USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1029 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 155 LYS NZ :NH3+ -157:sc= -0.158 (180deg=0) USER MOD Set 1.2: A 157 ASN : amide:sc= -0.0306 K(o=-0.19,f=-3.7) USER MOD Set 2.1: A 131 HIS : no HD1:sc= -0.0263 K(o=-5.3,f=-9.6!) USER MOD Set 2.2: A 142 CYS SG : rot -108:sc= -2.07! USER MOD Set 2.3: A 143 CYS SG : rot 173:sc= -1.91 USER MOD Set 2.4: A 145 GLN :FLIP amide:sc= 1.04 F(o=-10!,f=-5.3) USER MOD Set 2.5: A 153 CYS SG : rot -128:sc= -2.37 USER MOD Set 3.1: A 94 HIS :FLIP no HE2:sc= -0.593 F(o=-1.1,f=-0.6) USER MOD Set 3.2: A 97 ASN : amide:sc=-0.00191 K(o=-0.6,f=-2.3) USER MOD Set 4.1: A 47 MET CE :methyl 138:sc= -0.0151 (180deg=-0.661) USER MOD Set 4.2: A 49 THR OG1 : rot 170:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.12 USER MOD Single : A 23 LYS NZ :NH3+ 162:sc= -0.0327 (180deg=-0.359) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 36 TYR OH : rot 180:sc= 0.606 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -48:sc= 1.39 USER MOD Single : A 45 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0171) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 169:sc= 0.361 (180deg=0.225) USER MOD Single : A 70 LYS NZ :NH3+ -166:sc= 0.58 (180deg=0.459) USER MOD Single : A 71 CYS SG : rot 73:sc= 1.12 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 CYS SG : rot 130:sc= -3.71! USER MOD Single : A 85 GLN :FLIP amide:sc= -0.357 F(o=-1,f=-0.36) USER MOD Single : A 86 ASN : amide:sc= -0.153 K(o=-0.15,f=-4!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 0.139 K(o=0.14,f=-2.6!) USER MOD Single : A 98 THR OG1 : rot 124:sc= 0.0412 USER MOD Single : A 100 TYR OH : rot 150:sc= 1.27 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.029 X(o=-0.029,f=-0.49) USER MOD Single : A 108 SER OG : rot -110:sc= -0.496 USER MOD Single : A 114 LYS NZ :NH3+ 177:sc= 0.355 (180deg=0.344) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 172:sc= 0.838 (180deg=0.794) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN :FLIP amide:sc= 0 F(o=-0.53,f=0) USER MOD Single : A 123 ASN : amide:sc= -0.433 X(o=-0.43,f=0) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= 0.178 K(o=0.18,f=-4.7!) USER MOD Single : A 127 MET CE :methyl 172:sc= -2.47! (180deg=-2.65!) USER MOD Single : A 129 LYS NZ :NH3+ -167:sc=-0.00232 (180deg=-0.115) USER MOD Single : A 130 TYR OH : rot -158:sc= 0.0347 USER MOD Single : A 133 LYS NZ :NH3+ 171:sc= -0.0053 (180deg=-0.0997) USER MOD Single : A 136 THR OG1 : rot -121:sc= 0.469 USER MOD Single : A 139 SER OG : rot -160:sc= 0 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -0.813 K(o=-0.81,f=-3.9!) USER MOD Single : A 146 THR OG1 : rot 74:sc= 0.274 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 TYR OH : rot 45:sc= -0.454 USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -10.198 -2.317 15.344 1.00 14.21 N ATOM 230 CA THR A 15 -9.694 -2.076 13.987 1.00 23.12 C ATOM 231 C THR A 15 -10.266 -0.767 13.412 1.00 22.14 C ATOM 232 O THR A 15 -11.213 -0.178 13.956 1.00 51.21 O ATOM 233 CB THR A 15 -10.057 -3.291 13.053 1.00 12.13 C ATOM 234 OG1 THR A 15 -9.583 -3.087 11.701 1.00 23.42 O ATOM 235 CG2 THR A 15 -11.575 -3.553 13.030 1.00 61.15 C ATOM 0 HA THR A 15 -8.609 -1.978 14.035 1.00 23.12 H new ATOM 0 HB THR A 15 -9.555 -4.163 13.471 1.00 12.13 H new ATOM 0 HG1 THR A 15 -9.824 -3.861 11.150 1.00 23.42 H new ATOM 0 HG21 THR A 15 -11.788 -4.398 12.376 1.00 61.15 H new ATOM 0 HG22 THR A 15 -11.921 -3.779 14.039 1.00 61.15 H new ATOM 0 HG23 THR A 15 -12.091 -2.668 12.659 1.00 61.15 H new ATOM 243 N ILE A 16 -9.658 -0.327 12.310 1.00 2.01 N ATOM 244 CA ILE A 16 -10.097 0.825 11.519 1.00 23.44 C ATOM 245 C ILE A 16 -10.745 0.305 10.223 1.00 43.23 C ATOM 246 O ILE A 16 -11.833 0.750 9.830 1.00 63.35 O ATOM 247 CB ILE A 16 -8.883 1.774 11.176 1.00 45.05 C ATOM 248 CG1 ILE A 16 -8.229 2.332 12.482 1.00 35.25 C ATOM 249 CG2 ILE A 16 -9.302 2.922 10.222 1.00 11.14 C ATOM 250 CD1 ILE A 16 -7.035 3.247 12.252 1.00 75.35 C ATOM 0 H ILE A 16 -8.823 -0.774 11.932 1.00 2.01 H new ATOM 0 HA ILE A 16 -10.817 1.406 12.096 1.00 23.44 H new ATOM 0 HB ILE A 16 -8.137 1.178 10.651 1.00 45.05 H new ATOM 0 HG12 ILE A 16 -8.985 2.878 13.047 1.00 35.25 H new ATOM 0 HG13 ILE A 16 -7.913 1.493 13.102 1.00 35.25 H new ATOM 0 HG21 ILE A 16 -8.439 3.553 10.010 1.00 11.14 H new ATOM 0 HG22 ILE A 16 -9.681 2.501 9.291 1.00 11.14 H new ATOM 0 HG23 ILE A 16 -10.082 3.521 10.693 1.00 11.14 H new ATOM 0 HD11 ILE A 16 -6.646 3.586 13.212 1.00 75.35 H new ATOM 0 HD12 ILE A 16 -6.257 2.702 11.717 1.00 75.35 H new ATOM 0 HD13 ILE A 16 -7.346 4.109 11.662 1.00 75.35 H new ATOM 262 N LEU A 17 -10.060 -0.665 9.588 1.00 42.41 N ATOM 263 CA LEU A 17 -10.439 -1.194 8.265 1.00 34.34 C ATOM 264 C LEU A 17 -9.747 -2.551 8.042 1.00 73.34 C ATOM 265 O LEU A 17 -8.572 -2.696 8.368 1.00 3.20 O ATOM 266 CB LEU A 17 -10.024 -0.171 7.164 1.00 3.32 C ATOM 267 CG LEU A 17 -10.364 -0.540 5.685 1.00 62.54 C ATOM 268 CD1 LEU A 17 -11.871 -0.777 5.491 1.00 2.50 C ATOM 269 CD2 LEU A 17 -9.834 0.542 4.719 1.00 43.32 C ATOM 0 H LEU A 17 -9.227 -1.104 9.979 1.00 42.41 H new ATOM 0 HA LEU A 17 -11.518 -1.342 8.214 1.00 34.34 H new ATOM 0 HB2 LEU A 17 -10.499 0.783 7.392 1.00 3.32 H new ATOM 0 HB3 LEU A 17 -8.947 -0.016 7.235 1.00 3.32 H new ATOM 0 HG LEU A 17 -9.862 -1.479 5.451 1.00 62.54 H new ATOM 0 HD11 LEU A 17 -12.068 -1.031 4.450 1.00 2.50 H new ATOM 0 HD12 LEU A 17 -12.196 -1.596 6.132 1.00 2.50 H new ATOM 0 HD13 LEU A 17 -12.418 0.128 5.753 1.00 2.50 H new ATOM 0 HD21 LEU A 17 -10.081 0.267 3.694 1.00 43.32 H new ATOM 0 HD22 LEU A 17 -10.295 1.501 4.958 1.00 43.32 H new ATOM 0 HD23 LEU A 17 -8.752 0.624 4.822 1.00 43.32 H new ATOM 281 N GLU A 18 -10.482 -3.534 7.492 1.00 21.14 N ATOM 282 CA GLU A 18 -9.948 -4.886 7.216 1.00 13.15 C ATOM 283 C GLU A 18 -10.557 -5.455 5.922 1.00 31.21 C ATOM 284 O GLU A 18 -11.743 -5.246 5.645 1.00 32.42 O ATOM 285 CB GLU A 18 -10.208 -5.851 8.415 1.00 72.54 C ATOM 286 CG GLU A 18 -11.687 -6.238 8.686 1.00 13.31 C ATOM 287 CD GLU A 18 -12.603 -5.046 9.012 1.00 51.51 C ATOM 288 OE1 GLU A 18 -12.374 -4.382 10.043 1.00 75.05 O ATOM 289 OE2 GLU A 18 -13.555 -4.762 8.247 1.00 34.41 O ATOM 0 H GLU A 18 -11.460 -3.417 7.226 1.00 21.14 H new ATOM 0 HA GLU A 18 -8.870 -4.799 7.083 1.00 13.15 H new ATOM 0 HB2 GLU A 18 -9.642 -6.767 8.245 1.00 72.54 H new ATOM 0 HB3 GLU A 18 -9.805 -5.390 9.317 1.00 72.54 H new ATOM 0 HG2 GLU A 18 -12.081 -6.756 7.811 1.00 13.31 H new ATOM 0 HG3 GLU A 18 -11.720 -6.944 9.516 1.00 13.31 H new ATOM 296 N GLU A 19 -9.733 -6.161 5.130 1.00 10.50 N ATOM 297 CA GLU A 19 -10.175 -6.766 3.861 1.00 54.31 C ATOM 298 C GLU A 19 -9.157 -7.815 3.389 1.00 11.41 C ATOM 299 O GLU A 19 -7.968 -7.764 3.749 1.00 60.00 O ATOM 300 CB GLU A 19 -10.405 -5.653 2.779 1.00 62.24 C ATOM 301 CG GLU A 19 -10.934 -6.133 1.400 1.00 11.45 C ATOM 302 CD GLU A 19 -12.202 -7.009 1.485 1.00 74.34 C ATOM 303 OE1 GLU A 19 -13.235 -6.534 2.012 1.00 14.51 O ATOM 304 OE2 GLU A 19 -12.168 -8.185 1.041 1.00 34.03 O ATOM 0 H GLU A 19 -8.751 -6.328 5.348 1.00 10.50 H new ATOM 0 HA GLU A 19 -11.126 -7.275 4.019 1.00 54.31 H new ATOM 0 HB2 GLU A 19 -11.110 -4.925 3.181 1.00 62.24 H new ATOM 0 HB3 GLU A 19 -9.462 -5.130 2.620 1.00 62.24 H new ATOM 0 HG2 GLU A 19 -11.147 -5.262 0.781 1.00 11.45 H new ATOM 0 HG3 GLU A 19 -10.148 -6.697 0.897 1.00 11.45 H new ATOM 311 N ILE A 20 -9.660 -8.771 2.591 1.00 33.13 N ATOM 312 CA ILE A 20 -8.856 -9.767 1.900 1.00 10.20 C ATOM 313 C ILE A 20 -8.205 -9.088 0.671 1.00 75.11 C ATOM 314 O ILE A 20 -8.839 -8.914 -0.380 1.00 44.23 O ATOM 315 CB ILE A 20 -9.767 -10.982 1.475 1.00 22.20 C ATOM 316 CG1 ILE A 20 -10.386 -11.692 2.727 1.00 3.21 C ATOM 317 CG2 ILE A 20 -9.011 -11.992 0.586 1.00 64.43 C ATOM 318 CD1 ILE A 20 -9.381 -12.375 3.641 1.00 0.32 C ATOM 0 H ILE A 20 -10.659 -8.867 2.411 1.00 33.13 H new ATOM 0 HA ILE A 20 -8.072 -10.157 2.550 1.00 10.20 H new ATOM 0 HB ILE A 20 -10.582 -10.573 0.878 1.00 22.20 H new ATOM 0 HG12 ILE A 20 -10.940 -10.954 3.308 1.00 3.21 H new ATOM 0 HG13 ILE A 20 -11.107 -12.435 2.385 1.00 3.21 H new ATOM 0 HG21 ILE A 20 -9.678 -12.811 0.318 1.00 64.43 H new ATOM 0 HG22 ILE A 20 -8.667 -11.493 -0.320 1.00 64.43 H new ATOM 0 HG23 ILE A 20 -8.153 -12.386 1.131 1.00 64.43 H new ATOM 0 HD11 ILE A 20 -9.905 -12.837 4.478 1.00 0.32 H new ATOM 0 HD12 ILE A 20 -8.843 -13.141 3.082 1.00 0.32 H new ATOM 0 HD13 ILE A 20 -8.673 -11.637 4.019 1.00 0.32 H new ATOM 330 N LEU A 21 -6.969 -8.624 0.856 1.00 42.34 N ATOM 331 CA LEU A 21 -6.174 -7.970 -0.196 1.00 62.12 C ATOM 332 C LEU A 21 -5.047 -8.921 -0.615 1.00 34.23 C ATOM 333 O LEU A 21 -4.549 -9.681 0.214 1.00 52.42 O ATOM 334 CB LEU A 21 -5.551 -6.665 0.346 1.00 60.22 C ATOM 335 CG LEU A 21 -6.500 -5.634 1.031 1.00 12.24 C ATOM 336 CD1 LEU A 21 -5.685 -4.513 1.701 1.00 12.51 C ATOM 337 CD2 LEU A 21 -7.511 -5.049 0.033 1.00 11.30 C ATOM 0 H LEU A 21 -6.481 -8.690 1.750 1.00 42.34 H new ATOM 0 HA LEU A 21 -6.815 -7.735 -1.045 1.00 62.12 H new ATOM 0 HB2 LEU A 21 -4.778 -6.937 1.064 1.00 60.22 H new ATOM 0 HB3 LEU A 21 -5.053 -6.162 -0.483 1.00 60.22 H new ATOM 0 HG LEU A 21 -7.065 -6.161 1.800 1.00 12.24 H new ATOM 0 HD11 LEU A 21 -6.363 -3.803 2.174 1.00 12.51 H new ATOM 0 HD12 LEU A 21 -5.026 -4.943 2.455 1.00 12.51 H new ATOM 0 HD13 LEU A 21 -5.087 -3.998 