ARG A 32 14.385 -13.668 4.045 1.00 0.00 H new ATOM 0 HH11 ARG A 32 16.047 -12.912 1.003 1.00 0.00 H new ATOM 0 HH12 ARG A 32 16.444 -14.605 0.689 1.00 0.00 H new ATOM 0 HH21 ARG A 32 14.932 -15.787 3.662 1.00 0.00 H new ATOM 0 HH22 ARG A 32 15.811 -16.232 2.195 1.00 0.00 H new ATOM 496 N SER A 33 12.525 -10.683 1.157 1.00 0.00 N ATOM 497 CA SER A 33 12.552 -11.179 -0.192 1.00 0.00 C ATOM 498 C SER A 33 11.743 -10.246 -1.118 1.00 0.00 C ATOM 499 O SER A 33 12.137 -9.950 -2.268 1.00 0.00 O ATOM 500 CB SER A 33 11.962 -12.568 -0.178 1.00 0.00 C ATOM 501 OG SER A 33 12.741 -13.441 0.634 1.00 0.00 O ATOM 0 H SER A 33 12.108 -11.325 1.831 1.00 0.00 H new ATOM 0 HA SER A 33 13.573 -11.211 -0.572 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.940 -12.530 0.198 1.00 0.00 H new ATOM 0 HB3 SER A 33 11.913 -12.957 -1.195 1.00 0.00 H new ATOM 0 HG SER A 33 12.422 -13.399 1.560 1.00 0.00 H new ATOM 507 N LEU A 34 10.664 -9.733 -0.578 1.00 0.00 N ATOM 508 CA LEU A 34 9.781 -8.853 -1.297 1.00 0.00 C ATOM 509 C LEU A 34 10.503 -7.573 -1.593 1.00 0.00 C ATOM 510 O LEU A 34 10.402 -7.069 -2.653 1.00 0.00 O ATOM 511 CB LEU A 34 8.557 -8.523 -0.485 1.00 0.00 C ATOM 512 CG LEU A 34 7.410 -7.895 -1.252 1.00 0.00 C ATOM 513 CD1 LEU A 34 6.608 -8.943 -2.004 1.00 0.00 C ATOM 514 CD2 LEU A 34 6.549 -7.077 -0.347 1.00 0.00 C ATOM 0 H LEU A 34 10.373 -9.918 0.382 1.00 0.00 H new ATOM 0 HA LEU A 34 9.474 -9.356 -2.214 1.00 0.00 H new ATOM 0 HB2 LEU A 34 8.198 -9.438 -0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.848 -7.845 0.318 1.00 0.00 H new ATOM 0 HG LEU A 34 7.831 -7.222 -1.999 1.00 0.00 H new ATOM 0 HD11 LEU A 34 5.793 -8.460 -2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 34 7.257 -9.459 -2.712 1.00 0.00 H new ATOM 0 HD13 LEU A 34 6.198 -9.664 -1.297 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.733 -6.637 -0.921 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.139 -7.713 0.438 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.145 -6.283 0.103 1.00 0.00 H new ATOM 526 N MET A 35 11.285 -7.098 -0.641 1.00 0.00 N ATOM 527 CA MET A 35 12.058 -5.849 -0.803 1.00 0.00 C ATOM 528 C MET A 35 13.039 -5.979 -1.919 1.00 0.00 C ATOM 529 O MET A 35 13.412 -5.021 -2.566 1.00 0.00 O ATOM 530 CB MET A 35 12.830 -5.537 0.442 1.00 0.00 C ATOM 531 CG MET A 35 11.963 -5.403 1.612 1.00 0.00 C ATOM 532 SD MET A 35 12.865 -5.123 3.093 1.00 0.00 S ATOM 533 CE MET A 35 11.509 -5.288 4.177 1.00 0.00 C ATOM 0 H MET A 35 11.412 -7.551 0.264 1.00 0.00 H new ATOM 0 HA MET A 35 11.344 -5.053 -1.015 1.00 0.00 H new ATOM 0 HB2 MET A 35 13.560 -6.326 0.622 1.00 0.00 H new ATOM 0 HB3 MET A 35 13.389 -4.612 0.298 1.00 0.00 H new ATOM 0 HG2 MET A 35 11.269 -4.578 1.452 1.00 0.00 H new ATOM 0 HG3 MET A 35 11.364 -6.307 1.721 1.00 0.00 H new ATOM 0 HE1 MET A 35 11.320 -4.335 4.671 1.00 0.00 H new ATOM 0 HE2 MET A 35 10.626 -5.585 3.612 1.00 0.00 H new ATOM 0 HE3 MET A 35 11.733 -6.047 4.927 1.00 0.00 H new ATOM 543 N HIS A 36 13.488 -7.180 -2.114 1.00 0.00 N ATOM 544 CA HIS A 36 14.433 -7.451 -3.150 1.00 0.00 C ATOM 545 C HIS A 36 13.765 -7.693 -4.486 1.00 0.00 C ATOM 546 O HIS A 36 14.430 -7.695 -5.521 1.00 0.00 O ATOM 547 CB HIS A 36 15.360 -8.595 -2.773 1.00 0.00 C ATOM 548 CG HIS A 36 16.358 -8.235 -1.708 1.00 0.00 C ATOM 549 ND1 HIS A 36 17.706 -8.471 -1.819 1.00 0.00 N ATOM 550 CD2 HIS A 36 16.187 -7.657 -0.501 1.00 0.00 C ATOM 551 CE1 HIS A 36 18.309 -8.053 -0.728 1.00 0.00 C ATOM 552 NE2 HIS A 36 17.405 -7.556 0.083 1.00 0.00 N ATOM 0 H HIS A 36 13.212 -7.994 -1.564 1.00 0.00 H new ATOM 0 HA HIS A 36 15.044 -6.555 -3.262 1.00 0.00 H new ATOM 0 HB2 HIS A 36 14.761 -9.438 -2.428 1.00 0.00 H new ATOM 0 HB3 HIS A 36 15.895 -8.927 -3.663 1.00 0.00 H new ATOM 0 HD2 HIS A 36 15.248 -7.333 -0.077 1.00 0.00 H new ATOM 0 HE1 HIS A 36 19.370 -8.109 -0.532 1.00 0.00 H new ATOM 0 HE2 HIS A 36 17.590 -7.158 1.004 1.00 0.00 H new ATOM 561 N HIS A 37 12.465 -7.916 -4.485 1.00 0.00 N ATOM 562 CA HIS A 37 11.751 -8.117 -5.753 1.00 0.00 C ATOM 563 C HIS A 37 10.749 -6.996 -6.055 1.00 0.00 C ATOM 564 O HIS A 37 10.221 -6.905 -7.164 1.00 0.00 O ATOM 565 CB HIS A 37 11.056 -9.485 -5.790 1.00 0.00 C ATOM 566 CG HIS A 37 11.990 -10.657 -5.925 1.00 0.00 C ATOM 567 ND1 HIS A 37 12.265 -11.267 -7.123 1.00 0.00 N ATOM 568 CD2 HIS A 37 12.702 -11.338 -5.001 1.00 0.00 C ATOM 569 CE1 HIS A 37 13.096 -12.257 -6.934 1.00 0.00 C ATOM 570 NE2 HIS A 37 13.381 -12.324 -5.656 1.00 0.00 N ATOM 0 H HIS A 37 11.884 -7.964 -3.648 1.00 0.00 H new ATOM 0 HA HIS A 37 12.508 -8.088 -6.537 1.00 0.00 H new ATOM 0 HB2 HIS A 37 10.471 -9.606 -4.878 1.00 0.00 H new ATOM 0 HB3 HIS A 37 10.353 -9.499 -6.623 1.00 0.00 H new ATOM 0 HD2 HIS A 37 12.729 -11.139 -3.940 1.00 0.00 H new ATOM 0 HE1 HIS A 37 13.483 -12.911 -7.702 1.00 0.00 H new ATOM 0 HE2 HIS A 37 14.008 -13.002 -5.222 1.00 0.00 H new ATOM 579 N VAL A 38 10.522 -6.146 -5.088 1.00 0.00 N ATOM 580 CA VAL A 38 9.530 -5.079 -5.168 1.00 0.00 C ATOM 581 C VAL A 38 10.144 -3.805 -4.596 1.00 0.00 C ATOM 582 O VAL A 38 10.933 -3.868 -3.667 1.00 0.00 O ATOM 583 CB VAL A 38 8.245 -5.435 -4.324 1.00 0.00 C ATOM 584 CG1 VAL A 38 7.179 -4.377 -4.442 1.00 0.00 C ATOM 585 CG2 VAL A 38 7.669 -6.782 -4.712 1.00 0.00 C ATOM 0 H VAL A 38 11.025 -6.167 -4.201 1.00 0.00 H new ATOM 0 HA VAL A 38 9.240 -4.947 -6.211 1.00 0.00 H new ATOM 0 HB VAL A 38 8.572 -5.482 -3.285 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.314 -4.664 -3.845 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.569 -3.425 -4.081 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.882 -4.275 -5.486 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.786 -6.988 -4.107 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.392 -6.769 -5.766 1.00 0.00 H new ATOM 0 HG23 VAL A 38 8.414 -7.559 -4.542 1.00 0.00 H new ATOM 595 N LYS A 39 9.786 -2.671 -5.160 1.00 0.00 N ATOM 596 CA LYS A 39 10.290 -1.382 -4.714 1.00 0.00 C ATOM 597 C LYS A 39 9.628 -0.961 -3.401 1.00 0.00 C ATOM 598 O LYS A 39 10.294 -0.827 -2.370 1.00 0.00 O ATOM 599 CB LYS A 39 10.001 -0.357 -5.785 1.00 0.00 C ATOM 600 CG LYS A 39 10.374 1.055 -5.441 1.00 0.00 C ATOM 601 CD LYS A 39 9.926 1.980 -6.534 1.00 0.00 C ATOM 602 CE LYS A 39 10.134 3.424 -6.168 1.00 0.00 C ATOM 603 NZ LYS A 39 11.570 3.779 -5.981 1.00 0.00 N ATOM 0 H LYS A 39 9.135 -2.613 -5.943 1.00 0.00 H new ATOM 0 HA LYS A 39 11.363 -1.457 -4.540 1.00 0.00 H new ATOM 0 HB2 LYS A 39 10.532 -0.645 -6.692 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.936 -0.388 -6.016 1.00 0.00 H new ATOM 0 HG2 LYS A 39 9.912 1.343 -4.497 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.453 1.133 -5.305 1.00 0.00 H new ATOM 0 HD2 LYS A 39 10.475 1.755 -7.448 1.00 0.00 H new ATOM 0 HD3 LYS A 39 8.871 1.808 -6.746 1.00 0.00 H new ATOM 0 HE2 LYS A 39 9.708 4.055 -6.948 1.00 0.00 H new ATOM 0 HE3 LYS A 39 9.589 3.642 -5.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 11.656 4.802 -5.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.952 3.262 -5.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.105 3.521 -6.835 1.00 0.00 H new ATOM 617 N ASN A 40 8.330 -0.711 -3.460 1.00 0.00 N ATOM 618 CA ASN A 40 7.548 -0.348 -2.316 1.00 0.00 C ATOM 619 C ASN A 40 6.080 -0.623 -2.674 1.00 0.00 C ATOM 620 O ASN A 40 5.833 -1.336 -3.665 1.00 0.00 O ATOM 621 CB ASN A 40 7.836 1.143 -1.912 1.00 0.00 C ATOM 622 CG ASN A 40 7.119 1.597 -0.638 1.00 0.00 C ATOM 623 OD1 ASN A 40 6.059 2.151 -0.689 1.00 0.00 O ATOM 624 ND2 ASN A 40 7.666 1.305 0.489 1.00 0.00 N ATOM 0 H ASN A 40 7.792 -0.759 -4.325 1.00 0.00 H new ATOM 0 HA ASN A 40 7.806 -0.935 -1.435 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.910 1.270 -1.776 1.00 0.00 H new ATOM 0 HB3 ASN A 40 7.540 1.794 -2.734 1.00 0.00 H new ATOM 0 HD21 ASN A 40 7.196 1.546 1.362 1.00 0.00 H new ATOM 0 HD22 ASN A 40 8.570 0.833 0.510 1.00 0.00 H new ATOM 631 N ILE A 41 5.156 -0.063 -1.909 1.00 0.00 N ATOM 632 CA ILE A 41 3.708 -0.202 -2.021 1.00 0.00 C ATOM 633 C ILE A 41 3.246 -0.189 -3.471 1.00 0.00 C ATOM 634 O ILE A 41 2.490 -1.065 -3.884 1.00 0.00 O ATOM 635 CB ILE A 41 3.059 1.001 -1.316 1.00 0.00 C ATOM 636 CG1 ILE A 41 3.365 0.994 0.183 1.00 0.00 C ATOM 637 CG2 ILE A 41 1.543 1.069 -1.563 1.00 0.00 C ATOM 638 CD1 ILE A 41 2.884 2.232 0.901 1.00 0.00 C ATOM 0 H ILE A 41 5.416 0.547 -1.134 1.00 0.00 H new ATOM 0 HA ILE A 41 3.421 -1.153 -1.573 1.00 0.00 H new ATOM 0 HB ILE A 41 3.499 1.898 -1.752 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.902 0.118 0.636 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.441 0.896 0.326 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.129 1.934 -1.046 1.00 0.00 H new ATOM 0 HG22 ILE A 41 1.352 1.160 -2.632 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.072 0.161 -1.186 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.134 2.159 1.959 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.366 3.111 0.474 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.803 2.321 0.789 1.00 0.00 H new ATOM 650 N ALA A 42 3.726 0.808 -4.232 1.00 0.00 N ATOM 651 CA ALA A 42 3.347 0.960 -5.637 1.00 0.00 C ATOM 652 C ALA A 42 3.538 -0.314 -6.438 1.00 0.00 C ATOM 653 O ALA A 42 2.603 -0.806 -7.042 1.00 0.00 O ATOM 654 CB ALA A 42 4.098 2.111 -6.270 1.00 0.00 C ATOM 0 H ALA A 42 4.376 1.517 -3.894 1.00 0.00 H new ATOM 0 HA ALA A 42 2.280 1.182 -5.654 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.802 2.208 -7.315 1.00 0.00 H new ATOM 0 HB2 ALA A 42 3.864 3.034 -5.740 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.170 1.922 -6.212 1.00 0.00 H new ATOM 660 N GLU A 43 4.718 -0.876 -6.371 1.00 0.00 N ATOM 661 CA GLU A 43 5.047 -2.051 -7.144 1.00 0.00 C ATOM 662 C GLU A 43 4.394 -3.276 -6.547 1.00 0.00 C ATOM 663 O GLU A 43 4.003 -4.168 -7.262 1.00 0.00 O ATOM 664 CB GLU A 43 6.559 -2.202 -7.235 1.00 0.00 C ATOM 665 CG GLU A 43 7.255 -0.925 -7.676 1.00 0.00 C ATOM 666 CD GLU A 43 6.702 -0.371 -8.950 1.00 0.00 C ATOM 667 OE1 GLU A 43 7.133 -0.791 -10.024 1.00 0.00 O ATOM 668 OE2 GLU A 43 5.850 0.513 -8.888 1.00 0.00 O ATOM 0 H GLU A 43 5.477 -0.535 -5.781 1.00 0.00 H new ATOM 0 HA GLU A 43 4.659 -1.939 -8.157 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.948 -2.505 -6.263 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.798 -3.001 -7.937 1.00 0.00 H new ATOM 0 HG2 GLU A 43 7.162 -0.176 -6.889 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.319 -1.123 -7.803 1.00 0.00 H new ATOM 675 N LEU A 44 4.245 -3.285 -5.232 1.00 0.00 N ATOM 676 CA LEU A 44 3.578 -4.384 -4.539 1.00 0.00 C ATOM 677 C LEU A 44 2.144 -4.499 -5.012 1.00 0.00 C ATOM 678 O LEU A 44 1.643 -5.584 -5.272 1.00 0.00 O ATOM 679 CB LEU A 44 3.618 -4.161 -3.015 1.00 0.00 C ATOM 680 CG LEU A 44 2.824 -5.152 -2.156 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.256 -6.580 -2.428 1.00 0.00 C ATOM 682 CD2 LEU A 44 2.988 -4.823 -0.691 1.00 0.00 C ATOM 0 H LEU A 44 4.577 -2.542 -4.618 1.00 0.00 H new ATOM 0 HA LEU A 44 4.102 -5.312 -4.768 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.659 -4.189 -2.694 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.248 -3.157 -2.808 1.00 0.00 H new ATOM 0 HG LEU A 44 1.771 -5.063 -2.422 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.676 -7.261 -1.805 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.088 -6.817 -3.478 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.315 -6.690 -2.197 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.419 -5.534 -0.092 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.042 -4.883 -0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.621 -3.814 -0.501 1.00 0.00 H new ATOM 694 N ALA A 45 1.519 -3.367 -5.167 1.00 0.00 N ATOM 695 CA ALA A 45 0.165 -3.313 -5.578 1.00 0.00 C ATOM 696 C ALA A 45 0.030 -3.415 -7.084 1.00 0.00 C ATOM 697 O ALA A 45 -1.061 -3.689 -7.607 1.00 0.00 O ATOM 698 CB ALA A 45 -0.465 -2.054 -5.063 1.00 0.00 C ATOM 0 H ALA A 45 1.947 -2.455 -5.008 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.358 -4.172 -5.157 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -1.507 -2.013 -5.380 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.416 -2.042 -3.974 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.069 -1.191 -5.460 1.00 0.00 H new ATOM 704 N ALA A 46 1.129 -3.208 -7.774 1.00 0.00 N ATOM 705 CA ALA A 46 1.142 -3.255 -9.218 1.00 0.00 C ATOM 706 C ALA A 46 1.387 -4.664 -9.717 1.00 0.00 C ATOM 707 O ALA A 46 0.935 -5.031 -10.816 1.00 0.00 O ATOM 708 CB ALA A 46 2.188 -2.310 -9.782 1.00 0.00 C ATOM 0 H ALA A 46 2.035 -3.003 -7.352 1.00 0.00 H new ATOM 0 HA ALA A 46 0.160 -2.934 -9.566 1.00 0.00 H new ATOM 0 HB1 ALA A 46 2.178 -2.364 -10.871 1.00 0.00 H new ATOM 0 HB2 ALA A 46 1.965 -1.291 -9.467 1.00 0.00 H new ATOM 0 HB3 ALA A 46 3.173 -2.596 -9.414 1.00 0.00 H new ATOM 714 N LEU A 47 2.081 -5.456 -8.922 1.00 0.00 N ATOM 715 CA LEU A 47 2.403 -6.807 -9.303 1.00 0.00 C ATOM 716 C LEU A 47 1.209 -7.737 -9.118 1.00 0.00 C ATOM 717 O LEU A 47 0.293 -7.447 -8.346 1.00 0.00 O ATOM 718 CB LEU A 47 3.613 -7.345 -8.535 1.00 0.00 C ATOM 719 CG LEU A 47 4.939 -6.616 -8.758 1.00 0.00 C ATOM 720 CD1 LEU A 47 6.046 -7.292 -7.979 1.00 0.00 C ATOM 721 CD2 LEU A 47 5.288 -6.544 -10.238 1.00 0.00 C ATOM 0 H LEU A 47 2.432 -5.180 -8.005 1.00 0.00 H new ATOM 0 HA LEU A 47 2.661 -6.779 -10.362 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.382 -7.316 -7.470 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.750 -8.393 -8.803 1.00 0.00 H new ATOM 0 HG LEU A 47 4.829 -5.594 -8.395 1.00 0.00 H new ATOM 0 HD11 LEU A 47 6.984 -6.763 -8.147 1.00 0.00 H new ATOM 0 HD12 LEU A 47 5.805 -7.276 -6.916 1.00 0.00 H new ATOM 0 HD13 LEU A 47 6.147 -8.325 -8.312 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.236 -6.020 -10.363 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.375 -7.553 -10.641 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.503 -6.007 -10.771 1.00 0.00 H new ATOM 733 N SER A 48 1.219 -8.838 -9.816 1.00 0.00 N ATOM 734 CA SER A 48 0.140 -9.793 -9.753 1.00 0.00 C ATOM 735 C SER A 48 0.368 -10.811 -8.634 1.00 0.00 C ATOM 736 O SER A 48 1.479 -10.916 -8.087 1.00 0.00 O ATOM 737 CB SER A 48 -0.009 -10.462 -11.113 1.00 0.00 C ATOM 738 OG SER A 48 -0.221 -9.471 -12.112 1.00 0.00 O ATOM 0 H SER A 48 1.976 -9.102 -10.447 1.00 0.00 H new ATOM 0 HA SER A 48 -0.790 -9.278 -9.514 1.00 0.00 H new ATOM 0 HB2 SER A 48 0.885 -11.041 -11.345 1.00 0.00 H new ATOM 0 HB3 SER A 48 -0.846 -11.161 -11.096 1.00 0.00 H new ATOM 0 HG SER A 48 -0.315 -9.903 -12.987 1.00 0.00 H new ATOM 744 N GLN A 49 -0.675 -11.573 -8.306 1.00 0.00 N ATOM 745 CA GLN A 49 -0.628 -12.548 -7.226 1.00 0.00 C ATOM 746 C GLN A 49 0.404 -13.620 -7.516 1.00 0.00 C ATOM 747 O GLN A 49 1.023 -14.160 -6.600 1.00 0.00 O ATOM 748 CB GLN A 49 -2.000 -13.184 -7.021 1.00 0.00 C ATOM 749 CG GLN A 49 -2.064 -14.159 -5.866 1.00 0.00 C ATOM 750 CD GLN A 49 -3.395 -14.856 -5.765 1.00 0.00 C ATOM 751 OE1 GLN A 49 -4.438 -14.297 -6.100 1.00 0.00 O ATOM 752 NE2 GLN A 49 -3.372 -16.081 -5.328 1.00 0.00 N ATOM 0 H GLN A 49 -1.575 -11.529 -8.784 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.341 -12.028 -6.312 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.733 -12.395 -6.857 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.289 -13.702 -7.936 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.277 -14.904 -5.981 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.866 -13.627 -4.936 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -2.486 -16.510 -5.060 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.240 -16.612 -5.254 1.00 0.00 H new ATOM 761 N ASP A 50 0.618 -13.899 -8.788 1.00 0.00 N ATOM 762 CA ASP A 50 1.591 -14.909 -9.199 1.00 0.00 C ATOM 763 C ASP A 50 2.987 -14.486 -8.811 1.00 0.00 C ATOM 764 O ASP A 50 3.789 -15.301 -8.346 1.00 0.00 O ATOM 765 CB ASP A 50 1.538 -15.172 -10.689 1.00 0.00 C ATOM 766 CG ASP A 50 2.503 -16.260 -11.091 1.00 0.00 C ATOM 767 OD1 ASP A 50 2.238 -17.430 -10.801 1.00 0.00 O ATOM 768 OD2 ASP A 50 3.542 -15.968 -11.703 1.00 0.00 O ATOM 0 H ASP A 50 0.133 -13.442 -9.560 1.00 0.00 H new ATOM 0 HA ASP A 50 1.331 -15.833 -8.682 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.526 -15.458 -10.974 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.774 -14.256 -11.230 1.00 0.00 H new ATOM 773 N GLU A 51 3.249 -13.195 -8.955 1.00 0.00 N ATOM 774 CA GLU A 51 4.522 -12.609 -8.577 1.00 0.00 C ATOM 775 C GLU A 51 4.733 -12.808 -7.098 1.00 0.00 C ATOM 776 O GLU A 51 5.795 -13.236 -6.663 1.00 0.00 O ATOM 777 CB GLU A 51 4.557 -11.120 -8.930 1.00 0.00 C ATOM 778 CG GLU A 51 4.429 -10.843 -10.412 1.00 0.00 C ATOM 779 CD GLU A 51 5.509 -11.529 -11.211 1.00 0.00 C ATOM 780 OE1 GLU A 51 6.644 -11.018 -11.279 1.00 0.00 O ATOM 781 OE2 GLU A 51 5.248 -12.604 -11.767 1.00 0.00 O ATOM 0 H GLU A 51 2.582 -12.525 -9.338 1.00 0.00 H new ATOM 0 HA GLU A 51 5.324 -13.100 -9.128 1.00 0.00 H new ATOM 0 HB2 GLU A 51 3.749 -10.612 -8.403 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.492 -10.692 -8.569 1.00 0.00 H new ATOM 0 HG2 GLU A 51 3.452 -11.178 -10.760 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.477 -9.768 -10.585 1.00 0.00 H new ATOM 788 N LEU A 52 3.682 -12.571 -6.335 1.00 0.00 N ATOM 789 CA LEU A 52 3.731 -12.765 -4.903 1.00 0.00 C ATOM 790 C LEU A 52 3.923 -14.240 -4.574 1.00 0.00 C ATOM 791 O LEU A 52 4.644 -14.576 -3.670 1.00 0.00 O ATOM 792 CB LEU A 52 2.468 -12.232 -4.222 1.00 0.00 C ATOM 793 CG LEU A 52 2.136 -10.761 -4.453 1.00 0.00 C ATOM 794 CD1 LEU A 52 0.898 -10.367 -3.672 1.00 0.00 C ATOM 795 CD2 LEU A 52 3.312 -9.869 -4.090 1.00 0.00 C ATOM 0 H LEU A 52 2.783 -12.243 -6.687 1.00 0.00 H new ATOM 0 HA LEU A 52 4.582 -12.201 -4.521 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.621 -12.829 -4.560 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.565 -12.395 -3.149 1.00 0.00 H new ATOM 0 HG LEU A 52 1.931 -10.623 -5.515 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.676 -9.315 -3.849 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.054 -10.975 -3.997 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.073 -10.527 -2.608 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.046 -8.827 -4.265 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.563 -10.008 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.172 -10.132 -4.706 1.00 0.00 H new ATOM 807 N THR A 53 3.311 -15.117 -5.346 1.00 0.00 N ATOM 808 CA THR A 53 3.445 -16.545 -5.108 1.00 0.00 C ATOM 809 C THR A 53 4.890 -16.978 -5.375 1.00 0.00 C ATOM 810 O THR A 53 5.409 -17.846 -4.711 1.00 0.00 O ATOM 811 CB THR A 53 2.485 -17.372 -5.988 1.00 0.00 C ATOM 812 OG1 THR A 53 1.158 -16.790 -5.948 1.00 0.00 O ATOM 813 CG2 THR A 53 2.396 -18.803 -5.466 1.00 0.00 C ATOM 0 H THR A 53 2.719 -14.870 -6.139 1.00 0.00 H new ATOM 0 HA THR A 53 3.183 -16.732 -4.067 1.00 0.00 H new ATOM 0 HB THR A 53 2.867 -17.372 -7.009 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.181 -15.894 -6.345 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.716 -19.378 -6.094 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.385 -19.261 -5.488 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.024 -18.794 -4.442 1.00 0.00 H new ATOM 821 N SER A 54 5.527 -16.317 -6.308 1.00 0.00 N ATOM 822 CA SER A 54 6.900 -16.603 -6.643 1.00 0.00 C ATOM 823 C SER A 54 7.835 -16.099 -5.530 1.00 0.00 C ATOM 824 O SER A 54 8.730 -16.810 -5.091 1.00 0.00 O ATOM 825 CB SER A 54 7.250 -15.962 -7.999 1.00 0.00 C ATOM 826 OG SER A 54 8.578 -16.260 -8.413 1.00 0.00 O ATOM 0 H SER A 54 5.109 -15.566 -6.857 1.00 0.00 H new ATOM 0 HA SER A 54 7.034 -17.681 -6.729 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.549 -16.314 -8.756 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.128 -14.881 -7.929 1.00 0.00 H new ATOM 0 HG SER A 54 8.754 -15.834 -9.278 1.00 0.00 H new ATOM 832 N ILE A 55 7.592 -14.884 -5.065 1.00 0.00 N ATOM 833 CA ILE A 55 8.419 -14.253 -4.034 1.00 0.00 C ATOM 834 C ILE A 55 8.221 -14.916 -2.668 1.00 0.00 C ATOM 835 O ILE A 55 9.184 -15.332 -2.011 1.00 0.00 O ATOM 836 CB ILE A 55 8.067 -12.745 -3.908 1.00 0.00 C ATOM 837 CG1 ILE A 55 8.294 -12.036 -5.250 1.00 0.00 C ATOM 838 CG2 ILE A 55 8.899 -12.085 -2.801 1.00 0.00 C ATOM 839 CD1 ILE A 55 7.712 -10.638 -5.320 1.00 0.00 C ATOM 0 H ILE A 55 6.818 -14.303 -5.388 1.00 0.00 H new ATOM 0 HA ILE A 55 9.459 -14.374 -4.338 1.00 0.00 H new ATOM 0 HB ILE A 55 7.014 -12.655 -3.639 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.365 -11.982 -5.443 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.857 -12.640 -6.046 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.637 -11.029 -2.729 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.693 -12.575 -1.850 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.959 -12.181 -3.036 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.916 -10.208 -6.300 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.635 -10.684 -5.161 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.166 -10.016 -4.549 1.00 0.00 H new ATOM 851 N LEU A 56 6.975 -15.020 -2.260 1.00 0.00 N ATOM 852 CA LEU A 56 6.637 -15.528 -0.948 1.00 0.00 C ATOM 853 C LEU A 56 6.747 -17.047 -0.946 1.00 0.00 C ATOM 854 O LEU A 56 7.112 -17.662 0.051 1.00 0.00 O ATOM 855 CB LEU A 56 5.202 -15.103 -0.550 1.00 0.00 C ATOM 856 CG LEU A 56 4.766 -13.647 -0.884 1.00 0.00 C ATOM 857 CD1 LEU A 56 3.394 -13.368 -0.345 1.00 0.00 C ATOM 858 CD2 LEU A 56 5.747 -12.604 -0.385 1.00 0.00 C ATOM 0 H LEU A 56 6.169 -14.756 -2.827 1.00 0.00 H new ATOM 0 HA LEU A 56 7.333 -15.111 -0.221 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.503 -15.783 -1.036 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.094 -15.248 0.525 1.00 0.00 H new ATOM 0 HG LEU A 56 4.751 -13.573 -1.971 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.108 -12.345 -0.589 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.680 -14.061 -0.791 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.395 -13.496 0.738 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.387 -11.610 -0.649 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.840 -12.681 0.698 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.721 -12.771 -0.845 1.00 0.00 H new ATOM 870 N GLY A 57 6.421 -17.641 -2.070 1.00 0.00 N ATOM 871 CA GLY A 57 6.498 -19.077 -2.232 1.00 0.00 C ATOM 872 C GLY A 57 5.247 -19.788 -1.783 1.00 0.00 C ATOM 873 O GLY A 57 5.125 -20.999 -1.953 