0.949 1.00 12.51 H new ATOM 0 HD21 LEU A 21 -8.156 -4.335 0.545 1.00 11.30 H new ATOM 0 HD22 LEU A 21 -6.977 -4.544 -0.772 1.00 11.30 H new ATOM 0 HD23 LEU A 21 -8.118 -5.853 -0.383 1.00 11.30 H new ATOM 349 N ILE A 22 -4.618 -8.858 -1.880 1.00 73.21 N ATOM 350 CA ILE A 22 -3.514 -9.702 -2.368 1.00 1.44 C ATOM 351 C ILE A 22 -2.195 -8.908 -2.371 1.00 62.15 C ATOM 352 O ILE A 22 -2.028 -7.946 -3.111 1.00 55.23 O ATOM 353 CB ILE A 22 -3.836 -10.311 -3.779 1.00 61.32 C ATOM 354 CG1 ILE A 22 -5.030 -11.314 -3.639 1.00 12.41 C ATOM 355 CG2 ILE A 22 -2.592 -10.985 -4.409 1.00 45.14 C ATOM 356 CD1 ILE A 22 -5.388 -12.073 -4.896 1.00 70.31 C ATOM 0 H ILE A 22 -5.014 -8.235 -2.584 1.00 73.21 H new ATOM 0 HA ILE A 22 -3.397 -10.543 -1.685 1.00 1.44 H new ATOM 0 HB ILE A 22 -4.123 -9.508 -4.458 1.00 61.32 H new ATOM 0 HG12 ILE A 22 -4.789 -12.033 -2.857 1.00 12.41 H new ATOM 0 HG13 ILE A 22 -5.909 -10.762 -3.305 1.00 12.41 H new ATOM 0 HG21 ILE A 22 -2.855 -11.394 -5.384 1.00 45.14 H new ATOM 0 HG22 ILE A 22 -1.799 -10.247 -4.527 1.00 45.14 H new ATOM 0 HG23 ILE A 22 -2.246 -11.789 -3.759 1.00 45.14 H new ATOM 0 HD11 ILE A 22 -6.226 -12.740 -4.692 1.00 70.31 H new ATOM 0 HD12 ILE A 22 -5.667 -11.368 -5.679 1.00 70.31 H new ATOM 0 HD13 ILE A 22 -4.530 -12.659 -5.224 1.00 70.31 H new ATOM 368 N LYS A 23 -1.275 -9.356 -1.527 1.00 40.20 N ATOM 369 CA LYS A 23 0.059 -8.778 -1.339 1.00 51.25 C ATOM 370 C LYS A 23 1.044 -9.366 -2.375 1.00 54.43 C ATOM 371 O LYS A 23 0.987 -10.553 -2.670 1.00 12.25 O ATOM 372 CB LYS A 23 0.505 -9.125 0.112 1.00 12.05 C ATOM 373 CG LYS A 23 1.994 -8.903 0.446 1.00 64.23 C ATOM 374 CD LYS A 23 2.332 -9.321 1.898 1.00 12.03 C ATOM 375 CE LYS A 23 3.844 -9.401 2.160 1.00 32.41 C ATOM 376 NZ LYS A 23 4.539 -8.119 1.891 1.00 11.44 N ATOM 0 H LYS A 23 -1.440 -10.165 -0.928 1.00 40.20 H new ATOM 0 HA LYS A 23 0.044 -7.698 -1.483 1.00 51.25 H new ATOM 0 HB2 LYS A 23 -0.092 -8.531 0.804 1.00 12.05 H new ATOM 0 HB3 LYS A 23 0.265 -10.171 0.302 1.00 12.05 H new ATOM 0 HG2 LYS A 23 2.610 -9.474 -0.248 1.00 64.23 H new ATOM 0 HG3 LYS A 23 2.244 -7.852 0.304 1.00 64.23 H new ATOM 0 HD2 LYS A 23 1.886 -8.607 2.590 1.00 12.03 H new ATOM 0 HD3 LYS A 23 1.880 -10.291 2.106 1.00 12.03 H new ATOM 0 HE2 LYS A 23 4.014 -9.692 3.197 1.00 32.41 H new ATOM 0 HE3 LYS A 23 4.276 -10.182 1.535 1.00 32.41 H new ATOM 0 HZ1 LYS A 23 5.468 -8.123 2.358 1.00 11.44 H new ATOM 0 HZ2 LYS A 23 4.668 -8.002 0.866 1.00 11.44 H new ATOM 0 HZ3 LYS A 23 3.969 -7.331 2.260 1.00 11.44 H new ATOM 390 N ARG A 24 1.935 -8.525 -2.933 1.00 64.31 N ATOM 391 CA ARG A 24 3.115 -9.003 -3.671 1.00 60.45 C ATOM 392 C ARG A 24 4.206 -9.289 -2.628 1.00 1.42 C ATOM 393 O ARG A 24 4.570 -8.398 -1.839 1.00 52.41 O ATOM 394 CB ARG A 24 3.604 -7.955 -4.711 1.00 63.12 C ATOM 395 CG ARG A 24 4.935 -8.331 -5.413 1.00 31.23 C ATOM 396 CD ARG A 24 5.429 -7.281 -6.429 1.00 51.11 C ATOM 397 NE ARG A 24 4.645 -7.275 -7.682 1.00 4.44 N ATOM 398 CZ ARG A 24 4.942 -6.544 -8.779 1.00 24.11 C ATOM 399 NH1 ARG A 24 6.003 -5.734 -8.808 1.00 52.43 N ATOM 400 NH2 ARG A 24 4.176 -6.647 -9.857 1.00 42.11 N ATOM 0 H ARG A 24 1.858 -7.509 -2.885 1.00 64.31 H new ATOM 0 HA ARG A 24 2.869 -9.901 -4.237 1.00 60.45 H new ATOM 0 HB2 ARG A 24 2.831 -7.823 -5.468 1.00 63.12 H new ATOM 0 HB3 ARG A 24 3.728 -6.994 -4.211 1.00 63.12 H new ATOM 0 HG2 ARG A 24 5.704 -8.478 -4.655 1.00 31.23 H new ATOM 0 HG3 ARG A 24 4.806 -9.284 -5.925 1.00 31.23 H new ATOM 0 HD2 ARG A 24 5.382 -6.292 -5.973 1.00 51.11 H new ATOM 0 HD3 ARG A 24 6.476 -7.475 -6.663 1.00 51.11 H new ATOM 0 HE ARG A 24 3.816 -7.868 -7.722 1.00 4.44 H new ATOM 0 HH11 ARG A 24 6.609 -5.658 -7.991 1.00 52.43 H new ATOM 0 HH12 ARG A 24 6.208 -5.192 -9.647 1.00 52.43 H new ATOM 0 HH21 ARG A 24 3.371 -7.274 -9.853 1.00 42.11 H new ATOM 0 HH22 ARG A 24 4.392 -6.099 -10.690 1.00 42.11 H new ATOM 414 N SER A 25 4.692 -10.538 -2.605 1.00 21.41 N ATOM 415 CA SER A 25 5.645 -11.011 -1.597 1.00 3.41 C ATOM 416 C SER A 25 7.043 -10.454 -1.900 1.00 71.05 C ATOM 417 O SER A 25 7.484 -10.450 -3.061 1.00 71.25 O ATOM 418 CB SER A 25 5.678 -12.563 -1.569 1.00 42.42 C ATOM 419 OG SER A 25 6.565 -13.060 -0.572 1.00 44.10 O ATOM 0 H SER A 25 4.433 -11.249 -3.288 1.00 21.41 H new ATOM 0 HA SER A 25 5.327 -10.656 -0.617 1.00 3.41 H new ATOM 0 HB2 SER A 25 4.674 -12.944 -1.383 1.00 42.42 H new ATOM 0 HB3 SER A 25 5.985 -12.937 -2.546 1.00 42.42 H new ATOM 0 HG SER A 25 6.556 -14.040 -0.585 1.00 44.10 H new ATOM 583 N ASN A 35 5.748 -13.643 -5.896 1.00 31.33 N ATOM 584 CA ASN A 35 4.509 -14.422 -5.772 1.00 4.21 C ATOM 585 C ASN A 35 3.424 -13.569 -5.109 1.00 42.53 C ATOM 586 O ASN A 35 3.701 -12.804 -4.183 