1.00 0.00 O ATOM 0 H GLY A 57 6.095 -17.144 -2.899 1.00 0.00 H new ATOM 0 HA2 GLY A 57 6.685 -19.309 -3.280 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.348 -19.456 -1.665 1.00 0.00 H new ATOM 877 N ASN A 58 4.302 -19.044 -1.231 1.00 0.00 N ATOM 878 CA ASN A 58 3.072 -19.640 -0.762 1.00 0.00 C ATOM 879 C ASN A 58 1.933 -18.892 -1.382 1.00 0.00 C ATOM 880 O ASN A 58 1.864 -17.653 -1.265 1.00 0.00 O ATOM 881 CB ASN A 58 2.888 -19.577 0.784 1.00 0.00 C ATOM 882 CG ASN A 58 4.152 -19.381 1.590 1.00 0.00 C ATOM 883 OD1 ASN A 58 4.868 -20.325 1.921 1.00 0.00 O ATOM 884 ND2 ASN A 58 4.380 -18.157 1.985 1.00 0.00 N ATOM 0 H ASN A 58 4.366 -18.035 -1.100 1.00 0.00 H new ATOM 0 HA ASN A 58 3.103 -20.693 -1.042 1.00 0.00 H new ATOM 0 HB2 ASN A 58 2.202 -18.763 1.016 1.00 0.00 H new ATOM 0 HB3 ASN A 58 2.410 -20.500 1.112 1.00 0.00 H new ATOM 0 HD21 ASN A 58 5.176 -17.956 2.590 1.00 0.00 H new ATOM 0 HD22 ASN A 58 3.762 -17.402 1.688 1.00 0.00 H new ATOM 891 N ALA A 59 1.038 -19.614 -2.011 1.00 0.00 N ATOM 892 CA ALA A 59 -0.145 -19.040 -2.632 1.00 0.00 C ATOM 893 C ALA A 59 -1.061 -18.461 -1.575 1.00 0.00 C ATOM 894 O ALA A 59 -1.807 -17.538 -1.845 1.00 0.00 O ATOM 895 CB ALA A 59 -0.894 -20.089 -3.435 1.00 0.00 C ATOM 0 H ALA A 59 1.105 -20.627 -2.111 1.00 0.00 H new ATOM 0 HA ALA A 59 0.177 -18.246 -3.306 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.775 -19.638 -3.891 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.243 -20.483 -4.216 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.202 -20.901 -2.776 1.00 0.00 H new ATOM 901 N ALA A 60 -0.958 -18.985 -0.358 1.00 0.00 N ATOM 902 CA ALA A 60 -1.774 -18.532 0.752 1.00 0.00 C ATOM 903 C ALA A 60 -1.456 -17.088 1.047 1.00 0.00 C ATOM 904 O ALA A 60 -2.324 -16.236 1.013 1.00 0.00 O ATOM 905 CB ALA A 60 -1.511 -19.379 1.979 1.00 0.00 C ATOM 0 H ALA A 60 -0.307 -19.733 -0.119 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.826 -18.627 0.485 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.131 -19.027 2.804 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.753 -20.419 1.762 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.460 -19.301 2.256 1.00 0.00 H new ATOM 911 N ASN A 61 -0.179 -16.814 1.259 1.00 0.00 N ATOM 912 CA ASN A 61 0.281 -15.464 1.540 1.00 0.00 C ATOM 913 C ASN A 61 -0.007 -14.555 0.369 1.00 0.00 C ATOM 914 O ASN A 61 -0.517 -13.456 0.533 1.00 0.00 O ATOM 915 CB ASN A 61 1.782 -15.427 1.822 1.00 0.00 C ATOM 916 CG ASN A 61 2.211 -15.714 3.246 1.00 0.00 C ATOM 917 OD1 ASN A 61 3.222 -15.202 3.683 1.00 0.00 O ATOM 918 ND2 ASN A 61 1.503 -16.529 3.957 1.00 0.00 N ATOM 0 H ASN A 61 0.562 -17.514 1.241 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.256 -15.122 2.425 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.270 -16.149 1.167 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.157 -14.442 1.545 1.00 0.00 H new ATOM 0 HD21 ASN A 61 1.789 -16.756 4.909 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.658 -16.945 3.566 1.00 0.00 H new ATOM 925 N ALA A 62 0.257 -15.072 -0.819 1.00 0.00 N ATOM 926 CA ALA A 62 0.120 -14.326 -2.050 1.00 0.00 C ATOM 927 C ALA A 62 -1.311 -13.907 -2.283 1.00 0.00 C ATOM 928 O ALA A 62 -1.567 -12.783 -2.685 1.00 0.00 O ATOM 929 CB ALA A 62 0.618 -15.162 -3.209 1.00 0.00 C ATOM 0 H ALA A 62 0.576 -16.032 -0.953 1.00 0.00 H new ATOM 0 HA ALA A 62 0.721 -13.420 -1.971 1.00 0.00 H new ATOM 0 HB1 ALA A 62 0.514 -14.598 -4.136 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.667 -15.412 -3.053 1.00 0.00 H new ATOM 0 HB3 ALA A 62 0.032 -16.079 -3.275 1.00 0.00 H new ATOM 935 N LYS A 63 -2.243 -14.794 -1.989 1.00 0.00 N ATOM 936 CA LYS A 63 -3.623 -14.509 -2.205 1.00 0.00 C ATOM 937 C LYS A 63 -4.123 -13.557 -1.164 1.00 0.00 C ATOM 938 O LYS A 63 -4.810 -12.599 -1.489 1.00 0.00 O ATOM 939 CB LYS A 63 -4.469 -15.787 -2.241 1.00 0.00 C ATOM 940 CG LYS A 63 -5.958 -15.499 -2.336 1.00 0.00 C ATOM 941 CD LYS A 63 -6.799 -16.736 -2.523 1.00 0.00 C ATOM 942 CE LYS A 63 -8.257 -16.345 -2.662 1.00 0.00 C ATOM 943 NZ LYS A 63 -9.137 -17.495 -2.945 1.00 0.00 N ATOM 0 H LYS A 63 -2.054 -15.717 -1.599 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.720 -14.037 -3.183 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.165 -16.396 -3.093 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.273 -16.374 -1.344 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.279 -14.985 -1.430 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -6.136 -14.819 -3.169 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.472 -17.279 -3.409 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.671 -17.406 -1.673 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.587 -15.860 -1.743 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.356 -15.612 -3.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -10.120 -17.167 -3.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.844 -17.945 -3.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -9.067 -18.184 -2.169 1.00 0.00 H new ATOM 957 N GLN A 64 -3.731 -13.793 0.074 1.00 0.00 N ATOM 958 CA GLN A 64 -4.148 -12.952 1.183 1.00 0.00 C ATOM 959 C GLN A 64 -3.715 -11.511 0.973 1.00 0.00 C ATOM 960 O GLN A 64 -4.520 -10.570 1.139 1.00 0.00 O ATOM 961 CB GLN A 64 -3.614 -13.512 2.503 1.00 0.00 C ATOM 962 CG GLN A 64 -4.226 -14.858 2.854 1.00 0.00 C ATOM 963 CD GLN A 64 -3.806 -15.390 4.211 1.00 0.00 C ATOM 964 OE1 GLN A 64 -4.562 -16.090 4.867 1.00 0.00 O ATOM 965 NE2 GLN A 64 -2.597 -15.107 4.620 1.00 0.00 N ATOM 0 H GLN A 64 -3.120 -14.566 0.339 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.237 -12.956 1.229 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -2.531 -13.615 2.439 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -3.820 -12.803 3.305 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -5.312 -14.769 2.830 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -3.948 -15.583 2.089 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -1.990 -14.519 4.049 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -2.261 -15.474 5.510 1.00 0.00 H new ATOM 974 N LEU A 65 -2.479 -11.346 0.553 1.00 0.00 N ATOM 975 CA LEU A 65 -1.928 -10.043 0.320 1.00 0.00 C ATOM 976 C LEU A 65 -2.530 -9.399 -0.941 1.00 0.00 C ATOM 977 O LEU A 65 -3.037 -8.274 -0.877 1.00 0.00 O ATOM 978 CB LEU A 65 -0.378 -10.105 0.301 1.00 0.00 C ATOM 979 CG LEU A 65 0.364 -8.812 -0.007 1.00 0.00 C ATOM 980 CD1 LEU A 65 -0.066 -7.719 0.946 1.00 0.00 C ATOM 981 CD2 LEU A 65 1.863 -9.044 0.103 1.00 0.00 C ATOM 0 H LEU A 65 -1.835 -12.114 0.366 1.00 0.00 H new ATOM 0 HA LEU A 65 -2.204 -9.388 1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.042 -10.464 1.274 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -0.078 -10.851 -0.435 1.00 0.00 H new ATOM 0 HG LEU A 65 0.124 -8.498 -1.023 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.473 -6.801 0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.137 -7.547 0.843 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.156 -8.021 1.970 1.00 0.00 H new ATOM 0 HD21 LEU A 65 2.392 -8.117 -0.118 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.108 -9.369 1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.165 -9.813 -0.608 1.00 0.00 H new ATOM 993 N TYR A 66 -2.543 -10.131 -2.064 1.00 0.00 N ATOM 994 CA TYR A 66 -3.096 -9.619 -3.332 1.00 0.00 C ATOM 995 C TYR A 66 -4.560 -9.195 -3.178 1.00 0.00 C ATOM 996 O TYR A 66 -4.994 -8.125 -3.705 1.00 0.00 O ATOM 997 CB TYR A 66 -2.971 -10.689 -4.429 1.00 0.00 C ATOM 998 CG TYR A 66 -3.584 -10.329 -5.766 1.00 0.00 C ATOM 999 CD1 TYR A 66 -2.867 -9.619 -6.716 1.00 0.00 C ATOM 1000 CD2 TYR A 66 -4.883 -10.716 -6.078 1.00 0.00 C ATOM 1001 CE1 TYR A 66 -3.426 -9.302 -7.937 1.00 0.00 C ATOM 1002 CE2 TYR A 66 -5.445 -10.404 -7.290 1.00 0.00 C ATOM 1003 CZ TYR A 66 -4.717 -9.698 -8.217 1.00 0.00 C ATOM 1004 OH TYR A 66 -5.290 -9.367 -9.422 1.00 0.00 O ATOM 0 H TYR A 66 -2.177 -11.081 -2.123 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.521 -8.737 -3.616 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -1.914 -10.906 -4.581 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.437 -11.607 -4.071 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -1.856 -9.309 -6.497 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -5.459 -11.272 -5.353 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -2.857 -8.748 -8.668 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -6.455 -10.712 -7.515 1.00 0.00 H new ATOM 0 HH TYR A 66 -6.202 -9.723 -9.459 1.00 0.00 H new ATOM 1014 N ASP A 67 -5.312 -10.012 -2.472 1.00 0.00 N ATOM 1015 CA ASP A 67 -6.719 -9.765 -2.262 1.00 0.00 C ATOM 1016 C ASP A 67 -6.926 -8.533 -1.431 1.00 0.00 C ATOM 1017 O ASP A 67 -7.765 -7.727 -1.759 1.00 0.00 O ATOM 1018 CB ASP A 67 -7.418 -10.972 -1.644 1.00 0.00 C ATOM 1019 CG ASP A 67 -8.908 -10.783 -1.532 1.00 0.00 C ATOM 1020 OD1 ASP A 67 -9.562 -10.581 -2.567 1.00 0.00 O ATOM 1021 OD2 ASP A 67 -9.459 -10.894 -0.414 1.00 0.00 O ATOM 0 H ASP A 67 -4.965 -10.863 -2.029 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.173 -9.596 -3.238 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.212 -11.855 -2.248 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.004 -11.160 -0.653 1.00 0.00 H new ATOM 1026 N PHE A 68 -6.103 -8.352 -0.393 1.00 0.00 N ATOM 1027 CA PHE A 68 -6.192 -7.169 0.468 1.00 0.00 C ATOM 1028 C PHE A 68 -5.969 -5.906 -0.358 1.00 0.00 C ATOM 1029 O PHE A 68 -6.730 -4.962 -0.264 1.00 0.00 O ATOM 1030 CB PHE A 68 -5.165 -7.259 1.603 1.00 0.00 C ATOM 1031 CG PHE A 68 -5.226 -6.131 2.599 1.00 0.00 C ATOM 1032 CD1 PHE A 68 -6.284 -6.030 3.487 1.00 0.00 C ATOM 1033 CD2 PHE A 68 -4.220 -5.178 2.651 1.00 0.00 C ATOM 1034 CE1 PHE A 68 -6.339 -5.001 4.406 1.00 0.00 C ATOM 1035 CE2 PHE A 68 -4.271 -4.148 3.570 1.00 0.00 C ATOM 1036 CZ PHE A 68 -5.332 -4.060 4.449 1.00 0.00 C ATOM 0 H PHE A 68 -5.369 -9.009 -0.129 1.00 0.00 H new ATOM 0 HA PHE A 68 -7.188 -7.126 0.909 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.310 -8.201 2.132 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.166 -7.288 1.169 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.075 -6.765 3.460 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.388 -5.242 1.966 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -7.171 -4.933 5.091 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.481 -3.412 3.601 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.373 -3.256 5.169 1.00 0.00 H new ATOM 1046 N ILE A 69 -4.950 -5.960 -1.209 1.00 0.00 N ATOM 1047 CA ILE A 69 -4.566 -4.884 -2.142 1.00 0.00 C ATOM 1048 C ILE A 69 -5.740 -4.471 -3.064 1.00 0.00 C ATOM 1049 O ILE A 69 -5.837 -3.298 -3.529 1.00 0.00 O ATOM 1050 CB ILE A 69 -3.360 -5.363 -3.003 1.00 0.00 C ATOM 1051 CG1 ILE A 69 -2.124 -5.569 -2.123 1.00 0.00 C ATOM 1052 CG2 ILE A 69 -3.055 -4.413 -4.149 1.00 0.00 C ATOM 1053 CD1 ILE A 69 -0.960 -6.195 -2.849 1.00 0.00 C ATOM 0 H ILE A 69 -4.343 -6.777 -1.278 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.289 -4.008 -1.556 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.639 -6.317 -3.449 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -1.813 -4.606 -1.718 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.393 -6.199 -1.275 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -2.206 -4.791 -4.719 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.925 -4.338 -4.801 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -2.814 -3.428 -3.750 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -0.122 -6.310 -2.162 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.253 -7.173 -3.231 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -0.663 -5.555 -3.680 1.00 0.00 H new ATOM 1065 N HIS A 70 -6.581 -5.438 -3.376 1.00 0.00 N ATOM 1066 CA HIS A 70 -7.734 -5.198 -4.245 1.00 0.00 C ATOM 1067 C HIS A 70 -9.068 -5.089 -3.499 1.00 0.00 C ATOM 1068 O HIS A 70 -10.083 -4.774 -4.107 1.00 0.00 O ATOM 1069 CB HIS A 70 -7.825 -6.252 -5.347 1.00 0.00 C ATOM 1070 CG HIS A 70 -6.722 -6.162 -6.336 1.00 0.00 C ATOM 1071 ND1 HIS A 70 -5.472 -6.668 -6.102 1.00 0.00 N ATOM 1072 CD2 HIS A 70 -6.666 -5.572 -7.552 1.00 0.00 C ATOM 1073 CE1 HIS A 70 -4.696 -6.387 -7.124 1.00 0.00 C ATOM 1074 NE2 HIS A 70 -5.394 -5.729 -8.012 1.00 0.00 N ATOM 0 H HIS A 70 -6.494 -6.399 -3.045 1.00 0.00 H new ATOM 0 HA HIS A 70 -7.556 -4.221 -4.693 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -7.818 -7.243 -4.894 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -8.778 -6.145 -5.865 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -5.188 -7.181 -5.267 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -7.476 -5.071 -8.061 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.654 -6.655 -7.215 1.00 0.00 H new ATOM 1083 N THR A 71 -9.068 -5.315 -2.215 1.00 0.00 N ATOM 1084 CA THR A 71 -10.286 -5.241 -1.444 1.00 0.00 C ATOM 1085 C THR A 71 -10.572 -3.802 -1.058 1.00 0.00 C ATOM 1086 O THR A 71 -9.939 -3.263 -0.173 1.00 0.00 O ATOM 1087 CB THR A 71 -10.213 -6.145 -0.180 1.00 0.00 C ATOM 1088 OG1 THR A 71 -10.149 -7.523 -0.573 1.00 0.00 O ATOM 1089 CG2 THR A 71 -11.407 -5.934 0.751 1.00 0.00 C ATOM 0 H THR A 71 -8.236 -5.553 -1.675 1.00 0.00 H new ATOM 0 HA THR A 71 -11.103 -5.609 -2.064 1.00 0.00 H new ATOM 0 HB THR A 71 -9.313 -5.867 0.369 1.00 0.00 H new ATOM 0 HG1 THR A 71 -9.446 -7.639 -1.246 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.311 -6.587 1.619 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.433 -4.895 1.079 1.00 0.00 H new ATOM 0 HG23 THR A 71 -12.329 -6.170 0.219 1.00 0.00 H new ATOM 1097 N SER A 72 -11.521 -3.186 -1.748 1.00 0.00 N ATOM 1098 CA SER A 72 -11.887 -1.814 -1.499 1.00 0.00 C ATOM 1099 C SER A 72 -12.298 -1.625 -0.027 1.00 0.00 C ATOM 1100 O SER A 72 -12.828 -2.564 0.631 1.00 0.00 O ATOM 1101 CB SER A 72 -13.044 -1.396 -2.432 1.00 0.00 C ATOM 1102 OG SER A 72 -13.505 -0.091 -2.121 1.00 0.00 O ATOM 0 H SER A 72 -12.055 -3.630 -2.495 1.00 0.00 H new ATOM 0 HA SER A 72 -11.023 -1.181 -1.702 1.00 0.00 H new ATOM 0 HB2 SER A 72 -12.709 -1.429 -3.469 1.00 0.00 H new ATOM 0 HB3 SER A 72 -13.865 -2.107 -2.339 1.00 0.00 H new ATOM 0 HG SER A 72 -12.747 0.530 -2.112 1.00 0.00 H new ATOM 1108 N PHE A 73 -12.083 -0.423 0.487 1.00 0.00 N ATOM 1109 CA PHE A 73 -12.413 -0.091 1.880 1.00 0.00 C ATOM 1110 C PHE A 73 -13.943 -0.207 2.079 1.00 0.00 C ATOM 1111 O PHE A 73 -14.437 -0.434 3.187 1.00 0.00 O ATOM 1112 CB PHE A 73 -11.985 1.352 2.215 1.00 0.00 C ATOM 1113 CG PHE A 73 -10.883 1.907 1.344 1.00 0.00 C ATOM 1114 CD1 PHE A 73 -9.530 1.736 1.635 1.00 0.00 C ATOM 1115 CD2 PHE A 73 -11.222 2.607 0.205 1.00 0.00 C ATOM 1116 CE1 PHE A 73 -8.582 2.261 0.789 1.00 0.00 C ATOM 1117 CE2 PHE A 73 -10.267 3.121 -0.617 1.00 0.00 C ATOM 1118 CZ PHE A 73 -8.946 2.940 -0.326 1.00 0.00 C ATOM 0 H PHE A 73 -11.678 0.351 -0.040 1.00 0.00 H new ATOM 0 HA PHE A 73 -11.883 -0.782 2.535 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -12.856 2.002 2.132 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -11.659 1.387 3.255 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -9.229 1.194 2.520 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -12.264 2.750 -0.039 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.534 2.131 1.016 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -10.555 3.672 -1.500 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.189 3.339 -0.985 1.00 0.00 H new ATOM 1516 N GLY B 115 -9.696 -2.980 8.277 1.00 0.00 N ATOM 1517 CA GLY B 115 -8.377 -3.386 7.781 1.00 0.00 C ATOM 1518 C GLY B 115 -7.795 -2.420 6.765 1.00 0.00 C ATOM 1519 O GLY B 115 -6.750 -1.798 7.022 1.00 0.00 O ATOM 0 HA2 GLY B 115 -7.691 -3.474 8.623 1.00 0.00 H new ATOM 0 HA3 GLY B 115 -8.455 -4.375 7.329 1.00 0.00 H new ATOM 1523 N PRO B 116 -8.441 -2.267 5.607 1.00 0.00 N ATOM 1524 CA PRO B 116 -8.012 -1.326 4.604 1.00 0.00 C ATOM 1525 C PRO B 116 -8.165 0.145 5.059 1.00 0.00 C ATOM 1526 O PRO B 116 -7.271 0.927 4.835 1.00 0.00 O ATOM 1527 CB PRO B 116 -8.898 -1.645 3.395 1.00 0.00 C ATOM 1528 CG PRO B 116 -10.083 -2.300 3.965 1.00 0.00 C ATOM 1529 CD PRO B 116 -9.603 -3.048 5.167 1.00 0.00 C ATOM 0 HA PRO B 116 -6.949 -1.423 4.384 1.00 0.00 H new ATOM 0 HB2 PRO B 116 -9.169 -0.739 2.852 1.00 0.00 H new ATOM 0 HB3 PRO B 116 -8.385 -2.298 2.689 1.00 0.00 H new ATOM 0 HG2 PRO B 116 -10.840 -1.566 4.239 1.00 0.00 H new ATOM 0 HG3 PRO B 116 -10.541 -2.975 3.242 1.00 0.00 H new ATOM 0 HD2 PRO B 116 -10.369 -3.101 5.941 1.00 0.00 H new ATOM 0 HD3 PRO B 116 -9.329 -4.074 4.920 1.00 0.00 H new ATOM 1537 N GLN B 117 -9.268 0.497 5.752 1.00 0.00 N ATOM 1538 CA GLN B 117 -9.505 1.907 6.193 1.00 0.00 C ATOM 1539 C GLN B 117 -8.374 2.382 7.114 1.00 0.00 C ATOM 1540 O GLN B 117 -7.772 3.459 6.931 1.00 0.00 O ATOM 1541 CB GLN B 117 -10.846 2.031 6.918 1.00 0.00 C ATOM 1542 CG GLN B 117 -11.188 3.452 7.328 1.00 0.00 C ATOM 1543 CD GLN B 117 -12.536 3.569 8.004 1.00 0.00 C ATOM 1544 OE1 GLN B 117 -12.988 2.654 8.700 1.00 0.00 O ATOM 1545 NE2 GLN B 117 -13.208 4.671 7.791 1.00 0.00 N ATOM 0 H GLN B 117 -10.004 -0.157 6.020 1.00 0.00 H new ATOM 0 HA GLN B 117 -9.527 2.536 5.303 1.00 0.00 H new ATOM 0 HB2 GLN B 117 -11.636 1.649 6.271 1.00 0.00 H new ATOM 0 HB3 GLN B 117 -10.828 1.400 7.807 1.00 0.00 H new ATOM 0 HG2 GLN B 117 -10.417 3.824 8.003 1.00 0.00 H new ATOM 0 HG3 GLN B 117 -11.175 4.091 6.445 1.00 0.00 H new ATOM 0 HE21 GLN B 117 -12.808 5.409 7.211 1.00 0.00 H new ATOM 0 HE22 GLN B 117 -14.132 4.793 8.205 1.00 0.00 H new ATOM 1554 N ASP B 118 -8.071 1.543 8.052 1.00 0.00 N ATOM 1555 CA ASP B 118 -7.003 1.729 9.009 1.00 0.00 C ATOM 1556 C ASP B 118 -5.654 1.821 8.301 1.00 0.00 C ATOM 1557 O ASP B 118 -4.710 2.459 8.797 1.00 0.00 O ATOM 1558 CB ASP B 118 -7.041 0.579 10.014 1.00 0.00 C ATOM 1559 CG ASP B 118 -5.917 0.549 10.989 1.00 0.00 C ATOM 1560 OD1 ASP B 118 -6.001 1.211 12.032 1.00 0.00 O ATOM 1561 OD2 ASP B 118 -4.938 -0.182 10.761 1.00 0.00 O ATOM 0 H ASP B 118 -8.577 0.668 8.186 1.00 0.00 H new ATOM 0 HA ASP B 118 -7.141 2.668 9.544 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -7.979 0.633 10.567 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -7.049 -0.362 9.464 1.00 0.00 H new ATOM 1566 N PHE B 119 -5.568 1.184 7.130 1.00 0.00 N ATOM 1567 CA PHE B 119 -4.327 1.109 6.391 1.00 0.00 C ATOM 1568 C PHE B 119 -3.928 2.469 5.888 1.00 0.00 C ATOM 1569 O PHE B 119 -2.787 2.873 6.015 1.00 0.00 O ATOM 1570 CB PHE B 119 -4.477 0.214 5.183 1.00 0.00 C ATOM 1571 CG PHE B 119 -3.269 -0.596 4.896 1.00 0.00 C ATOM 1572 CD1 PHE B 119 -2.691 -1.356 5.896 1.00 0.00 C ATOM 1573 CD2 PHE B 119 -2.689 -0.582 3.646 1.00 0.00 C ATOM 1574 CE1 PHE B 119 -1.563 -2.090 5.656 1.00 0.00 C ATOM 1575 CE2 PHE B 119 -1.555 -1.317 3.404 1.00 0.00 C ATOM 1576 CZ PHE B 119 -0.995 -2.070 4.412 1.00 0.00 C ATOM 0 H PHE B 119 -6.354 0.714 6.680 1.00 0.00 H new ATOM 0 HA PHE B 119 -3.572 0.712 7.070 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -5.325 -0.454 5.338 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -4.709 0.827 4.312 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -3.137 -1.370 6.880 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -3.127 0.008 2.855 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -1.123 -2.682 6.444 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -1.102 -1.305 2.424 1.00 0.00 H new ATOM 0 HZ PHE B 119 -0.103 -2.648 4.219 1.00 0.00 H new ATOM 1586 N LEU B 120 -4.869 3.155 5.299 1.00 0.00 N ATOM 1587 CA LEU B 120 -4.568 4.440 4.679 1.00 0.00 C ATOM 1588 C LEU B 120 -4.312 5.471 5.740 1.00 0.00 C ATOM 1589 O LEU B 120 -3.351 6.176 5.668 1.00 0.00 O ATOM 1590 CB LEU B 120 -5.653 4.938 3.673 1.00 0.00 C ATOM 1591 CG LEU B 120 -6.493 3.876 2.958 1.00 0.00 C ATOM 1592 CD1 LEU B 120 -5.689 2.672 2.463 1.00 0.00 C ATOM 1593 CD2 LEU B 120 -7.701 3.551 3.785 1.00 0.00 C ATOM 0 H LEU B 120 -5.843 2.860 5.229 1.00 0.00 H new ATOM 0 HA LEU B 120 -3.670 4.287 4.080 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -6.333 5.599 4.211 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -5.156 5.542 2.914 1.00 0.00 H new ATOM 0 HG LEU B 120 -6.856 4.295 2.019 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -6.357 1.967 1.968 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -4.929 3.007 1.758 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -5.208 2.183 3.310 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -8.298 2.795 3.275 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.385 3.170 4.756 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -8.299 4.452 3.926 1.00 0.00 H new ATOM 1605 N LEU B 121 -5.146 5.480 6.779 1.00 0.00 N ATOM 1606 CA LEU B 121 -5.028 6.465 7.891 1.00 0.00 C ATOM 1607 C LEU B 121 -3.669 6.410 8.604 1.00 0.00 C ATOM 1608 O LEU B 121 -3.247 7.395 9.224 1.00 0.00 O ATOM 1609 CB LEU B 121 -6.118 6.231 8.935 1.00 0.00 C ATOM 1610 CG LEU B 121 -7.555 6.419 8.485 1.00 0.00 C ATOM 1611 CD1 LEU B 121 -8.497 5.964 9.580 1.00 0.00 C ATOM 1612 CD2 LEU B 121 -7.814 7.873 8.164 1.00 0.00 C ATOM 0 H LEU B 121 -5.917 4.821 6.888 1.00 0.00 H new ATOM 0 HA LEU B 121 -5.134 7.446 7.428 1.00 0.00 H new ATOM 0 HB2 LEU B 121 -6.012 5.214 9.313 1.00 0.00 H new ATOM 0 HB3 LEU B 121 -5.935 6.904 9.773 1.00 0.00 H new ATOM 0 HG LEU B 121 -7.725 5.822 7.589 1.00 0.00 H new ATOM 0 HD11 LEU B 121 -9.528 6.101 9.253 1.00 0.00 H new ATOM 0 HD12 LEU B 121 -8.321 4.910 9.796 1.00 0.00 H new ATOM 0 HD13 LEU B 121 -8.321 6.553 10.480 1.00 0.00 H new ATOM 0 HD21 LEU B 121 -8.848 7.996 7.842 1.00 0.00 H new ATOM 0 HD22 LEU B 121 -7.636 8.479 9.052 1.00 0.00 H new ATOM 0 HD23 LEU B 121 -7.145 8.194 7.366 1.00 0.00 H new ATOM 1624 N LYS B 122 -2.986 5.292 8.526 1.00 0.00 N ATOM 1625 CA LYS B 122 -1.717 5.161 9.220 1.00 0.00 C ATOM 1626 C LYS B 122 -0.559 5.609 8.348 1.00 0.00 C ATOM 1627 O LYS B 122 0.598 5.588 8.779 1.00 0.00 O ATOM 1628 CB LYS B 122 -1.477 3.742 9.687 1.00 0.00 C ATOM 1629 CG LYS B 122 -1.246 2.761 8.571 1.00 0.00 C ATOM 1630 CD LYS B 122 -0.809 1.407 9.078 1.00 0.00 C ATOM 1631 CE LYS B 122 -1.972 0.529 9.567 1.00 0.00 C ATOM 1632 NZ LYS B 122 -2.646 1.032 10.775 1.00 0.00 N ATOM 0 H LYS B 122 -3.278 4.469 7.999 1.00 0.00 H new ATOM 0 HA LYS B 122 -1.773 5.810 10.094 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -0.613 3.730 10.352 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -2.335 3.414 10.274 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -2.163 