1.00 52.52 O ATOM 587 CB ASN A 35 4.736 -15.707 -4.941 1.00 43.34 C ATOM 588 CG ASN A 35 3.471 -16.583 -4.801 1.00 70.41 C ATOM 589 OD1 ASN A 35 2.658 -16.696 -5.717 1.00 54.10 O ATOM 590 ND2 ASN A 35 3.286 -17.189 -3.643 1.00 30.14 N ATOM 0 HA ASN A 35 4.191 -14.712 -6.773 1.00 4.21 H new ATOM 0 HB2 ASN A 35 5.526 -16.296 -5.406 1.00 43.34 H new ATOM 0 HB3 ASN A 35 5.088 -15.430 -3.947 1.00 43.34 H new ATOM 0 HD21 ASN A 35 2.457 -17.764 -3.495 1.00 30.14 H new ATOM 0 HD22 ASN A 35 3.972 -17.082 -2.896 1.00 30.14 H new ATOM 597 N TYR A 36 2.196 -13.718 -5.588 1.00 4.10 N ATOM 598 CA TYR A 36 1.041 -12.977 -5.089 1.00 52.13 C ATOM 599 C TYR A 36 0.359 -13.794 -3.993 1.00 61.25 C ATOM 600 O TYR A 36 -0.279 -14.815 -4.259 1.00 22.23 O ATOM 601 CB TYR A 36 0.111 -12.642 -6.272 1.00 45.51 C ATOM 602 CG TYR A 36 0.823 -11.709 -7.266 1.00 60.13 C ATOM 603 CD1 TYR A 36 0.865 -10.334 -7.042 1.00 41.30 C ATOM 604 CD2 TYR A 36 1.538 -12.212 -8.360 1.00 24.43 C ATOM 605 CE1 TYR A 36 1.555 -9.498 -7.891 1.00 74.13 C ATOM 606 CE2 TYR A 36 2.238 -11.372 -9.200 1.00 21.33 C ATOM 607 CZ TYR A 36 2.251 -10.020 -8.956 1.00 53.22 C ATOM 608 OH TYR A 36 2.952 -9.176 -9.786 1.00 3.03 O ATOM 0 H TYR A 36 1.969 -14.365 -6.344 1.00 4.10 H new ATOM 0 HA TYR A 36 1.338 -12.030 -4.639 1.00 52.13 H new ATOM 0 HB2 TYR A 36 -0.191 -13.560 -6.777 1.00 45.51 H new ATOM 0 HB3 TYR A 36 -0.798 -12.167 -5.905 1.00 45.51 H new ATOM 0 HD1 TYR A 36 0.349 -9.918 -6.190 1.00 41.30 H new ATOM 0 HD2 TYR A 36 1.541 -13.275 -8.549 1.00 24.43 H new ATOM 0 HE1 TYR A 36 1.550 -8.432 -7.720 1.00 74.13 H new ATOM 0 HE2 TYR A 36 2.774 -11.775 -10.046 1.00 21.33 H new ATOM 0 HH TYR A 36 3.391 -9.699 -10.489 1.00 3.03 H new ATOM 618 N LYS A 37 0.551 -13.331 -2.749 1.00 20.44 N ATOM 619 CA LYS A 37 0.097 -13.998 -1.536 1.00 12.43 C ATOM 620 C LYS A 37 -1.138 -13.260 -0.995 1.00 50.12 C ATOM 621 O LYS A 37 -1.052 -12.089 -0.615 1.00 52.00 O ATOM 622 CB LYS A 37 1.236 -13.968 -0.474 1.00 75.10 C ATOM 623 CG LYS A 37 0.961 -14.819 0.793 1.00 34.12 C ATOM 624 CD LYS A 37 0.910 -16.342 0.499 1.00 61.00 C ATOM 625 CE LYS A 37 2.239 -16.881 -0.071 1.00 0.11 C ATOM 626 NZ LYS A 37 2.193 -18.343 -0.304 1.00 21.34 N ATOM 0 H LYS A 37 1.041 -12.456 -2.562 1.00 20.44 H new ATOM 0 HA LYS A 37 -0.162 -15.034 -1.754 1.00 12.43 H new ATOM 0 HB2 LYS A 37 2.157 -14.319 -0.939 1.00 75.10 H new ATOM 0 HB3 LYS A 37 1.406 -12.935 -0.172 1.00 75.10 H new ATOM 0 HG2 LYS A 37 1.738 -14.623 1.532 1.00 34.12 H new ATOM 0 HG3 LYS A 37 0.015 -14.508 1.235 1.00 34.12 H new ATOM 0 HD2 LYS A 37 0.669 -16.878 1.417 1.00 61.00 H new ATOM 0 HD3 LYS A 37 0.106 -16.545 -0.209 1.00 61.00 H new ATOM 0 HE2 LYS A 37 2.464 -16.372 -1.008 1.00 0.11 H new ATOM 0 HE3 LYS A 37 3.050 -16.650 0.620 1.00 0.11 H new ATOM 0 HZ1 LYS A 37 3.106 -18.662 -0.687 1.00 21.34 H new ATOM 0 HZ2 LYS A 37 2.004 -18.832 0.594 1.00 21.34 H new ATOM 0 HZ3 LYS A 37 1.437 -18.563 -0.983 1.00 21.34 H new ATOM 640 N GLU A 38 -2.272 -13.961 -0.970 1.00 73.31 N ATOM 641 CA GLU A 38 -3.534 -13.433 -0.436 1.00 61.42 C ATOM 642 C GLU A 38 -3.413 -13.301 1.097 1.00 70.11 C ATOM 643 O GLU A 38 -2.884 -14.199 1.760 1.00 20.41 O ATOM 644 CB GLU A 38 -4.703 -14.366 -0.870 1.00 44.54 C ATOM 645 CG GLU A 38 -6.123 -13.964 -0.380 1.00 42.34 C ATOM 646 CD GLU A 38 -6.505 -14.547 1.000 1.00 73.41 C ATOM 647 OE1 GLU A 38 -6.800 -15.758 1.073 1.00 4.11 O ATOM 648 OE2 GLU A 38 -6.481 -13.815 2.013 1.00 34.04 O ATOM 0 H GLU A 38 -2.344 -14.916 -1.321 1.00 73.31 H new ATOM 0 HA GLU A 38 -3.747 -12.441 -0.835 1.00 61.42 H new ATOM 0 HB2 GLU A 38 -4.717 -14.413 -1.959 1.00 44.54 H new ATOM 0 HB3 GLU A 38 -4.489 -15.373 -0.510 1.00 44.54 H new ATOM 0 HG2 GLU A 38 -6.185 -12.877 -0.332 1.00 42.34 H new ATOM 0 HG3 GLU A 38 -6.856 -14.293 -1.117 1.00 42.34 H new ATOM 655 N ARG A 39 -3.853 -12.151 1.637 1.00 50.32 N ATOM 656 CA ARG A 39 -3.777 -11.840 3.079 1.00 12.20 C ATOM 657 C ARG A 39 -5.020 -11.057 3.547 1.00 35.32 C ATOM 658 O ARG A 39 -5.582 -10.255 2.804 1.00 44.42 O ATOM 659 CB ARG A 39 -2.509 -10.990 3.390 1.00 42.14 C ATOM 660 CG ARG A 39 -1.151 -11.703 3.228 1.00 42.23 C ATOM 661 CD ARG A 39 -0.963 -12.845 4.239 1.00 21.33 C ATOM 662 NE ARG A 39 0.395 -13.403 4.187 1.00 63.14 N ATOM 663 CZ ARG A 39 1.063 -13.895 5.234 1.00 53.13 C ATOM 664 NH1 ARG A 39 0.519 -13.913 6.455 1.00 31.24 N ATOM 665 NH2 ARG A 39 2.280 -14.355 5.055 1.00 1.23 N ATOM 0 H ARG A 39 -4.274 -11.405 1.083 1.00 50.32 H new ATOM 0 HA ARG A 39 -3.728 -12.790 3.612 1.00 12.20 H new ATOM 0 HB2 ARG A 39 -2.516 -10.115 2.740 1.00 42.14 H new ATOM 0 HB3 ARG A 39 -2.584 -10.626 4.415 1.00 42.14 H new ATOM 0 HG2 ARG A 39 -1.071 -12.101 2.216 1.00 42.23 H new ATOM 0 HG3 ARG A 39 -0.346 -10.978 3.350 1.00 42.23 H new ATOM 0 HD2 ARG A 39 -1.166 -12.477 5.245 1.00 21.33 H new ATOM 0 HD3 ARG A 39 -1.688 -13.633 4.036 1.00 21.33 H new ATOM 0 HE ARG A 39 0.864 -13.416 3.281 1.00 63.14 H new ATOM 0 HH11 ARG A 39 -0.422 -13.547 6.600 1.00 31.24 H new ATOM 0 HH12 ARG A 39 1.045 -14.293 7.242 1.00 31.24 H new ATOM 0 HH21 ARG A 39 2.702 -14.333 4.127 1.00 1.23 H new ATOM 0 HH22 ARG A 39 2.803 -14.734 5.844 1.00 1.23 H new ATOM 679 N LEU A 40 -5.402 -11.296 4.808 1.00 14.12 N ATOM 680 CA LEU A 40 -6.389 -10.496 5.540 1.00 5.12 C ATOM 681 C LEU A 40 -5.646 -9.342 6.240 1.00 4.33 C ATOM 682 O LEU A 40 -5.091 -9.518 7.334 1.00 11.32 O ATOM 683 CB LEU A 40 -7.147 -11.378 6.581 1.00 53.50 C ATOM 684 CG LEU A 40 -8.170 -10.639 7.516 1.00 2.04 C ATOM 685 CD1 LEU A 40 -9.305 -9.962 6.712 1.00 61.02 C ATOM 686 CD2 LEU A 40 -8.730 -11.601 8.586 1.00 23.21 C ATOM 0 H LEU A 40 -5.025 -12.068 5.358 1.00 14.12 H new ATOM 0 HA LEU A 40 -7.132 -10.095 4.850 1.00 5.12 H new ATOM 0 HB2 LEU A 40 -7.682 -12.159 6.041 1.00 53.50 H new ATOM 0 HB3 LEU A 40 -6.408 -11.874 7.210 1.00 53.50 H new ATOM 0 HG LEU A 40 -7.630 -9.843 8.028 1.00 2.04 H new ATOM 0 HD11 LEU A 40 -9.989 -9.463 7.398 1.00 61.02 H new ATOM 0 HD12 LEU A 40 -8.879 -9.229 6.027 1.00 61.02 H new ATOM 0 HD13 LEU A 40 -9.848 -10.717 6.143 1.00 61.02 H new ATOM 0 HD21 LEU A 40 -9.436 -11.067 9.222 1.00 23.21 H new ATOM 0 HD22 LEU A 40 -9.238 -12.432 8.098 1.00 23.21 H new ATOM 0 HD23 LEU A 40 -7.911 -11.984 9.195 1.00 23.21 H new ATOM 698 N PHE A 41 -5.587 -8.178 5.570 1.00 14.12 N ATOM 699 CA PHE A 41 -4.949 -6.971 6.126 1.00 51.15 C ATOM 700 C PHE A 41 -5.904 -6.309 7.129 1.00 45.22 C ATOM 701 O PHE A 41 -6.998 -5.885 6.755 1.00 22.20 O ATOM 702 CB PHE A 41 -4.576 -5.963 5.001 1.00 41.12 C ATOM 703 CG PHE A 41 -3.345 -6.341 4.175 1.00 3.15 C ATOM 704 CD1 PHE A 41 -3.426 -7.264 3.134 1.00 51.42 C ATOM 705 CD2 PHE A 41 -2.104 -5.765 4.442 1.00 61.02 C ATOM 706 CE1 PHE A 41 -2.312 -7.586 2.384 1.00 71.32 C ATOM 707 CE2 PHE A 41 -0.991 -6.088 3.692 1.00 5.01 C ATOM 708 CZ PHE A 41 -1.094 -7.001 2.667 1.00 75.33 C ATOM 0 H PHE A 41 -5.976 -8.047 4.636 1.00 14.12 H new ATOM 0 HA PHE A 41 -4.029 -7.265 6.630 1.00 51.15 H new ATOM 0 HB2 PHE A 41 -5.428 -5.860 4.329 1.00 41.12 H new ATOM 0 HB3 PHE A 41 -4.406 -4.985 5.452 1.00 41.12 H new ATOM 0 HD1 PHE A 41 -4.373 -7.734 2.911 1.00 51.42 H new ATOM 0 HD2 PHE A 41 -2.012 -5.054 5.250 1.00 61.02 H new ATOM 0 HE1 PHE A 41 -2.394 -8.297 1.575 1.00 71.32 H new ATOM 0 HE2 PHE A 41 -0.040 -5.625 3.909 1.00 5.01 H new ATOM 0 HZ PHE A 41 -0.222 -7.260 2.084 1.00 75.33 H new ATOM 718 N VAL A 42 -5.492 -6.270 8.405 1.00 74.42 N ATOM 719 CA VAL A 42 -6.212 -5.575 9.481 1.00 55.43 C ATOM 720 C VAL A 42 -5.413 -4.314 9.856 1.00 12.51 C ATOM 721 O VAL A 42 -4.246 -4.405 10.254 1.00 13.40 O ATOM 722 CB VAL A 42 -6.404 -6.498 10.744 1.00 31.21 C ATOM 723 CG1 VAL A 42 -7.182 -5.763 11.869 1.00 2.21 C ATOM 724 CG2 VAL A 42 -7.104 -7.827 10.355 1.00 71.31 C ATOM 0 H VAL A 42 -4.637 -6.727 8.722 1.00 74.42 H new ATOM 0 HA VAL A 42 -7.208 -5.306 9.130 1.00 55.43 H new ATOM 0 HB VAL A 42 -5.415 -6.739 11.134 1.00 31.21 H new ATOM 0 HG11 VAL A 42 -7.297 -6.427 12.725 1.00 2.21 H new ATOM 0 HG12 VAL A 42 -6.630 -4.873 12.172 1.00 2.21 H new ATOM 0 HG13 VAL A 42 -8.166 -5.472 11.501 1.00 2.21 H new ATOM 0 HG21 VAL A 42 -7.226 -8.448 11.243 1.00 71.31 H new ATOM 0 HG22 VAL A 42 -8.083 -7.611 9.926 1.00 71.31 H new ATOM 0 HG23 VAL A 42 -6.496 -8.357 9.622 1.00 71.31 H new ATOM 734 N LEU A 43 -6.046 -3.144 9.720 1.00 51.43 N ATOM 735 CA LEU A 43 -5.408 -1.841 9.934 1.00 51.01 C ATOM 736 C LEU A 43 -5.825 -1.287 11.300 1.00 74.20 C ATOM 737 O LEU A 43 -7.002 -1.045 11.536 1.00 32.00 O ATOM 738 CB LEU A 43 -5.820 -0.854 8.802 1.00 23.35 C ATOM 739 CG LEU A 43 -5.260 0.605 8.912 1.00 73.54 C ATOM 740 CD1 LEU A 43 -3.718 0.619 8.905 1.00 33.31 C ATOM 741 CD2 LEU A 43 -5.840 1.507 7.799 1.00 14.32 C ATOM 0 H LEU A 43 -7.028 -3.075 9.455 1.00 51.43 H new ATOM 0 HA LEU A 43 -4.325 -1.960 9.913 1.00 51.01 H new ATOM 0 HB2 LEU A 43 -5.497 -1.273 7.849 1.00 23.35 H new ATOM 0 HB3 LEU A 43 -6.908 -0.801 8.774 1.00 23.35 H new ATOM 0 HG LEU A 43 -5.582 1.013 9.870 1.00 73.54 H new ATOM 0 HD11 LEU A 43 -3.363 1.647 8.983 1.00 33.31 H new ATOM 0 HD12 LEU A 43 -3.345 0.041 9.751 1.00 33.31 H new ATOM 0 HD13 LEU A 43 -3.354 0.179 7.977 1.00 33.31 H new ATOM 0 HD21 LEU A 43 -5.435 2.514 7.899 1.00 14.32 H new ATOM 0 HD22 LEU A 43 -5.569 1.102 6.824 1.00 14.32 H new ATOM 0 HD23 LEU A 43 -6.926 1.542 7.888 1.00 14.32 H new ATOM 753 N THR A 44 -4.849 -1.139 12.198 