2.651 7.992 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -0.487 3.155 7.895 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -0.279 0.884 8.282 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -0.101 1.545 9.895 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -2.706 0.440 8.766 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -1.595 -0.474 9.767 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -3.260 0.289 11.165 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -1.934 1.299 11.484 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -3.221 1.864 10.531 1.00 0.00 H new ATOM 1646 N MET B 123 -0.862 6.015 7.138 1.00 0.00 N ATOM 1647 CA MET B 123 0.152 6.437 6.207 1.00 0.00 C ATOM 1648 C MET B 123 0.485 7.914 6.503 1.00 0.00 C ATOM 1649 O MET B 123 -0.286 8.588 7.186 1.00 0.00 O ATOM 1650 CB MET B 123 -0.364 6.280 4.758 1.00 0.00 C ATOM 1651 CG MET B 123 -0.813 4.858 4.364 1.00 0.00 C ATOM 1652 SD MET B 123 -1.344 4.783 2.632 1.00 0.00 S ATOM 1653 CE MET B 123 -1.754 3.060 2.432 1.00 0.00 C ATOM 0 H MET B 123 -1.814 6.061 6.774 1.00 0.00 H new ATOM 0 HA MET B 123 1.047 5.824 6.314 1.00 0.00 H new ATOM 0 HB2 MET B 123 -1.203 6.960 4.614 1.00 0.00 H new ATOM 0 HB3 MET B 123 0.424 6.596 4.074 1.00 0.00 H new ATOM 0 HG2 MET B 123 0.008 4.159 4.524 1.00 0.00 H new ATOM 0 HG3 MET B 123 -1.632 4.542 5.010 1.00 0.00 H new ATOM 0 HE1 MET B 123 -2.543 2.958 1.687 1.00 0.00 H new ATOM 0 HE2 MET B 123 -0.871 2.512 2.103 1.00 0.00 H new ATOM 0 HE3 MET B 123 -2.099 2.655 3.383 1.00 0.00 H new ATOM 1663 N PRO B 124 1.632 8.435 6.078 1.00 0.00 N ATOM 1664 CA PRO B 124 1.936 9.836 6.267 1.00 0.00 C ATOM 1665 C PRO B 124 1.329 10.669 5.146 1.00 0.00 C ATOM 1666 O PRO B 124 1.484 10.343 3.982 1.00 0.00 O ATOM 1667 CB PRO B 124 3.467 9.906 6.208 1.00 0.00 C ATOM 1668 CG PRO B 124 3.938 8.558 5.726 1.00 0.00 C ATOM 1669 CD PRO B 124 2.719 7.731 5.399 1.00 0.00 C ATOM 0 HA PRO B 124 1.534 10.225 7.202 1.00 0.00 H new ATOM 0 HB2 PRO B 124 3.794 10.696 5.532 1.00 0.00 H new ATOM 0 HB3 PRO B 124 3.883 10.134 7.189 1.00 0.00 H new ATOM 0 HG2 PRO B 124 4.572 8.668 4.846 1.00 0.00 H new ATOM 0 HG3 PRO B 124 4.538 8.067 6.492 1.00 0.00 H new ATOM 0 HD2 PRO B 124 2.550 7.675 4.324 1.00 0.00 H new ATOM 0 HD3 PRO B 124 2.821 6.707 5.760 1.00 0.00 H new ATOM 1677 N GLY B 125 0.626 11.717 5.494 1.00 0.00 N ATOM 1678 CA GLY B 125 0.041 12.547 4.482 1.00 0.00 C ATOM 1679 C GLY B 125 -1.426 12.266 4.305 1.00 0.00 C ATOM 1680 O GLY B 125 -1.997 12.552 3.272 1.00 0.00 O ATOM 0 H GLY B 125 0.449 12.009 6.455 1.00 0.00 H new ATOM 0 HA2 GLY B 125 0.181 13.595 4.747 1.00 0.00 H new ATOM 0 HA3 GLY B 125 0.558 12.386 3.536 1.00 0.00 H new ATOM 1684 N VAL B 126 -2.033 11.698 5.309 1.00 0.00 N ATOM 1685 CA VAL B 126 -3.427 11.387 5.243 1.00 0.00 C ATOM 1686 C VAL B 126 -4.114 11.788 6.564 1.00 0.00 C ATOM 1687 O VAL B 126 -3.457 11.894 7.613 1.00 0.00 O ATOM 1688 CB VAL B 126 -3.602 9.875 4.965 1.00 0.00 C ATOM 1689 CG1 VAL B 126 -3.101 9.072 6.111 1.00 0.00 C ATOM 1690 CG2 VAL B 126 -5.024 9.502 4.581 1.00 0.00 C ATOM 0 H VAL B 126 -1.579 11.441 6.185 1.00 0.00 H new ATOM 0 HA VAL B 126 -3.894 11.947 4.433 1.00 0.00 H new ATOM 0 HB VAL B 126 -2.995 9.636 4.092 1.00 0.00 H new ATOM 0 HG11 VAL B 126 -3.232 8.011 5.897 1.00 0.00 H new ATOM 0 HG12 VAL B 126 -2.043 9.282 6.268 1.00 0.00 H new ATOM 0 HG13 VAL B 126 -3.660 9.333 7.010 1.00 0.00 H new ATOM 0 HG21 VAL B 126 -5.082 8.429 4.399 1.00 0.00 H new ATOM 0 HG22 VAL B 126 -5.702 9.770 5.392 1.00 0.00 H new ATOM 0 HG23 VAL B 126 -5.310 10.040 3.677 1.00 0.00 H new ATOM 1700 N ASN B 127 -5.396 12.061 6.493 1.00 0.00 N ATOM 1701 CA ASN B 127 -6.231 12.385 7.643 1.00 0.00 C ATOM 1702 C ASN B 127 -7.566 11.752 7.418 1.00 0.00 C ATOM 1703 O ASN B 127 -7.878 11.396 6.293 1.00 0.00 O ATOM 1704 CB ASN B 127 -6.446 13.904 7.838 1.00 0.00 C ATOM 1705 CG ASN B 127 -5.195 14.675 8.182 1.00 0.00 C ATOM 1706 OD1 ASN B 127 -4.813 14.775 9.347 1.00 0.00 O ATOM 1707 ND2 ASN B 127 -4.597 15.273 7.199 1.00 0.00 N ATOM 0 H ASN B 127 -5.909 12.066 5.611 1.00 0.00 H new ATOM 0 HA ASN B 127 -5.727 12.016 8.536 1.00 0.00 H new ATOM 0 HB2 ASN B 127 -6.873 14.318 6.924 1.00 0.00 H new ATOM 0 HB3 ASN B 127 -7.180 14.055 8.630 1.00 0.00 H new ATOM 0 HD21 ASN B 127 -3.777 15.853 7.378 1.00 0.00 H new ATOM 0 HD22 ASN B 127 -4.947 15.164 6.247 1.00 0.00 H new ATOM 1714 N ALA B 128 -8.375 11.648 8.440 1.00 0.00 N ATOM 1715 CA ALA B 128 -9.692 11.043 8.310 1.00 0.00 C ATOM 1716 C ALA B 128 -10.595 11.816 7.340 1.00 0.00 C ATOM 1717 O ALA B 128 -11.497 11.235 6.726 1.00 0.00 O ATOM 1718 CB ALA B 128 -10.345 10.896 9.666 1.00 0.00 C ATOM 0 H ALA B 128 -8.151 11.974 9.380 1.00 0.00 H new ATOM 0 HA ALA B 128 -9.553 10.050 7.883 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -11.329 10.442 9.549 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -9.726 10.262 10.301 1.00 0.00 H new ATOM 0 HB3 ALA B 128 -10.451 11.878 10.127 1.00 0.00 H new ATOM 1724 N LYS B 129 -10.332 13.102 7.177 1.00 0.00 N ATOM 1725 CA LYS B 129 -11.125 13.940 6.289 1.00 0.00 C ATOM 1726 C LYS B 129 -10.819 13.608 4.821 1.00 0.00 C ATOM 1727 O LYS B 129 -11.716 13.381 3.976 1.00 0.00 O ATOM 1728 CB LYS B 129 -10.878 15.440 6.612 1.00 0.00 C ATOM 1729 CG LYS B 129 -9.408 15.895 6.552 1.00 0.00 C ATOM 1730 CD LYS B 129 -9.232 17.373 6.926 1.00 0.00 C ATOM 1731 CE LYS B 129 -9.634 17.655 8.375 1.00 0.00 C ATOM 1732 NZ LYS B 129 -9.489 19.089 8.732 1.00 0.00 N ATOM 0 H LYS B 129 -9.572 13.591 7.650 1.00 0.00 H new ATOM 0 HA LYS B 129 -12.184 13.737 6.451 1.00 0.00 H new ATOM 0 HB2 LYS B 129 -11.457 16.045 5.914 1.00 0.00 H new ATOM 0 HB3 LYS B 129 -11.265 15.648 7.610 1.00 0.00 H new ATOM 0 HG2 LYS B 129 -8.813 15.280 7.227 1.00 0.00 H new ATOM 0 HG3 LYS B 129 -9.021 15.730 5.546 1.00 0.00 H new ATOM 0 HD2 LYS B 129 -8.192 17.662 6.777 1.00 0.00 H new ATOM 0 HD3 LYS B 129 -9.833 17.989 6.258 1.00 0.00 H new ATOM 0 HE2 LYS B 129 -10.668 17.348 8.529 1.00 0.00 H new ATOM 0 HE3 LYS B 129 -9.019 17.053 9.044 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 -9.773 19.231 9.722 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 -8.497 19.378 8.611 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 -10.095 19.664 8.113 1.00 0.00 H new ATOM 1746 N ASN B 130 -9.579 13.475 4.531 1.00 0.00 N ATOM 1747 CA ASN B 130 -9.201 13.244 3.184 1.00 0.00 C ATOM 1748 C ASN B 130 -9.213 11.778 2.859 1.00 0.00 C ATOM 1749 O ASN B 130 -9.284 11.414 1.720 1.00 0.00 O ATOM 1750 CB ASN B 130 -7.899 13.955 2.817 1.00 0.00 C ATOM 1751 CG ASN B 130 -6.691 13.585 3.649 1.00 0.00 C ATOM 1752 OD1 ASN B 130 -6.527 12.462 4.071 1.00 0.00 O ATOM 1753 ND2 ASN B 130 -5.883 14.559 3.947 1.00 0.00 N ATOM 0 H ASN B 130 -8.811 13.521 5.201 1.00 0.00 H new ATOM 0 HA ASN B 130 -9.954 13.698 2.540 1.00 0.00 H new ATOM 0 HB2 ASN B 130 -7.675 13.745 1.771 1.00 0.00 H new ATOM 0 HB3 ASN B 130 -8.058 15.030 2.899 1.00 0.00 H new ATOM 0 HD21 ASN B 130 -5.081 14.389 4.554 1.00 0.00 H new ATOM 0 HD22 ASN B 130 -6.051 15.493 3.574 1.00 0.00 H new ATOM 1760 N CYS B 131 -9.189 10.944 3.884 1.00 0.00 N ATOM 1761 CA CYS B 131 -9.303 9.515 3.711 1.00 0.00 C ATOM 1762 C CYS B 131 -10.719 9.130 3.341 1.00 0.00 C ATOM 1763 O CYS B 131 -10.904 8.202 2.597 1.00 0.00 O ATOM 1764 CB CYS B 131 -8.864 8.742 4.949 1.00 0.00 C ATOM 1765 SG CYS B 131 -8.900 6.947 4.762 1.00 0.00 S ATOM 0 H CYS B 131 -9.090 11.242 4.855 1.00 0.00 H new ATOM 0 HA CYS B 131 -8.630 9.245 2.897 1.00 0.00 H new ATOM 0 HB2 CYS B 131 -7.851 9.047 5.212 1.00 0.00 H new ATOM 0 HB3 CYS B 131 -9.508 9.021 5.783 1.00 0.00 H new ATOM 0 HG CYS B 131 -9.723 6.627 3.808 1.00 0.00 H new ATOM 1771 N ARG B 132 -11.728 9.839 3.866 1.00 0.00 N ATOM 1772 CA ARG B 132 -13.115 9.544 3.477 1.00 0.00 C ATOM 1773 C ARG B 132 -13.304 9.924 2.024 1.00 0.00 C ATOM 1774 O ARG B 132 -13.860 9.150 1.214 1.00 0.00 O ATOM 1775 CB ARG B 132 -14.143 10.247 4.403 1.00 0.00 C ATOM 1776 CG ARG B 132 -14.062 11.767 4.451 1.00 0.00 C ATOM 1777 CD ARG B 132 -14.960 12.473 3.424 1.00 0.00 C ATOM 1778 NE ARG B 132 -16.385 12.199 3.598 1.00 0.00 N ATOM 1779 CZ ARG B 132 -17.355 12.784 2.881 1.00 0.00 C ATOM 1780 NH1 ARG B 132 -17.044 13.671 1.935 1.00 0.00 N ATOM 1781 NH2 ARG B 132 -18.626 12.470 3.095 1.00 0.00 N ATOM 0 H ARG B 132 -11.618 10.597 4.540 1.00 0.00 H new ATOM 0 HA ARG B 132 -13.299 8.476 3.593 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -15.146 9.966 4.081 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -14.014 9.863 5.415 1.00 0.00 H new ATOM 0 HG2 ARG B 132 -14.336 12.104 5.451 1.00 0.00 H new ATOM 0 HG3 ARG B 132 -13.029 12.071 4.285 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -14.796 13.549 3.491 1.00 0.00 H new ATOM 0 HD3 ARG B 132 -14.660 12.166 2.422 1.00 0.00 H new ATOM 0 HE ARG B 132 -16.658 11.521 4.309 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -16.067 13.905 1.756 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -17.783 14.116 1.390 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -18.868 11.781 3.807 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -19.361 12.917 2.547 1.00 0.00 H new ATOM 1795 N SER B 133 -12.787 11.093 1.679 1.00 0.00 N ATOM 1796 CA SER B 133 -12.813 11.554 0.323 1.00 0.00 C ATOM 1797 C SER B 133 -12.033 10.567 -0.580 1.00 0.00 C ATOM 1798 O SER B 133 -12.489 10.173 -1.668 1.00 0.00 O ATOM 1799 CB SER B 133 -12.202 12.940 0.308 1.00 0.00 C ATOM 1800 OG SER B 133 -12.968 13.826 1.116 1.00 0.00 O ATOM 0 H SER B 133 -12.343 11.736 2.335 1.00 0.00 H new ATOM 0 HA SER B 133 -13.830 11.603 -0.066 1.00 0.00 H new ATOM 0 HB2 SER B 133 -11.177 12.897 0.675 1.00 0.00 H new ATOM 0 HB3 SER B 133 -12.159 13.315 -0.715 1.00 0.00 H new ATOM 0 HG SER B 133 -12.672 13.758 2.048 1.00 0.00 H new ATOM 1806 N LEU B 134 -10.917 10.102 -0.064 1.00 0.00 N ATOM 1807 CA LEU B 134 -10.037 9.166 -0.762 1.00 0.00 C ATOM 1808 C LEU B 134 -10.757 7.881 -1.001 1.00 0.00 C ATOM 1809 O LEU B 134 -10.745 7.358 -2.072 1.00 0.00 O ATOM 1810 CB LEU B 134 -8.812 8.856 0.078 1.00 0.00 C ATOM 1811 CG LEU B 134 -7.727 8.052 -0.615 1.00 0.00 C ATOM 1812 CD1 LEU B 134 -6.839 8.924 -1.482 1.00 0.00 C ATOM 1813 CD2 LEU B 134 -6.943 7.218 0.364 1.00 0.00 C ATOM 0 H LEU B 134 -10.583 10.361 0.864 1.00 0.00 H new ATOM 0 HA LEU B 134 -9.737 9.626 -1.704 1.00 0.00 H new ATOM 0 HB2 LEU B 134 -8.380 9.797 0.419 1.00 0.00 H new ATOM 0 HB3 LEU B 134 -9.131 8.311 0.966 1.00 0.00 H new ATOM 0 HG LEU B 134 -8.222 7.355 -1.292 1.00 0.00 H new ATOM 0 HD11 LEU B 134 -6.077 8.307 -1.958 1.00 0.00 H new ATOM 0 HD12 LEU B 134 -7.443 9.411 -2.248 1.00 0.00 H new ATOM 0 HD13 LEU B 134 -6.358 9.682 -0.864 1.00 0.00 H new ATOM 0 HD21 LEU B 134 -6.176 6.657 -0.169 1.00 0.00 H new ATOM 0 HD22 LEU B 134 -6.471 7.869 1.100 1.00 0.00 H new ATOM 0 HD23 LEU B 134 -7.614 6.524 0.870 1.00 0.00 H new ATOM 1825 N MET B 135 -11.431 7.446 0.008 1.00 0.00 N ATOM 1826 CA MET B 135 -12.140 6.189 0.061 1.00 0.00 C ATOM 1827 C MET B 135 -13.197 6.114 -1.016 1.00 0.00 C ATOM 1828 O MET B 135 -13.545 5.039 -1.497 1.00 0.00 O ATOM 1829 CB MET B 135 -12.750 6.089 1.433 1.00 0.00 C ATOM 1830 CG MET B 135 -13.251 4.742 1.838 1.00 0.00 C ATOM 1831 SD MET B 135 -13.683 4.717 3.576 1.00 0.00 S ATOM 1832 CE MET B 135 -12.110 5.202 4.326 1.00 0.00 C ATOM 0 H MET B 135 -11.514 7.980 0.873 1.00 0.00 H new ATOM 0 HA MET B 135 -11.461 5.355 -0.118 1.00 0.00 H new ATOM 0 HB2 MET B 135 -12.006 6.411 2.162 1.00 0.00 H new ATOM 0 HB3 MET B 135 -13.579 6.794 1.491 1.00 0.00 H new ATOM 0 HG2 MET B 135 -14.122 4.478 1.239 1.00 0.00 H new ATOM 0 HG3 MET B 135 -12.487 3.990 1.638 1.00 0.00 H new ATOM 0 HE1 MET B 135 -12.090 4.882 5.368 1.00 0.00 H new ATOM 0 HE2 MET B 135 -11.289 4.731 3.786 1.00 0.00 H new ATOM 0 HE3 MET B 135 -12.002 6.286 4.277 1.00 0.00 H new ATOM 1842 N HIS B 136 -13.723 7.255 -1.369 1.00 0.00 N ATOM 1843 CA HIS B 136 -14.694 7.320 -2.436 1.00 0.00 C ATOM 1844 C HIS B 136 -14.049 7.658 -3.794 1.00 0.00 C ATOM 1845 O HIS B 136 -14.693 7.563 -4.839 1.00 0.00 O ATOM 1846 CB HIS B 136 -15.831 8.274 -2.089 1.00 0.00 C ATOM 1847 CG HIS B 136 -16.728 7.762 -0.975 1.00 0.00 C ATOM 1848 ND1 HIS B 136 -18.082 7.538 -1.121 1.00 0.00 N ATOM 1849 CD2 HIS B 136 -16.440 7.418 0.311 1.00 0.00 C ATOM 1850 CE1 HIS B 136 -18.577 7.080 0.016 1.00 0.00 C ATOM 1851 NE2 HIS B 136 -17.602 6.998 0.896 1.00 0.00 N ATOM 0 H HIS B 136 -13.499 8.152 -0.937 1.00 0.00 H new ATOM 0 HA HIS B 136 -15.123 6.324 -2.542 1.00 0.00 H new ATOM 0 HB2 HIS B 136 -15.411 9.236 -1.795 1.00 0.00 H new ATOM 0 HB3 HIS B 136 -16.434 8.448 -2.980 1.00 0.00 H new ATOM 0 HD2 HIS B 136 -15.470 7.468 0.783 1.00 0.00 H new ATOM 0 HE1 HIS B 136 -19.609 6.817 0.193 1.00 0.00 H new ATOM 0 HE2 HIS B 136 -17.698 6.674 1.858 1.00 0.00 H new ATOM 1860 N HIS B 137 -12.782 8.053 -3.779 1.00 0.00 N ATOM 1861 CA HIS B 137 -12.065 8.365 -5.026 1.00 0.00 C ATOM 1862 C HIS B 137 -11.062 7.281 -5.442 1.00 0.00 C ATOM 1863 O HIS B 137 -10.473 7.355 -6.539 1.00 0.00 O ATOM 1864 CB HIS B 137 -11.348 9.714 -4.956 1.00 0.00 C ATOM 1865 CG HIS B 137 -12.220 10.916 -5.149 1.00 0.00 C ATOM 1866 ND1 HIS B 137 -12.436 11.491 -6.377 1.00 0.00 N ATOM 1867 CD2 HIS B 137 -12.885 11.680 -4.266 1.00 0.00 C ATOM 1868 CE1 HIS B 137 -13.191 12.553 -6.237 1.00 0.00 C ATOM 1869 NE2 HIS B 137 -13.478 12.689 -4.966 1.00 0.00 N ATOM 0 H HIS B 137 -12.227 8.167 -2.930 1.00 0.00 H new ATOM 0 HA HIS B 137 -12.843 8.410 -5.788 1.00 0.00 H new ATOM 0 HB2 HIS B 137 -10.856 9.795 -3.987 1.00 0.00 H new ATOM 0 HB3 HIS B 137 -10.564 9.729 -5.713 1.00 0.00 H new ATOM 0 HD2 HIS B 137 -12.940 11.524 -3.199 1.00 0.00 H new ATOM 0 HE1 HIS B 137 -13.520 13.204 -7.033 1.00 0.00 H new ATOM 0 HE2 HIS B 137 -14.052 13.430 -4.565 1.00 0.00 H new ATOM 1878 N VAL B 138 -10.849 6.305 -4.587 1.00 0.00 N ATOM 1879 CA VAL B 138 -9.905 5.239 -4.871 1.00 0.00 C ATOM 1880 C VAL B 138 -10.480 3.884 -4.405 1.00 0.00 C ATOM 1881 O VAL B 138 -11.357 3.841 -3.552 1.00 0.00 O ATOM 1882 CB VAL B 138 -8.518 5.514 -4.194 1.00 0.00 C ATOM 1883 CG1 VAL B 138 -8.555 5.364 -2.710 1.00 0.00 C ATOM 1884 CG2 VAL B 138 -7.447 4.667 -4.775 1.00 0.00 C ATOM 0 H VAL B 138 -11.318 6.225 -3.685 1.00 0.00 H new ATOM 0 HA VAL B 138 -9.745 5.202 -5.949 1.00 0.00 H new ATOM 0 HB VAL B 138 -8.286 6.558 -4.405 1.00 0.00 H new ATOM 0 HG11 VAL B 138 -7.566 5.567 -2.299 1.00 0.00 H new ATOM 0 HG12 VAL B 138 -9.274 6.068 -2.291 1.00 0.00 H new ATOM 0 HG13 VAL B 138 -8.852 4.347 -2.454 1.00 0.00 H new ATOM 0 HG21 VAL B 138 -6.501 4.886 -4.280 1.00 0.00 H new ATOM 0 HG22 VAL B 138 -7.696 3.616 -4.631 1.00 0.00 H new ATOM 0 HG23 VAL B 138 -7.356 4.876 -5.841 1.00 0.00 H new ATOM 1894 N LYS B 139 -10.002 2.808 -4.993 1.00 0.00 N ATOM 1895 CA LYS B 139 -10.446 1.447 -4.679 1.00 0.00 C ATOM 1896 C LYS B 139 -9.826 0.952 -3.378 1.00 0.00 C ATOM 1897 O LYS B 139 -10.512 0.718 -2.401 1.00 0.00 O ATOM 1898 CB LYS B 139 -10.033 0.538 -5.829 1.00 0.00 C ATOM 1899 CG LYS B 139 -10.312 -0.943 -5.669 1.00 0.00 C ATOM 1900 CD LYS B 139 -9.615 -1.708 -6.787 1.00 0.00 C ATOM 1901 CE LYS B 139 -9.850 -3.204 -6.716 1.00 0.00 C ATOM 1902 NZ LYS B 139 -11.263 -3.580 -6.947 1.00 0.00 N ATOM 0 H LYS B 139 -9.283 2.844 -5.715 1.00 0.00 H new ATOM 0 HA LYS B 139 -11.528 1.439 -4.551 1.00 0.00 H new ATOM 0 HB2 LYS B 139 -10.538 0.882 -6.731 1.00 0.00 H new ATOM 0 HB3 LYS B 139 -8.963 0.665 -5.994 1.00 0.00 H new ATOM 0 HG2 LYS B 139 -9.956 -1.289 -4.699 1.00 0.00 H new ATOM 0 HG3 LYS B 139 -11.386 -1.128 -5.700 1.00 0.00 H new ATOM 0 HD2 LYS B 139 -9.967 -1.336 -7.749 1.00 0.00 H new ATOM 0 HD3 LYS B 139 -8.544 -1.511 -6.742 1.00 0.00 H new ATOM 0 HE2 LYS B 139 -9.222 -3.700 -7.456 1.00 0.00 H new ATOM 0 HE3 LYS B 139 -9.538 -3.569 -5.737 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 -11.350 -4.616 -6.954 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 -11.855 -3.188 -6.187 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 -11.578 -3.200 -7.863 1.00 0.00 H new ATOM 1916 N ASN B 140 -8.539 0.782 -3.405 1.00 0.00 N ATOM 1917 CA ASN B 140 -7.754 0.335 -2.309 1.00 0.00 C ATOM 1918 C ASN B 140 -6.295 0.644 -2.695 1.00 0.00 C ATOM 1919 O ASN B 140 -6.083 1.437 -3.635 1.00 0.00 O ATOM 1920 CB ASN B 140 -8.004 -1.184 -2.052 1.00 0.00 C ATOM 1921 CG ASN B 140 -7.314 -1.706 -0.794 1.00 0.00 C ATOM 1922 OD1 ASN B 140 -6.228 -2.215 -0.849 1.00 0.00 O ATOM 1923 ND2 ASN B 140 -7.907 -1.516 0.329 1.00 0.00 N ATOM 0 H ASN B 140 -7.984 0.963 -4.241 1.00 0.00 H new ATOM 0 HA ASN B 140 -8.009 0.834 -1.374 1.00 0.00 H new ATOM 0 HB2 ASN B 140 -9.077 -1.359 -1.969 1.00 0.00 H new ATOM 0 HB3 ASN B 140 -7.654 -1.753 -2.913 1.00 0.00 H new ATOM 0 HD21 ASN B 140 -7.455 -1.799 1.199 1.00 0.00 H new ATOM 0 HD22 ASN B 140 -8.830 -1.082 0.351 1.00 0.00 H new ATOM 1930 N ILE B 141 -5.345 0.008 -2.034 1.00 0.00 N ATOM 1931 CA ILE B 141 -3.902 0.170 -2.188 1.00 0.00 C ATOM 1932 C ILE B 141 -3.487 0.249 -3.653 1.00 0.00 C ATOM 1933 O ILE B 141 -2.760 1.154 -4.031 1.00 0.00 O ATOM 1934 CB ILE B 141 -3.202 -1.058 -1.584 1.00 0.00 C ATOM 1935 CG1 ILE B 141 -3.483 -1.187 -0.087 1.00 0.00 C ATOM 1936 CG2 ILE B 141 -1.690 -1.029 -1.838 1.00 0.00 C ATOM 1937 CD1 ILE B 141 -2.935 -2.460 0.518 1.00 0.00 C ATOM 0 H ILE B 141 -5.573 -0.687 -1.323 1.00 0.00 H new ATOM 0 HA ILE B 141 -3.620 1.097 -1.688 1.00 0.00 H new ATOM 0 HB ILE B 141 -3.616 -1.933 -2.086 1.00 0.00 H new ATOM 0 HG12 ILE B 141 -3.051 -0.331 0.432 1.00 0.00 H new ATOM 0 HG13 ILE B 141 -4.560 -1.149 0.078 1.00 0.00 H new ATOM 0 HG21 ILE B 141 -1.230 -1.913 -1.396 1.00 0.00 H new ATOM 0 HG22 ILE B 141 -1.502 -1.020 -2.912 1.00 0.00 H new ATOM 0 HG23 ILE B 141 -1.262 -0.134 -1.387 1.00 0.00 H new ATOM 0 HD11 ILE B 141 -3.170 -2.487 1.582 1.00 0.00 H new ATOM 0 HD12 ILE B 141 -3.386 -3.321 0.025 1.00 0.00 H new ATOM 0 HD13 ILE B 141 -1.854 -2.490 0.384 1.00 0.00 H new ATOM 1949 N ALA B 142 -3.968 -0.707 -4.470 1.00 0.00 N ATOM 1950 CA ALA B 142 -3.597 -0.774 -5.899 1.00 0.00 C ATOM 1951 C ALA B 142 -3.807 0.538 -6.623 1.00 0.00 C ATOM 1952 O ALA B 142 -2.878 1.072 -7.229 1.00 0.00 O ATOM 1953 CB ALA B 142 -4.338 -1.893 -6.598 1.00 0.00 C ATOM 0 H ALA B 142 -4.610 -1.440 -4.169 1.00 0.00 H new ATOM 0 HA ALA B 142 -2.528 -0.984 -5.931 1.00 0.00 H new ATOM 0 HB1 ALA B 142 -4.048 -1.921 -7.648 1.00 0.00 H new ATOM 0 HB2 ALA B 142 -4.089 -2.844 -6.127 1.00 0.00 H new ATOM 0 HB3 ALA B 142 -5.412 -1.721 -6.523 1.00 0.00 H new ATOM 1959 N GLU B 143 -4.992 1.074 -6.516 1.00 0.00 N ATOM 1960 CA GLU B 143 -5.323 2.305 -7.189 1.00 0.00 C ATOM 1961 C GLU B 143 -4.690 3.472 -6.484 1.00 0.00 C ATOM 1962 O GLU B 143 -4.292 4.402 -7.124 1.00 0.00 O ATOM 1963 CB GLU B 143 -6.823 2.483 -7.275 1.00 0.00 C ATOM 1964 CG GLU B 143 -7.548 1.325 -7.913 1.00 0.00 C ATOM 1965 CD GLU B 143 -7.072 1.024 -9.288 1.00 0.00 C ATOM 1966 OE1 GLU B 143 -7.383 1.779 -10.202 1.00 0.00 O ATOM 1967 OE2 GLU B 143 -6.410 -0.007 -9.483 1.00 0.00 O ATOM 0 H GLU B 143 -5.752 0.675 -5.965 1.00 0.00 H new ATOM 0 HA GLU B 143 -4.929 2.259 -8.204 1.00 0.00 H new ATOM 0 HB2 GLU B 143 -7.218 2.635 -6.270 1.00 0.00 H new ATOM 0 HB3 GLU B 143 -7.038 3.389 -7.842 1.00 0.00 H new ATOM 0 HG2 GLU B 143 -7.424 0.439 -7.290 1.00 0.00 H new ATOM 0 HG3 GLU B 143 -8.615 1.545 -7.945 1.00 0.00 H new ATOM 1974 N LEU B 144 -4.586 3.404 -5.156 1.00 0.00 N ATOM 1975 CA LEU B 144 -3.968 4.472 -4.381 1.00 0.00 C ATOM 1976 C LEU B 144 -2.528 4.677 -4.826 1.00 0.00 C ATOM 1977 O LEU B 144 -2.080 5.794 -5.037 1.00 0.00 O ATOM 1978 CB LEU B 144 -4.030 4.135 -2.882 1.00 0.00 C ATOM 1979 CG LEU B 144 -3.349 5.119 -1.928 1.00 0.00 C ATOM 1980 CD1 LEU B 144 -3.942 6.509 -2.077 1.00 0.00 C ATOM 1981 CD2 LEU B 144 -3.482 4.638 -0.492 1.00 0.00 C ATOM 0 H LEU B 144 -4.923 2.619 -4.598 1.00 0.00 H new ATOM 0 HA LEU B 144 -4.515 5.399 -4.552 1.00 0.00 H new ATOM 0 HB2 LEU B 144 -5.078 4.053 -2.595 1.00 0.00 H new ATOM 0 HB3 LEU B 144 -3.581 3.153 -2.735 1.00 0.00 H new ATOM 0 HG LEU B 144 -2.291 5.169 -2.184 1.00 0.00 H new ATOM 0 HD11 LEU B 144 -3.444 7.193 -1.390 1.00 0.00 H new ATOM 0 HD12 LEU B 144 -3.802 6.857 -3.100 1.00 0.00 H new ATOM 0 HD13 LEU B 144 -5.007 6.477 -1.848 1.00 0.00 H new ATOM 0 HD21 LEU B 144 -2.993 5.347 0.176 1.00 0.00 H new ATOM 0 HD22 LEU B 144 -4.537 4.561 -0.230 1.00 0.00 H new ATOM 0 HD23 LEU B 144 -3.011 3.660 -0.391 1.00 0.00 H new ATOM 1993 N ALA B 145 -1.842 3.582 -5.021 1.00 0.00 N ATOM 1994 CA ALA B 145 -0.476 3.609 -5.427 1.00 0.00 C ATOM 1995 C ALA B 145 -0.341 3.790 -6.935 1.00 0.00 C ATOM 1996 O ALA B 145 0.750 4.055 -7.451 1.00 0.00 O ATOM 1997 CB ALA B 145 0.219 2.369 -4.949 1.00 0.00 C ATOM 0 H ALA B 145 -2.224 2.644 -4.900 1.00 0.00 H new ATOM 0 HA ALA B 145 0.007 4.472 -4.969 1.00 0.00 H new ATOM 0 HB1 ALA B 145 1.263 2.394 -5.261 1.00 0.00 H new ATOM 0 HB2 ALA B 145 0.167 2.319 -3.861 1.00 0.00 H new ATOM 0 HB3 ALA B 145 -0.267 1.492 -5.376 1.00 0.00 H new ATOM 2003 N ALA B 146 -1.448 3.621 -7.632 1.00 0.00 N ATOM 2004 CA ALA B 146 -1.501 3.847 -9.068 1.00 0.00 C ATOM 2005 C ALA B 146 -1.764 5.304 -9.345 1.00 0.00 C ATOM 2006 O ALA B 146 -1.515 5.802 -10.448 1.00 0.00 O ATOM 2007 CB ALA B 146 -2.584 3.009 -9.718 1.00 0.00 C ATOM 0 H ALA B 146 -2.334 3.324 -7.223 1.00 0.00 H new ATOM 0 HA ALA B 146 -0.540 3.555 -9.490 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -2.598 3.201 -10.791 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -2.382 1.953 -9.541 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -3.552 3.270 -9.290 1.00 0.00 H new ATOM 2013 N LEU B 147 -2.298 5.987 -8.360 1.00 0.00 N ATOM 2014 CA LEU B 147 -2.562 7.382 -8.479 1.00 0.00 C ATOM 2015 C LEU B 147 -1.253 8.165 -8.345 1.00 0.00 C ATOM 2016 O LEU B 147 -0.281 7.680 -7.743 1.00 0.00 O ATOM 2017 CB LEU B 147 -3.563 7.856 -7.414 1.00 0.00 C ATOM 2018 CG LEU B 147 -4.977 7.267 -7.476 1.00 0.00 C ATOM 2019 CD1 LEU B 147 -5.822 7.804 -6.337 1.00 0.00 C ATOM 2020 CD2 LEU B 147 -5.648 7.559 -8.815 1.00 0.00 C ATOM 0 H LEU B 147 -2.557 5.583 -7.460 1.00 0.00 H new ATOM 0 HA LEU B 147 -3.003 7.563 -9.459 1.00 0.00 H new ATOM 0 HB2 LEU B 147 -3.145 7.631 -6.433 1.00 0.00 H new ATOM 0 HB3 LEU B 147 -3.645 8.941 -7.485 1.00 0.00 H new ATOM 0 HG LEU B 147 -4.890 6.185 -7.376 1.00 0.00 H new ATOM 0 HD11 LEU B 147 -6.823 7.377 -6.394 1.00 0.00 H new ATOM 0 HD12 LEU B 147 -5.365 7.532 -5.385 1.00 0.00 H new ATOM 0 HD13 LEU B 147 -5.886 