1.00 25.44 N ATOM 754 CA THR A 44 -5.015 -0.432 13.475 1.00 43.44 C ATOM 755 C THR A 44 -4.310 0.938 13.380 1.00 24.22 C ATOM 756 O THR A 44 -3.681 1.247 12.352 1.00 33.11 O ATOM 757 CB THR A 44 -4.436 -1.267 14.668 1.00 33.44 C ATOM 758 OG1 THR A 44 -3.016 -1.435 14.521 1.00 4.44 O ATOM 759 CG2 THR A 44 -5.109 -2.650 14.778 1.00 23.10 C ATOM 0 H THR A 44 -3.909 -1.510 12.060 1.00 25.44 H new ATOM 0 HA THR A 44 -6.078 -0.289 13.667 1.00 43.44 H new ATOM 0 HB THR A 44 -4.646 -0.712 15.582 1.00 33.44 H new ATOM 0 HG1 THR A 44 -2.815 -1.735 13.610 1.00 4.44 H new ATOM 0 HG21 THR A 44 -4.680 -3.198 15.617 1.00 23.10 H new ATOM 0 HG22 THR A 44 -6.180 -2.522 14.938 1.00 23.10 H new ATOM 0 HG23 THR A 44 -4.944 -3.209 13.857 1.00 23.10 H new ATOM 767 N LYS A 45 -4.394 1.751 14.455 1.00 53.11 N ATOM 768 CA LYS A 45 -3.859 3.136 14.464 1.00 64.15 C ATOM 769 C LYS A 45 -2.310 3.170 14.373 1.00 2.31 C ATOM 770 O LYS A 45 -1.733 4.193 13.994 1.00 44.52 O ATOM 771 CB LYS A 45 -4.324 3.895 15.742 1.00 33.12 C ATOM 772 CG LYS A 45 -5.858 3.974 15.929 1.00 34.15 C ATOM 773 CD LYS A 45 -6.262 4.824 17.165 1.00 41.52 C ATOM 774 CE LYS A 45 -7.786 4.860 17.399 1.00 5.51 C ATOM 775 NZ LYS A 45 -8.532 5.432 16.241 1.00 11.25 N ATOM 0 H LYS A 45 -4.829 1.473 15.334 1.00 53.11 H new ATOM 0 HA LYS A 45 -4.256 3.632 13.579 1.00 64.15 H new ATOM 0 HB2 LYS A 45 -3.891 3.407 16.615 1.00 33.12 H new ATOM 0 HB3 LYS A 45 -3.923 4.908 15.711 1.00 33.12 H new ATOM 0 HG2 LYS A 45 -6.309 4.403 15.034 1.00 34.15 H new ATOM 0 HG3 LYS A 45 -6.260 2.967 16.037 1.00 34.15 H new ATOM 0 HD2 LYS A 45 -5.773 4.421 18.052 1.00 41.52 H new ATOM 0 HD3 LYS A 45 -5.896 5.842 17.034 1.00 41.52 H new ATOM 0 HE2 LYS A 45 -8.144 3.849 17.593 1.00 5.51 H new ATOM 0 HE3 LYS A 45 -7.999 5.450 18.290 1.00 5.51 H new ATOM 0 HZ1 LYS A 45 -9.545 5.480 16.470 1.00 11.25 H new ATOM 0 HZ2 LYS A 45 -8.177 6.388 16.038 1.00 11.25 H new ATOM 0 HZ3 LYS A 45 -8.394 4.827 15.406 1.00 11.25 H new ATOM 789 N SER A 46 -1.650 2.043 14.714 1.00 73.21 N ATOM 790 CA SER A 46 -0.171 1.961 14.803 1.00 4.14 C ATOM 791 C SER A 46 0.412 0.872 13.889 1.00 61.23 C ATOM 792 O SER A 46 1.572 0.971 13.490 1.00 15.32 O ATOM 793 CB SER A 46 0.243 1.689 16.268 1.00 20.53 C ATOM 794 OG SER A 46 -0.359 2.630 17.134 1.00 23.52 O ATOM 0 H SER A 46 -2.122 1.166 14.935 1.00 73.21 H new ATOM 0 HA SER A 46 0.232 2.916 14.466 1.00 4.14 H new ATOM 0 HB2 SER A 46 -0.053 0.680 16.555 1.00 20.53 H new ATOM 0 HB3 SER A 46 1.328 1.741 16.362 1.00 20.53 H new ATOM 0 HG SER A 46 -0.089 2.444 18.058 1.00 23.52 H new ATOM 800 N MET A 47 -0.387 -0.167 13.561 1.00 10.42 N ATOM 801 CA MET A 47 0.118 -1.375 12.859 1.00 63.24 C ATOM 802 C MET A 47 -0.879 -1.860 11.789 1.00 25.02 C ATOM 803 O MET A 47 -2.057 -2.054 12.075 1.00 20.31 O ATOM 804 CB MET A 47 0.384 -2.530 13.880 1.00 53.03 C ATOM 805 CG MET A 47 1.509 -2.267 14.899 1.00 5.42 C ATOM 806 SD MET A 47 1.588 -3.512 16.216 1.00 14.13 S ATOM 807 CE MET A 47 1.896 -5.019 15.305 1.00 23.03 C ATOM 0 H MET A 47 -1.385 -0.196 13.770 1.00 10.42 H new ATOM 0 HA MET A 47 1.051 -1.101 12.367 1.00 63.24 H new ATOM 0 HB2 MET A 47 -0.538 -2.728 14.426 1.00 53.03 H new ATOM 0 HB3 MET A 47 0.626 -3.435 13.323 1.00 53.03 H new ATOM 0 HG2 MET A 47 2.465 -2.240 14.376 1.00 5.42 H new ATOM 0 HG3 MET A 47 1.363 -1.284 15.346 1.00 5.42 H new ATOM 0 HE1 MET A 47 2.641 -5.616 15.831 1.00 23.03 H new ATOM 0 HE2 MET A 47 0.970 -5.588 15.219 1.00 23.03 H new ATOM 0 HE3 MET A 47 2.265 -4.773 14.309 1.00 23.03 H new ATOM 817 N LEU A 48 -0.394 -2.058 10.565 1.00 73.43 N ATOM 818 CA LEU A 48 -1.107 -2.798 9.526 1.00 42.42 C ATOM 819 C LEU A 48 -0.591 -4.247 9.576 1.00 11.13 C ATOM 820 O LEU A 48 0.499 -4.552 9.076 1.00 74.32 O ATOM 821 CB LEU A 48 -0.852 -2.142 8.140 1.00 53.24 C ATOM 822 CG LEU A 48 -1.492 -2.852 6.900 1.00 2.51 C ATOM 823 CD1 LEU A 48 -3.031 -2.898 6.996 1.00 11.03 C ATOM 824 CD2 LEU A 48 -1.025 -2.189 5.585 1.00 43.33 C ATOM 0 H LEU A 48 0.514 -1.706 10.264 1.00 73.43 H new ATOM 0 HA LEU A 48 -2.185 -2.784 9.688 1.00 42.42 H new ATOM 0 HB2 LEU A 48 -1.222 -1.117 8.175 1.00 53.24 H new ATOM 0 HB3 LEU A 48 0.225 -2.086 7.982 1.00 53.24 H new ATOM 0 HG LEU A 48 -1.145 -3.885 6.896 1.00 2.51 H new ATOM 0 HD11 LEU A 48 -3.436 -3.399 6.116 1.00 11.03 H new ATOM 0 HD12 LEU A 48 -3.323 -3.446 7.892 1.00 11.03 H new ATOM 0 HD13 LEU A 48 -3.423 -1.882 7.048 1.00 11.03 H new ATOM 0 HD21 LEU A 48 -1.483 -2.699 4.738 1.00 43.33 H new ATOM 0 HD22 LEU A 48 -1.322 -1.140 5.581 1.00 43.33 H new ATOM 0 HD23 LEU A 48 0.060 -2.259 5.508 1.00 43.33 H new ATOM 836 N THR A 49 -1.365 -5.121 10.229 1.00 14.42 N ATOM 837 CA THR A 49 -0.992 -6.517 10.483 