8.890 -6.412 1.00 0.00 H new ATOM 0 HD21 LEU B 147 -6.648 7.126 -8.823 1.00 0.00 H new ATOM 0 HD22 LEU B 147 -5.718 8.637 -8.960 1.00 0.00 H new ATOM 0 HD23 LEU B 147 -5.058 7.122 -9.621 1.00 0.00 H new ATOM 2032 N SER B 148 -1.199 9.330 -8.925 1.00 0.00 N ATOM 2033 CA SER B 148 -0.044 10.171 -8.789 1.00 0.00 C ATOM 2034 C SER B 148 -0.297 11.195 -7.692 1.00 0.00 C ATOM 2035 O SER B 148 -1.400 11.233 -7.111 1.00 0.00 O ATOM 2036 CB SER B 148 0.260 10.852 -10.124 1.00 0.00 C ATOM 2037 OG SER B 148 -0.895 11.513 -10.635 1.00 0.00 O ATOM 0 H SER B 148 -1.946 9.721 -9.500 1.00 0.00 H new ATOM 0 HA SER B 148 0.824 9.573 -8.511 1.00 0.00 H new ATOM 0 HB2 SER B 148 1.068 11.572 -9.993 1.00 0.00 H new ATOM 0 HB3 SER B 148 0.607 10.111 -10.844 1.00 0.00 H new ATOM 0 HG SER B 148 -0.682 12.453 -10.812 1.00 0.00 H new ATOM 2043 N GLN B 149 0.681 12.046 -7.427 1.00 0.00 N ATOM 2044 CA GLN B 149 0.550 13.057 -6.404 1.00 0.00 C ATOM 2045 C GLN B 149 -0.524 14.053 -6.821 1.00 0.00 C ATOM 2046 O GLN B 149 -1.170 14.655 -5.983 1.00 0.00 O ATOM 2047 CB GLN B 149 1.869 13.789 -6.199 1.00 0.00 C ATOM 2048 CG GLN B 149 1.864 14.724 -5.007 1.00 0.00 C ATOM 2049 CD GLN B 149 3.081 15.624 -4.938 1.00 0.00 C ATOM 2050 OE1 GLN B 149 4.184 15.254 -5.367 1.00 0.00 O ATOM 2051 NE2 GLN B 149 2.889 16.810 -4.423 1.00 0.00 N ATOM 0 H GLN B 149 1.578 12.052 -7.913 1.00 0.00 H new ATOM 0 HA GLN B 149 0.271 12.576 -5.466 1.00 0.00 H new ATOM 0 HB2 GLN B 149 2.666 13.056 -6.072 1.00 0.00 H new ATOM 0 HB3 GLN B 149 2.101 14.360 -7.098 1.00 0.00 H new ATOM 0 HG2 GLN B 149 0.967 15.342 -5.044 1.00 0.00 H new ATOM 0 HG3 GLN B 149 1.807 14.133 -4.093 1.00 0.00 H new ATOM 0 HE21 GLN B 149 1.965 17.074 -4.082 1.00 0.00 H new ATOM 0 HE22 GLN B 149 3.663 17.471 -4.363 1.00 0.00 H new ATOM 2060 N ASP B 150 -0.724 14.184 -8.133 1.00 0.00 N ATOM 2061 CA ASP B 150 -1.738 15.096 -8.703 1.00 0.00 C ATOM 2062 C ASP B 150 -3.086 14.706 -8.173 1.00 0.00 C ATOM 2063 O ASP B 150 -3.824 15.520 -7.617 1.00 0.00 O ATOM 2064 CB ASP B 150 -1.809 14.968 -10.231 1.00 0.00 C ATOM 2065 CG ASP B 150 -0.486 15.055 -10.911 1.00 0.00 C ATOM 2066 OD1 ASP B 150 0.014 16.177 -11.151 1.00 0.00 O ATOM 2067 OD2 ASP B 150 0.084 13.978 -11.228 1.00 0.00 O ATOM 0 H ASP B 150 -0.194 13.667 -8.835 1.00 0.00 H new ATOM 0 HA ASP B 150 -1.463 16.115 -8.431 1.00 0.00 H new ATOM 0 HB2 ASP B 150 -2.273 14.015 -10.484 1.00 0.00 H new ATOM 0 HB3 ASP B 150 -2.458 15.752 -10.621 1.00 0.00 H new ATOM 2072 N GLU B 151 -3.360 13.422 -8.283 1.00 0.00 N ATOM 2073 CA GLU B 151 -4.623 12.848 -7.883 1.00 0.00 C ATOM 2074 C GLU B 151 -4.820 13.013 -6.400 1.00 0.00 C ATOM 2075 O GLU B 151 -5.900 13.373 -5.941 1.00 0.00 O ATOM 2076 CB GLU B 151 -4.660 11.376 -8.248 1.00 0.00 C ATOM 2077 CG GLU B 151 -4.424 11.105 -9.721 1.00 0.00 C ATOM 2078 CD GLU B 151 -5.389 11.850 -10.599 1.00 0.00 C ATOM 2079 OE1 GLU B 151 -6.559 11.432 -10.707 1.00 0.00 O ATOM 2080 OE2 GLU B 151 -4.989 12.861 -11.210 1.00 0.00 O ATOM 0 H GLU B 151 -2.700 12.741 -8.658 1.00 0.00 H new ATOM 0 HA GLU B 151 -5.427 13.366 -8.406 1.00 0.00 H new ATOM 0 HB2 GLU B 151 -3.905 10.848 -7.665 1.00 0.00 H new ATOM 0 HB3 GLU B 151 -5.628 10.965 -7.963 1.00 0.00 H new ATOM 0 HG2 GLU B 151 -3.405 11.390 -9.982 1.00 0.00 H new ATOM 0 HG3 GLU B 151 -4.515 10.035 -9.911 1.00 0.00 H new ATOM 2087 N LEU B 152 -3.757 12.791 -5.654 1.00 0.00 N ATOM 2088 CA LEU B 152 -3.804 12.932 -4.221 1.00 0.00 C ATOM 2089 C LEU B 152 -4.056 14.389 -3.838 1.00 0.00 C ATOM 2090 O LEU B 152 -4.800 14.664 -2.930 1.00 0.00 O ATOM 2091 CB LEU B 152 -2.522 12.412 -3.569 1.00 0.00 C ATOM 2092 CG LEU B 152 -2.159 10.953 -3.850 1.00 0.00 C ATOM 2093 CD1 LEU B 152 -0.897 10.564 -3.111 1.00 0.00 C ATOM 2094 CD2 LEU B 152 -3.305 10.014 -3.498 1.00 0.00 C ATOM 0 H LEU B 152 -2.848 12.511 -6.023 1.00 0.00 H new ATOM 0 HA LEU B 152 -4.631 12.327 -3.849 1.00 0.00 H new ATOM 0 HB2 LEU B 152 -1.693 13.039 -3.897 1.00 0.00 H new ATOM 0 HB3 LEU B 152 -2.611 12.540 -2.490 1.00 0.00 H new ATOM 0 HG LEU B 152 -1.974 10.858 -4.920 1.00 0.00 H new ATOM 0 HD11 LEU B 152 -0.657 9.523 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU B 152 -0.074 11.200 -3.436 1.00 0.00 H new ATOM 0 HD13 LEU B 152 -1.050 10.688 -2.039 1.00 0.00 H new ATOM 0 HD21 LEU B 152 -3.011 8.986 -3.711 1.00 0.00 H new ATOM 0 HD22 LEU B 152 -3.543 10.112 -2.439 1.00 0.00 H new ATOM 0 HD23 LEU B 152 -4.182 10.271 -4.092 1.00 0.00 H new ATOM 2106 N THR B 153 -3.475 15.312 -4.572 1.00 0.00 N ATOM 2107 CA THR B 153 -3.673 16.728 -4.311 1.00 0.00 C ATOM 2108 C THR B 153 -5.134 17.111 -4.601 1.00 0.00 C ATOM 2109 O THR B 153 -5.691 17.988 -3.962 1.00 0.00 O ATOM 2110 CB THR B 153 -2.708 17.611 -5.133 1.00 0.00 C ATOM 2111 OG1 THR B 153 -1.369 17.104 -5.002 1.00 0.00 O ATOM 2112 CG2 THR B 153 -2.716 19.030 -4.600 1.00 0.00 C ATOM 0 H THR B 153 -2.858 15.110 -5.359 1.00 0.00 H new ATOM 0 HA THR B 153 -3.452 16.908 -3.259 1.00 0.00 H new ATOM 0 HB THR B 153 -3.030 17.598 -6.174 1.00 0.00 H new ATOM 0 HG1 THR B 153 -1.270 16.296 -5.547 1.00 0.00 H new ATOM 0 HG21 THR B 153 -2.032 19.643 -5.187 1.00 0.00 H new ATOM 0 HG22 THR B 153 -3.723 19.440 -4.672 1.00 0.00 H new ATOM 0 HG23 THR B 153 -2.398 19.029 -3.557 1.00 0.00 H new ATOM 2120 N SER B 154 -5.735 16.434 -5.547 1.00 0.00 N ATOM 2121 CA SER B 154 -7.127 16.658 -5.877 1.00 0.00 C ATOM 2122 C SER B 154 -8.018 16.119 -4.737 1.00 0.00 C ATOM 2123 O SER B 154 -8.871 16.831 -4.194 1.00 0.00 O ATOM 2124 CB SER B 154 -7.463 15.957 -7.211 1.00 0.00 C ATOM 2125 OG SER B 154 -8.810 16.180 -7.614 1.00 0.00 O ATOM 0 H SER B 154 -5.280 15.715 -6.109 1.00 0.00 H new ATOM 0 HA SER B 154 -7.313 17.726 -5.991 1.00 0.00 H new ATOM 0 HB2 SER B 154 -6.789 16.318 -7.988 1.00 0.00 H new ATOM 0 HB3 SER B 154 -7.289 14.886 -7.110 1.00 0.00 H new ATOM 0 HG SER B 154 -8.978 15.720 -8.463 1.00 0.00 H new ATOM 2131 N ILE B 155 -7.765 14.882 -4.356 1.00 0.00 N ATOM 2132 CA ILE B 155 -8.543 14.192 -3.341 1.00 0.00 C ATOM 2133 C ILE B 155 -8.330 14.786 -1.947 1.00 0.00 C ATOM 2134 O ILE B 155 -9.288 15.075 -1.237 1.00 0.00 O ATOM 2135 CB ILE B 155 -8.166 12.697 -3.305 1.00 0.00 C ATOM 2136 CG1 ILE B 155 -8.440 12.047 -4.667 1.00 0.00 C ATOM 2137 CG2 ILE B 155 -8.944 11.981 -2.209 1.00 0.00 C ATOM 2138 CD1 ILE B 155 -7.860 10.656 -4.813 1.00 0.00 C ATOM 0 H ILE B 155 -7.007 14.321 -4.745 1.00 0.00 H new ATOM 0 HA ILE B 155 -9.592 14.313 -3.610 1.00 0.00 H new ATOM 0 HB ILE B 155 -7.102 12.611 -3.087 1.00 0.00 H new ATOM 0 HG12 ILE B 155 -9.517 11.999 -4.825 1.00 0.00 H new ATOM 0 HG13 ILE B 155 -8.031 12.684 -5.451 1.00 0.00 H new ATOM 0 HG21 ILE B 155 -8.667 10.927 -2.196 1.00 0.00 H new ATOM 0 HG22 ILE B 155 -8.709 12.430 -1.244 1.00 0.00 H new ATOM 0 HG23 ILE B 155 -10.013 12.073 -2.402 1.00 0.00 H new ATOM 0 HD11 ILE B 155 -8.097 10.265 -5.803 1.00 0.00 H new ATOM 0 HD12 ILE B 155 -6.778 10.698 -4.689 1.00 0.00 H new ATOM 0 HD13 ILE B 155 -8.287 10.002 -4.053 1.00 0.00 H new ATOM 2150 N LEU B 156 -7.083 14.957 -1.565 1.00 0.00 N ATOM 2151 CA LEU B 156 -6.760 15.426 -0.229 1.00 0.00 C ATOM 2152 C LEU B 156 -6.917 16.934 -0.171 1.00 0.00 C ATOM 2153 O LEU B 156 -7.286 17.497 0.849 1.00 0.00 O ATOM 2154 CB LEU B 156 -5.324 15.029 0.176 1.00 0.00 C ATOM 2155 CG LEU B 156 -4.864 13.585 -0.158 1.00 0.00 C ATOM 2156 CD1 LEU B 156 -3.479 13.330 0.379 1.00 0.00 C ATOM 2157 CD2 LEU B 156 -5.830 12.528 0.356 1.00 0.00 C ATOM 0 H LEU B 156 -6.273 14.779 -2.159 1.00 0.00 H new ATOM 0 HA LEU B 156 -7.447 14.956 0.475 1.00 0.00 H new ATOM 0 HB2 LEU B 156 -4.634 15.723 -0.305 1.00 0.00 H new ATOM 0 HB3 LEU B 156 -5.224 15.174 1.252 1.00 0.00 H new ATOM 0 HG LEU B 156 -4.849 13.505 -1.245 1.00 0.00 H new ATOM 0 HD11 LEU B 156 -3.176 12.312 0.134 1.00 0.00 H new ATOM 0 HD12 LEU B 156 -2.779 14.035 -0.070 1.00 0.00 H new ATOM 0 HD13 LEU B 156 -3.479 13.458 1.461 1.00 0.00 H new ATOM 0 HD21 LEU B 156 -5.458 11.537 0.094 1.00 0.00 H new ATOM 0 HD22 LEU B 156 -5.915 12.609 1.440 1.00 0.00 H new ATOM 0 HD23 LEU B 156 -6.810 12.679 -0.097 1.00 0.00 H new ATOM 2169 N GLY B 157 -6.627 17.572 -1.281 1.00 0.00 N ATOM 2170 CA GLY B 157 -6.770 19.005 -1.399 1.00 0.00 C ATOM 2171 C GLY B 157 -5.563 19.763 -0.908 1.00 0.00 C ATOM 2172 O GLY B 157 -5.548 20.995 -0.912 1.00 0.00 O ATOM 0 H GLY B 157 -6.286 17.114 -2.126 1.00 0.00 H new ATOM 0 HA2 GLY B 157 -6.952 19.261 -2.443 1.00 0.00 H new ATOM 0 HA3 GLY B 157 -7.646 19.324 -0.835 1.00 0.00 H new ATOM 2176 N ASN B 158 -4.546 19.045 -0.488 1.00 0.00 N ATOM 2177 CA ASN B 158 -3.341 19.680 -0.002 1.00 0.00 C ATOM 2178 C ASN B 158 -2.176 18.963 -0.581 1.00 0.00 C ATOM 2179 O ASN B 158 -2.075 17.726 -0.443 1.00 0.00 O ATOM 2180 CB ASN B 158 -3.213 19.645 1.544 1.00 0.00 C ATOM 2181 CG ASN B 158 -4.485 19.309 2.272 1.00 0.00 C ATOM 2182 OD1 ASN B 158 -5.336 20.163 2.517 1.00 0.00 O ATOM 2183 ND2 ASN B 158 -4.584 18.086 2.691 1.00 0.00 N ATOM 0 H ASN B 158 -4.528 18.025 -0.473 1.00 0.00 H new ATOM 0 HA ASN B 158 -3.378 20.727 -0.302 1.00 0.00 H new ATOM 0 HB2 ASN B 158 -2.451 18.914 1.815 1.00 0.00 H new ATOM 0 HB3 ASN B 158 -2.859 20.617 1.888 1.00 0.00 H new ATOM 0 HD21 ASN B 158 -5.391 17.801 3.246 1.00 0.00 H new ATOM 0 HD22 ASN B 158 -3.855 17.409 2.465 1.00 0.00 H new ATOM 2190 N ALA B 159 -1.292 19.706 -1.206 1.00 0.00 N ATOM 2191 CA ALA B 159 -0.098 19.154 -1.818 1.00 0.00 C ATOM 2192 C ALA B 159 0.812 18.563 -0.770 1.00 0.00 C ATOM 2193 O ALA B 159 1.532 17.639 -1.045 1.00 0.00 O ATOM 2194 CB ALA B 159 0.650 20.209 -2.608 1.00 0.00 C ATOM 0 H ALA B 159 -1.379 20.717 -1.307 1.00 0.00 H new ATOM 0 HA ALA B 159 -0.413 18.366 -2.503 1.00 0.00 H new ATOM 0 HB1 ALA B 159 1.540 19.766 -3.055 1.00 0.00 H new ATOM 0 HB2 ALA B 159 0.005 20.600 -3.395 1.00 0.00 H new ATOM 0 HB3 ALA B 159 0.944 21.021 -1.943 1.00 0.00 H new ATOM 2200 N ALA B 160 0.729 19.080 0.444 1.00 0.00 N ATOM 2201 CA ALA B 160 1.552 18.611 1.541 1.00 0.00 C ATOM 2202 C ALA B 160 1.225 17.170 1.855 1.00 0.00 C ATOM 2203 O ALA B 160 2.102 16.321 1.908 1.00 0.00 O ATOM 2204 CB ALA B 160 1.327 19.457 2.764 1.00 0.00 C ATOM 0 H ALA B 160 0.090 19.835 0.695 1.00 0.00 H new ATOM 0 HA ALA B 160 2.598 18.687 1.245 1.00 0.00 H new ATOM 0 HB1 ALA B 160 1.952 19.092 3.579 1.00 0.00 H new ATOM 0 HB2 ALA B 160 1.587 20.492 2.543 1.00 0.00 H new ATOM 0 HB3 ALA B 160 0.279 19.401 3.058 1.00 0.00 H new ATOM 2210 N ASN B 161 -0.060 16.895 2.019 1.00 0.00 N ATOM 2211 CA ASN B 161 -0.522 15.549 2.314 1.00 0.00 C ATOM 2212 C ASN B 161 -0.249 14.644 1.139 1.00 0.00 C ATOM 2213 O ASN B 161 0.237 13.532 1.298 1.00 0.00 O ATOM 2214 CB ASN B 161 -2.024 15.516 2.649 1.00 0.00 C ATOM 2215 CG ASN B 161 -2.388 15.866 4.086 1.00 0.00 C ATOM 2216 OD1 ASN B 161 -3.369 15.368 4.614 1.00 0.00 O ATOM 2217 ND2 ASN B 161 -1.648 16.705 4.705 1.00 0.00 N ATOM 0 H ASN B 161 -0.804 17.590 1.952 1.00 0.00 H new ATOM 0 HA ASN B 161 0.025 15.200 3.190 1.00 0.00 H new ATOM 0 HB2 ASN B 161 -2.541 16.208 1.984 1.00 0.00 H new ATOM 0 HB3 ASN B 161 -2.405 14.518 2.430 1.00 0.00 H new ATOM 0 HD21 ASN B 161 -1.872 16.973 5.663 1.00 0.00 H new ATOM 0 HD22 ASN B 161 -0.834 17.107 4.240 1.00 0.00 H new ATOM 2224 N ALA B 162 -0.497 15.173 -0.041 1.00 0.00 N ATOM 2225 CA ALA B 162 -0.338 14.440 -1.279 1.00 0.00 C ATOM 2226 C ALA B 162 1.104 14.045 -1.502 1.00 0.00 C ATOM 2227 O ALA B 162 1.380 12.940 -1.935 1.00 0.00 O ATOM 2228 CB ALA B 162 -0.827 15.288 -2.427 1.00 0.00 C ATOM 0 H ALA B 162 -0.818 16.133 -0.169 1.00 0.00 H new ATOM 0 HA ALA B 162 -0.927 13.525 -1.219 1.00 0.00 H new ATOM 0 HB1 ALA B 162 -0.709 14.739 -3.361 1.00 0.00 H new ATOM 0 HB2 ALA B 162 -1.880 15.529 -2.279 1.00 0.00 H new ATOM 0 HB3 ALA B 162 -0.246 16.209 -2.472 1.00 0.00 H new ATOM 2234 N LYS B 163 2.014 14.937 -1.173 1.00 0.00 N ATOM 2235 CA LYS B 163 3.415 14.712 -1.382 1.00 0.00 C ATOM 2236 C LYS B 163 3.916 13.705 -0.393 1.00 0.00 C ATOM 2237 O LYS B 163 4.648 12.805 -0.755 1.00 0.00 O ATOM 2238 CB LYS B 163 4.193 16.031 -1.282 1.00 0.00 C ATOM 2239 CG LYS B 163 5.698 15.891 -1.436 1.00 0.00 C ATOM 2240 CD LYS B 163 6.389 17.229 -1.272 1.00 0.00 C ATOM 2241 CE LYS B 163 7.879 17.132 -1.536 1.00 0.00 C ATOM 2242 NZ LYS B 163 8.564 16.204 -0.618 1.00 0.00 N ATOM 0 H LYS B 163 1.795 15.840 -0.752 1.00 0.00 H new ATOM 0 HA LYS B 163 3.571 14.316 -2.385 1.00 0.00 H new ATOM 0 HB2 LYS B 163 3.825 16.714 -2.048 1.00 0.00 H new ATOM 0 HB3 LYS B 163 3.981 16.490 -0.317 1.00 0.00 H new ATOM 0 HG2 LYS B 163 6.079 15.188 -0.695 1.00 0.00 H new ATOM 0 HG3 LYS B 163 5.929 15.476 -2.417 1.00 0.00 H new ATOM 0 HD2 LYS B 163 5.946 17.953 -1.956 1.00 0.00 H new ATOM 0 HD3 LYS B 163 6.223 17.602 -0.261 1.00 0.00 H new ATOM 0 HE2 LYS B 163 8.041 16.805 -2.563 1.00 0.00 H new ATOM 0 HE3 LYS B 163 8.325 18.122 -1.443 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 9.591 16.254 -0.776 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 8.352 16.469 0.365 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 8.233 15.234 -0.794 1.00 0.00 H new ATOM 2256 N GLN B 164 3.461 13.830 0.843 1.00 0.00 N ATOM 2257 CA GLN B 164 3.854 12.916 1.897 1.00 0.00 C ATOM 2258 C GLN B 164 3.405 11.498 1.593 1.00 0.00 C ATOM 2259 O GLN B 164 4.195 10.544 1.696 1.00 0.00 O ATOM 2260 CB GLN B 164 3.309 13.368 3.246 1.00 0.00 C ATOM 2261 CG GLN B 164 3.900 14.652 3.753 1.00 0.00 C ATOM 2262 CD GLN B 164 3.544 14.893 5.197 1.00 0.00 C ATOM 2263 OE1 GLN B 164 4.267 14.478 6.103 1.00 0.00 O ATOM 2264 NE2 GLN B 164 2.445 15.545 5.426 1.00 0.00 N ATOM 0 H GLN B 164 2.815 14.561 1.140 1.00 0.00 H new ATOM 0 HA GLN B 164 4.943 12.924 1.946 1.00 0.00 H new ATOM 0 HB2 GLN B 164 2.228 13.485 3.167 1.00 0.00 H new ATOM 0 HB3 GLN B 164 3.492 12.583 3.980 1.00 0.00 H new ATOM 0 HG2 GLN B 164 4.984 14.622 3.645 1.00 0.00 H new ATOM 0 HG3 GLN B 164 3.542 15.483 3.146 1.00 0.00 H new ATOM 0 HE21 GLN B 164 1.874 15.872 4.647 1.00 0.00 H new ATOM 0 HE22 GLN B 164 2.152 15.730 6.385 1.00 0.00 H new ATOM 2273 N LEU B 165 2.161 11.366 1.184 1.00 0.00 N ATOM 2274 CA LEU B 165 1.607 10.080 0.870 1.00 0.00 C ATOM 2275 C LEU B 165 2.260 9.502 -0.398 1.00 0.00 C ATOM 2276 O LEU B 165 2.699 8.344 -0.402 1.00 0.00 O ATOM 2277 CB LEU B 165 0.063 10.158 0.783 1.00 0.00 C ATOM 2278 CG LEU B 165 -0.667 8.876 0.413 1.00 0.00 C ATOM 2279 CD1 LEU B 165 -0.318 7.775 1.392 1.00 0.00 C ATOM 2280 CD2 LEU B 165 -2.167 9.116 0.407 1.00 0.00 C ATOM 0 H LEU B 165 1.515 12.146 1.063 1.00 0.00 H new ATOM 0 HA LEU B 165 1.835 9.383 1.677 1.00 0.00 H new ATOM 0 HB2 LEU B 165 -0.315 10.499 1.747 1.00 0.00 H new ATOM 0 HB3 LEU B 165 -0.198 10.922 0.050 1.00 0.00 H new ATOM 0 HG LEU B 165 -0.355 8.568 -0.585 1.00 0.00 H new ATOM 0 HD11 LEU B 165 -0.847 6.862 1.117 1.00 0.00 H new ATOM 0 HD12 LEU B 165 0.756 7.593 1.367 1.00 0.00 H new ATOM 0 HD13 LEU B 165 -0.612 8.076 2.398 1.00 0.00 H new ATOM 0 HD21 LEU B 165 -2.682 8.193 0.141 1.00 0.00 H new ATOM 0 HD22 LEU B 165 -2.488 9.438 1.398 1.00 0.00 H new ATOM 0 HD23 LEU B 165 -2.409 9.889 -0.322 1.00 0.00 H new ATOM 2292 N TYR B 166 2.392 10.328 -1.443 1.00 0.00 N ATOM 2293 CA TYR B 166 3.018 9.903 -2.697 1.00 0.00 C ATOM 2294 C TYR B 166 4.465 9.444 -2.472 1.00 0.00 C ATOM 2295 O TYR B 166 4.917 8.423 -3.066 1.00 0.00 O ATOM 2296 CB TYR B 166 2.962 11.044 -3.728 1.00 0.00 C ATOM 2297 CG TYR B 166 3.615 10.753 -5.057 1.00 0.00 C ATOM 2298 CD1 TYR B 166 2.966 10.003 -6.020 1.00 0.00 C ATOM 2299 CD2 TYR B 166 4.883 11.237 -5.346 1.00 0.00 C ATOM 2300 CE1 TYR B 166 3.561 9.741 -7.233 1.00 0.00 C ATOM 2301 CE2 TYR B 166 5.482 10.976 -6.553 1.00 0.00 C ATOM 2302 CZ TYR B 166 4.818 10.229 -7.495 1.00 0.00 C ATOM 2303 OH TYR B 166 5.422 9.951 -8.694 1.00 0.00 O ATOM 0 H TYR B 166 2.072 11.297 -1.443 1.00 0.00 H new ATOM 0 HA TYR B 166 2.460 9.050 -3.084 1.00 0.00 H new ATOM 0 HB2 TYR B 166 1.917 11.299 -3.905 1.00 0.00 H new ATOM 0 HB3 TYR B 166 3.436 11.925 -3.295 1.00 0.00 H new ATOM 0 HD1 TYR B 166 1.978 9.617 -5.818 1.00 0.00 H new ATOM 0 HD2 TYR B 166 5.407 11.828 -4.610 1.00 0.00 H new ATOM 0 HE1 TYR B 166 3.042 9.154 -7.976 1.00 0.00 H new ATOM 0 HE2 TYR B 166 6.471 11.356 -6.761 1.00 0.00 H new ATOM 0 HH TYR B 166 6.307 10.372 -8.720 1.00 0.00 H new ATOM 2313 N ASP B 167 5.169 10.178 -1.625 1.00 0.00 N ATOM 2314 CA ASP B 167 6.555 9.896 -1.281 1.00 0.00 C ATOM 2315 C ASP B 167 6.669 8.558 -0.616 1.00 0.00 C ATOM 2316 O ASP B 167 7.481 7.748 -1.021 1.00 0.00 O ATOM 2317 CB ASP B 167 7.128 10.998 -0.375 1.00 0.00 C ATOM 2318 CG ASP B 167 8.587 10.798 -0.007 1.00 0.00 C ATOM 2319 OD1 ASP B 167 9.463 10.903 -0.899 1.00 0.00 O ATOM 2320 OD2 ASP B 167 8.893 10.601 1.185 1.00 0.00 O ATOM 0 H ASP B 167 4.790 10.997 -1.150 1.00 0.00 H new ATOM 0 HA ASP B 167 7.137 9.876 -2.202 1.00 0.00 H new ATOM 0 HB2 ASP B 167 7.019 11.960 -0.876 1.00 0.00 H new ATOM 0 HB3 ASP B 167 6.537 11.046 0.539 1.00 0.00 H new ATOM 2325 N PHE B 168 5.801 8.299 0.344 1.00 0.00 N ATOM 2326 CA PHE B 168 5.820 7.047 1.093 1.00 0.00 C ATOM 2327 C PHE B 168 5.578 5.854 0.163 1.00 0.00 C ATOM 2328 O PHE B 168 6.338 4.896 0.177 1.00 0.00 O ATOM 2329 CB PHE B 168 4.774 7.086 2.209 1.00 0.00 C ATOM 2330 CG PHE B 168 4.795 5.888 3.128 1.00 0.00 C ATOM 2331 CD1 PHE B 168 5.858 5.687 3.998 1.00 0.00 C ATOM 2332 CD2 PHE B 168 3.746 4.982 3.141 1.00 0.00 C ATOM 2333 CE1 PHE B 168 5.876 4.603 4.856 1.00 0.00 C ATOM 2334 CE2 PHE B 168 3.761 3.895 3.997 1.00 0.00 C ATOM 2335 CZ PHE B 168 4.827 3.707 4.856 1.00 0.00 C ATOM 0 H PHE B 168 5.064 8.944 0.629 1.00 0.00 H new ATOM 0 HA PHE B 168 6.805 6.926 1.544 1.00 0.00 H new ATOM 0 HB2 PHE B 168 4.928 7.987 2.803 1.00 0.00 H new ATOM 0 HB3 PHE B 168 3.784 7.166 1.760 1.00 0.00 H new ATOM 0 HD1 PHE B 168 6.681 6.386 4.005 1.00 0.00 H new ATOM 0 HD2 PHE B 168 2.908 5.126 2.476 1.00 0.00 H new ATOM 0 HE1 PHE B 168 6.711 4.458 5.526 1.00 0.00 H new ATOM 0 HE2 PHE B 168 2.940 3.194 3.994 1.00 0.00 H new ATOM 0 HZ PHE B 168 4.839 2.860 5.526 1.00 0.00 H new ATOM 2345 N ILE B 169 4.555 5.978 -0.680 1.00 0.00 N ATOM 2346 CA ILE B 169 4.165 4.957 -1.678 1.00 0.00 C ATOM 2347 C ILE B 169 5.339 4.598 -2.620 1.00 0.00 C ATOM 2348 O ILE B 169 5.441 3.454 -3.148 1.00 0.00 O ATOM 2349 CB ILE B 169 2.970 5.484 -2.530 1.00 0.00 C ATOM 2350 CG1 ILE B 169 1.721 5.669 -1.666 1.00 0.00 C ATOM 2351 CG2 ILE B 169 2.670 4.573 -3.708 1.00 0.00 C ATOM 2352 CD1 ILE B 169 0.564 6.299 -2.411 1.00 0.00 C ATOM 0 H ILE B 169 3.956 6.803 -0.697 1.00 0.00 H new ATOM 0 HA ILE B 169 3.876 4.058 -1.135 1.00 0.00 H new ATOM 0 HB ILE B 169 3.264 6.455 -2.929 1.00 0.00 H new ATOM 0 HG12 ILE B 169 1.409 4.699 -1.278 1.00 0.00 H new ATOM 0 HG13 ILE B 169 1.972 6.290 -0.806 1.00 0.00 H new ATOM 0 HG21 ILE B 169 1.831 4.976 -4.275 1.00 0.00 H new ATOM 0 HG22 ILE B 169 3.547 4.510 -4.352 1.00 0.00 H new ATOM 0 HG23 ILE B 169 2.416 3.578 -3.343 1.00 0.00 H new ATOM 0 HD11 ILE B 169 -0.289 6.401 -1.740 1.00 0.00 H new ATOM 0 HD12 ILE B 169 0.859 7.283 -2.776 1.00 0.00 H new ATOM 0 HD13 ILE B 169 0.288 5.667 -3.255 1.00 0.00 H new ATOM 2364 N HIS B 170 6.178 5.583 -2.871 1.00 0.00 N ATOM 2365 CA HIS B 170 7.312 5.413 -3.768 1.00 0.00 C ATOM 2366 C HIS B 170 8.672 5.373 -3.054 1.00 0.00 C ATOM 2367 O HIS B 170 9.710 5.435 -3.704 1.00 0.00 O ATOM 2368 CB HIS B 170 7.298 6.481 -4.867 1.00 0.00 C ATOM 2369 CG HIS B 170 6.157 6.318 -5.817 1.00 0.00 C ATOM 2370 ND1 HIS B 170 4.907 6.843 -5.587 1.00 0.00 N ATOM 2371 CD2 HIS B 170 6.068 5.644 -6.982 1.00 0.00 C ATOM 2372 CE1 HIS B 170 4.099 6.487 -6.574 1.00 0.00 C ATOM 2373 NE2 HIS B 170 4.780 5.763 -7.428 1.00 0.00 N ATOM 0 H HIS B 170 6.098 6.516 -2.466 1.00 0.00 H new ATOM 0 HA HIS B 170 7.191 4.430 -4.222 1.00 0.00 H new ATOM 0 HB2 HIS B 170 7.244 7.468 -4.408 1.00 0.00 H new ATOM 0 HB3 HIS B 170 8.236 6.438 -5.421 1.00 0.00 H new ATOM 0 HD1 HIS B 170 4.644 7.415 -4.785 1.00 0.00 H new ATOM 0 HD2 HIS B 170 6.867 5.108 -7.473 1.00 0.00 H new ATOM 0 HE1 HIS B 170 3.055 6.749 -6.661 1.00 0.00 H new ATOM 2382 N THR B 171 8.683 5.243 -1.754 1.00 0.00 N ATOM 2383 CA THR B 171 9.942 5.142 -1.034 1.00 0.00 C ATOM 2384 C THR B 171 10.302 3.685 -0.830 1.00 0.00 C ATOM 2385 O THR B 171 9.726 3.024 0.007 1.00 0.00 O ATOM 2386 CB THR B 171 9.900 5.891 0.330 1.00 0.00 C ATOM 2387 OG1 THR B 171 9.797 7.297 0.101 1.00 0.00 O ATOM 2388 CG2 THR B 171 11.133 5.594 1.197 1.00 0.00 C ATOM 0 H THR B 171 7.848 5.204 -1.169 1.00 0.00 H new ATOM 0 HA THR B 171 10.710 5.624 -1.639 1.00 0.00 H new ATOM 0 HB THR B 171 9.026 5.533 0.875 1.00 0.00 H new ATOM 0 HG1 THR B 171 9.129 7.467 -0.596 1.00 0.00 H new ATOM 0 HG21 THR B 171 11.056 6.140 2.137 1.00 0.00 H new ATOM 0 HG22 THR B 171 11.185 4.525 1.401 1.00 0.00 H new ATOM 0 HG23 THR B 171 12.033 5.907 0.668 1.00 0.00 H new ATOM 2396 N SER B 172 11.244 3.192 -1.627 1.00 0.00 N ATOM 2397 CA SER B 172 11.681 1.811 -1.569 1.00 0.00 C ATOM 2398 C SER B 172 12.084 1.444 -0.111 1.00 0.00 C ATOM 2399 O SER B 172 12.651 2.285 0.617 1.00 0.00 O ATOM 2400 CB SER B 172 12.892 1.656 -2.492 1.00 0.00 C ATOM 2401 OG SER B 172 12.704 2.362 -3.732 1.00 0.00 O ATOM 0 H SER B 172 11.726 3.747 -2.334 1.00 0.00 H new ATOM 0 HA SER B 172 10.875 1.148 -1.885 1.00 0.00 H new ATOM 0 HB2 SER B 172 13.784 2.031 -1.990 1.00 0.00 H new ATOM 0 HB3 SER B 172 13.062 0.599 -2.696 1.00 0.00 H new ATOM 0 HG SER B 172 13.495 2.245 -4.298 1.00 0.00 H new ATOM 2407 N PHE B 173 11.810 0.207 0.311 1.00 0.00 N ATOM 2408 CA PHE B 173 12.130 -0.240 1.690 1.00 0.00 C ATOM 2409 C PHE B 173 13.645 -0.117 1.923 1.00 0.00 C ATOM 2410 O PHE B 173 14.115 0.153 3.042 1.00 0.00 O ATOM 2411 CB PHE B 173 11.686 -1.702 1.907 1.00 0.00 C ATOM 2412 CG PHE B 173 10.313 -2.013 1.361 1.00 0.00 C ATOM 2413 CD1 PHE B 173 9.143 -1.657 2.041 1.00 0.00 C ATOM 2414 CD2 PHE B 173 10.199 -2.639 0.131 1.00 0.00 C ATOM 2415 CE1 PHE B 173 7.912 -1.932 1.483 1.00 0.00 C ATOM 2416 CE2 PHE B 173 8.973 -2.909 -0.422 1.00 0.00 C ATOM 2417 CZ PHE B 173 7.828 -2.552 0.247 1.00 0.00 C ATOM 0 H PHE B 173 11.370 -0.507 -0.270 1.00 0.00 H new ATOM 0 HA PHE B 173 11.593 0.390 2.399 1.00 0.00 H new ATOM 0 HB2 PHE B 173 12.412 -2.365 1.437 1.00 0.00 H new ATOM 0 HB3 PHE B 173 11.700 -1.921 2.975 1.00 0.00 H new ATOM 0 HD1 PHE B 173 9.204 -1.167 3.002 1.00 0.00 H new ATOM 0 HD2 PHE B 173 11.094 -2.920 -0.404 1.00 0.00 H new ATOM 0 HE1 PHE B 173 7.010 -1.663 2.012 1.00 0.00 H new ATOM 0 HE2 PHE B 173 8.908 -3.401 -1.381 1.00 0.00 H new ATOM 0 HZ PHE B 173 6.862 -2.755 -0.191 1.00 0.00 H new