1.00 22.25 C ATOM 838 C THR A 49 -1.836 -7.440 9.601 1.00 0.11 C ATOM 839 O THR A 49 -3.070 -7.418 9.678 1.00 12.10 O ATOM 840 CB THR A 49 -1.202 -6.878 11.991 1.00 53.10 C ATOM 841 OG1 THR A 49 -0.448 -5.969 12.812 1.00 11.44 O ATOM 842 CG2 THR A 49 -0.788 -8.327 12.312 1.00 21.35 C ATOM 0 H THR A 49 -2.282 -4.875 10.601 1.00 14.42 H new ATOM 0 HA THR A 49 0.063 -6.649 10.243 1.00 22.25 H new ATOM 0 HB THR A 49 -2.267 -6.789 12.203 1.00 53.10 H new ATOM 0 HG1 THR A 49 -0.702 -6.088 13.751 1.00 11.44 H new ATOM 0 HG21 THR A 49 -0.953 -8.527 13.371 1.00 21.35 H new ATOM 0 HG22 THR A 49 -1.385 -9.017 11.715 1.00 21.35 H new ATOM 0 HG23 THR A 49 0.268 -8.464 12.078 1.00 21.35 H new ATOM 850 N TYR A 50 -1.174 -8.257 8.772 1.00 34.13 N ATOM 851 CA TYR A 50 -1.852 -9.147 7.820 1.00 75.41 C ATOM 852 C TYR A 50 -1.696 -10.616 8.235 1.00 52.43 C ATOM 853 O TYR A 50 -0.590 -11.079 8.548 1.00 23.24 O ATOM 854 CB TYR A 50 -1.337 -8.904 6.377 1.00 64.21 C ATOM 855 CG TYR A 50 0.197 -8.905 6.205 1.00 30.14 C ATOM 856 CD1 TYR A 50 0.905 -10.087 5.951 1.00 64.14 C ATOM 857 CD2 TYR A 50 0.935 -7.716 6.281 1.00 74.13 C ATOM 858 CE1 TYR A 50 2.274 -10.082 5.781 1.00 31.41 C ATOM 859 CE2 TYR A 50 2.306 -7.709 6.113 1.00 11.33 C ATOM 860 CZ TYR A 50 2.970 -8.893 5.860 1.00 35.05 C ATOM 861 OH TYR A 50 4.337 -8.888 5.686 1.00 75.44 O ATOM 0 H TYR A 50 -0.156 -8.320 8.742 1.00 34.13 H new ATOM 0 HA TYR A 50 -2.917 -8.915 7.834 1.00 75.41 H new ATOM 0 HB2 TYR A 50 -1.758 -9.671 5.727 1.00 64.21 H new ATOM 0 HB3 TYR A 50 -1.723 -7.945 6.030 1.00 64.21 H new ATOM 0 HD1 TYR A 50 0.368 -11.022 5.887 1.00 64.14 H new ATOM 0 HD2 TYR A 50 0.421 -6.786 6.475 1.00 74.13 H new ATOM 0 HE1 TYR A 50 2.799 -11.005 5.587 1.00 31.41 H new ATOM 0 HE2 TYR A 50 2.856 -6.782 6.179 1.00 11.33 H new ATOM 0 HH TYR A 50 4.674 -7.972 5.771 1.00 75.44 H new ATOM 871 N TYR A 51 -2.827 -11.328 8.233 1.00 41.24 N ATOM 872 CA TYR A 51 -2.892 -12.758 8.550 1.00 73.02 C ATOM 873 C TYR A 51 -3.104 -13.547 7.268 1.00 74.12 C ATOM 874 O TYR A 51 -3.724 -13.064 6.327 1.00 73.51 O ATOM 875 CB TYR A 51 -4.071 -13.046 9.512 1.00 12.30 C ATOM 876 CG TYR A 51 -4.040 -12.229 10.805 1.00 71.11 C ATOM 877 CD1 TYR A 51 -3.351 -12.688 11.928 1.00 53.11 C ATOM 878 CD2 TYR A 51 -4.698 -10.995 10.898 1.00 2.11 C ATOM 879 CE1 TYR A 51 -3.321 -11.954 13.094 1.00 22.44 C ATOM 880 CE2 TYR A 51 -4.665 -10.256 12.066 1.00 24.41 C ATOM 881 CZ TYR A 51 -3.978 -10.741 13.158 1.00 34.52 C ATOM 882 OH TYR A 51 -3.940 -10.006 14.319 1.00 53.31 O ATOM 0 H TYR A 51 -3.735 -10.922 8.008 1.00 41.24 H new ATOM 0 HA TYR A 51 -1.958 -13.053 9.028 1.00 73.02 H new ATOM 0 HB2 TYR A 51 -5.007 -12.845 8.991 1.00 12.30 H new ATOM 0 HB3 TYR A 51 -4.068 -14.106 9.765 1.00 12.30 H new ATOM 0 HD1 TYR A 51 -2.833 -13.634 11.883 1.00 53.11 H new ATOM 0 HD2 TYR A 51 -5.239 -10.615 10.044 1.00 2.11 H new ATOM 0 HE1 TYR A 51 -2.785 -12.326 13.955 1.00 22.44 H new ATOM 0 HE2 TYR A 51 -5.174 -9.305 12.122 1.00 24.41 H new ATOM 0 HH TYR A 51 -4.451 -9.178 14.199 1.00 53.31 H new ATOM 1081 N PHE A 63 3.807 -7.635 9.679 1.00 23.51 N ATOM 1082 CA PHE A 63 3.166 -6.364 10.017 1.00 44.32 C ATOM 1083 C PHE A 63 4.076 -5.207 9.587 1.00 25.42 C ATOM 1084 O PHE A 63 5.305 -5.351 9.519 1.00 23.04 O ATOM 1085 CB PHE A 63 2.824 -6.270 11.536 1.00 0.41 C ATOM 1086 CG PHE A 63 4.017 -6.427 12.482 1.00 75.43 C ATOM 1087 CD1 PHE A 63 4.404 -7.687 12.945 1.00 63.20 C ATOM 1088 CD2 PHE A 63 4.752 -5.317 12.912 1.00 33.24 C ATOM 1089 CE1 PHE A 63 5.479 -7.830 13.796 1.00 54.22 C ATOM 1090 CE2 PHE A 63 5.825 -5.467 13.762 1.00 60.41 C ATOM 1091 CZ PHE A 63 6.189 -6.720 14.206 1.00 51.11 C ATOM 0 HA PHE A 63 2.220 -6.301 9.479 1.00 44.32 H new ATOM 0 HB2 PHE A 63 2.353 -5.306 11.727 1.00 0.41 H new ATOM 0 HB3 PHE A 63 2.088 -7.037 11.775 1.00 0.41 H new ATOM 0 HD1 PHE A 63 3.853 -8.562 12.632 1.00 63.20 H new ATOM 0 HD2 PHE A 63 4.474 -4.330 12.573 1.00 33.24 H new ATOM 0 HE1 PHE A 63 5.766 -8.812 14.142 1.00 54.22 H new ATOM 0 HE2 PHE A 63 6.383 -4.600 14.082 1.00 60.41 H new ATOM 0 HZ PHE A 63 7.030 -6.833 14.875 1.00 51.11 H new ATOM 1101 N ILE A 64 3.454 -4.068 9.307 1.00 64.32 N ATOM 1102 CA ILE A 64 4.137 -2.811 8.988 1.00 62.05 C ATOM 1103 C ILE A 64 3.573 -1.757 9.933 1.00 23.41 C ATOM 1104 O ILE A 64 2.365 -1.710 10.144 1.00 70.35 O ATOM 1105 CB ILE A 64 3.913 -2.371 7.483 1.00 23.41 C ATOM 1106 CG1 ILE A 64 4.458 -3.460 6.499 1.00 1.21 C ATOM 1107 CG2 ILE A 64 4.550 -0.979 7.193 1.00 2.43 C ATOM 1108 CD1 ILE A 64 4.269 -3.128 5.032 1.00 14.11 C ATOM 0 H ILE A 64 2.437 -3.986 9.294 1.00 64.32 H new ATOM 0 HA ILE A 64 5.213 -2.934 9.112 1.00 62.05 H new ATOM 0 HB ILE A 64 2.839 -2.275 7.321 1.00 23.41 H new ATOM 0 HG12 ILE A 64 5.521 -3.608 6.692 1.00 1.21 H new ATOM 0 HG13 ILE A 64 3.961 -4.406 6.712 1.00 1.21 H new ATOM 0 HG21 ILE A 64 4.377 -0.710 6.151 1.00 2.43 H new ATOM 0 HG22 ILE A 64 4.097 -0.229 7.842 1.00 2.43 H new ATOM 0 HG23 ILE A 64 5.622 -1.023 7.383 1.00 2.43 H new ATOM 0 HD11 ILE A 64 4.674 -3.935 4.421 1.00 14.11 H new ATOM 0 HD12 ILE A 64 3.206 -3.011 4.819 1.00 14.11 H new ATOM 0 HD13 ILE A 64 4.790 -2.200 4.799 1.00 14.11 H new ATOM 1120 N ASP A 65 4.438 -0.931 10.518 1.00 33.12 N ATOM 1121 CA ASP A 65 3.992 0.172 11.372 1.00 40.42 C ATOM 1122 C ASP A 65 3.521 1.300 10.451 1.00 60.43 C ATOM 1123 O ASP A 65 4.196 1.622 9.457 1.00 23.05 O ATOM 1124 CB ASP A 65 5.116 0.679 12.298 1.00 12.32 C ATOM 1125 CG ASP A 65 5.754 -0.415 13.171 1.00 33.45 C ATOM 1126 OD1 ASP A 65 5.134 -0.817 14.181 1.00 4.22 O ATOM 1127 OD2 ASP A 65 6.886 -0.862 12.855 1.00 33.44 O ATOM 0 H ASP A 65 5.451 -1.003 10.418 1.00 33.12 H new ATOM 0 HA ASP A 65 3.187 -0.175 12.020 1.00 40.42 H new ATOM 0 HB2 ASP A 65 5.893 1.141 11.689 1.00 12.32 H new ATOM 0 HB3 ASP A 65 4.714 1.457 12.946 1.00 12.32 H new ATOM 1132 N VAL A 66 2.364 1.882 10.775 1.00 1.32 N ATOM 1133 CA VAL A 66 1.783 3.000 10.015 1.00 14.13 C ATOM 1134 C VAL A 66 2.714 4.239 10.097 1.00 35.04 C ATOM 1135 O VAL A 66 2.782 5.049 9.169 1.00 42.12 O ATOM 1136 CB VAL A 66 0.322 3.328 10.524 1.00 54.52 C ATOM 1137 CG1 VAL A 66 -0.355 4.399 9.642 1.00 14.13 C ATOM 1138 CG2 VAL A 66 -0.548 2.039 10.585 1.00 52.31 C ATOM 0 H VAL A 66 1.799 1.593 11.574 1.00 1.32 H new ATOM 0 HA VAL A 66 1.700 2.711 8.967 1.00 14.13 H new ATOM 0 HB VAL A 66 0.409 3.732 11.533 1.00 54.52 H new ATOM 0 HG11 VAL A 66 -1.357 4.601 10.020 1.00 14.13 H new ATOM 0 HG12 VAL A 66 0.234 5.316 9.667 1.00 14.13 H new ATOM 0 HG13 VAL A 66 -0.420 4.037 8.616 1.00 14.13 H new ATOM 0 HG21 VAL A 66 -1.548 2.291 10.938 1.00 52.31 H new ATOM 0 HG22 VAL A 66 -0.615 1.598 9.591 1.00 52.31 H new ATOM 0 HG23 VAL A 66 -0.091 1.324 11.269 1.00 52.31 H new ATOM 1148 N SER A 67 3.472 4.329 11.207 1.00 3.23 N ATOM 1149 CA SER A 67 4.475 5.385 11.438 1.00 35.33 C ATOM 1150 C SER A 67 5.723 5.219 10.527 1.00 54.40 C ATOM 1151 O SER A 67 6.434 6.192 10.272 1.00 34.01 O ATOM 1152 CB SER A 67 4.891 5.378 12.927 1.00 21.33 C ATOM 1153 OG SER A 67 3.758 5.472 13.778 1.00 13.45 O ATOM 0 H SER A 67 3.404 3.663 11.976 1.00 3.23 H new ATOM 0 HA SER A 67 4.021 6.343 11.183 1.00 35.33 H new ATOM 0 HB2 SER A 67 5.441 4.463 13.149 1.00 21.33 H new ATOM 0 HB3 SER A 67 5.566 6.211 13.123 1.00 21.33 H new ATOM 0 HG SER A 67 4.050 5.464 14.713 1.00 13.45 H new ATOM 1159 N LYS A 68 5.985 3.977 10.049 1.00 62.21 N ATOM 1160 CA LYS A 68 7.129 3.682 9.141 1.00 72.25 C ATOM 1161 C LYS A 68 6.810 4.051 7.677 1.00 74.51 C ATOM 1162 O LYS A 68 7.718 4.106 6.834 1.00 12.43 O ATOM 1163 CB LYS A 68 7.513 2.178 9.219 1.00 1.33 C ATOM 1164 CG LYS A 68 8.034 1.711 10.595 1.00 52.31 C ATOM 1165 CD LYS A 68 9.471 2.167 10.915 1.00 54.22 C ATOM 1166 CE LYS A 68 9.906 1.762 12.339 1.00 40.03 C ATOM 1167 NZ LYS A 68 9.737 0.299 12.597 1.00 64.41 N ATOM 0 H LYS A 68 5.419 3.159 10.276 1.00 62.21 H new ATOM 0 HA LYS A 68 7.967 4.294 9.474 1.00 72.25 H new ATOM 0 HB2 LYS A 68 6.640 1.581 8.956 1.00 1.33 H new ATOM 0 HB3 LYS A 68 8.277 1.974 8.469 1.00 1.33 H new ATOM 0 HG2 LYS A 68 7.365 2.085 11.370 1.00 52.31 H new ATOM 0 HG3 LYS A 68 7.993 0.623 10.636 1.00 52.31 H new ATOM 0 HD2 LYS A 68 10.159 1.733 10.189 1.00 54.22 H new ATOM 0 HD3 LYS A 68 9.539 3.250 10.810 1.00 54.22 H new ATOM 0 HE2 LYS A 68 10.951 2.035 12.487 1.00 40.03 H new ATOM 0 HE3 LYS A 68 9.323 2.325 13.067 1.00 40.03 H new ATOM 0 HZ1 LYS A 68 10.211 0.047 13.488 1.00 64.41 H new ATOM 0 HZ2 LYS A 68 8.724 0.074 12.667 1.00 64.41 H new ATOM 0 HZ3 LYS A 68 10.159 -0.242 11.815 1.00 64.41 H new ATOM 1181 N ILE A 69 5.519 4.278 7.381 1.00 22.04 N ATOM 1182 CA ILE A 69 5.047 4.585 6.024 1.00 52.24 C ATOM 1183 C ILE A 69 5.367 6.053 5.661 1.00 22.32 C ATOM 1184 O ILE A 69 5.048 6.972 6.419 1.00 1.33 O ATOM 1185 CB ILE A 69 3.505 4.339 5.882 1.00 62.01 C ATOM 1186 CG1 ILE A 69 3.125 2.875 6.273 1.00 44.21 C ATOM 1187 CG2 ILE A 69 3.027 4.665 4.451 1.00 32.40 C ATOM 1188 CD1 ILE A 69 1.627 2.569 6.231 1.00 62.11 C ATOM 0 H ILE A 69 4.774 4.253 8.078 1.00 22.04 H new ATOM 0 HA ILE A 69 5.568 3.916 5.339 1.00 52.24 H new ATOM 0 HB ILE A 69 2.997 5.011 6.574 1.00 62.01 H new ATOM 0 HG12 ILE A 69 3.641 2.189 5.601 1.00 44.21 H new ATOM 0 HG13 ILE A 69 3.495 2.675 7.279 1.00 44.21 H new ATOM 0 HG21 ILE A 69 1.954 4.487 4.376 1.00 32.40 H new ATOM 0 HG22 ILE A 69 3.238 5.711 4.226 1.00 32.40 H new ATOM 0 HG23 ILE A 69 3.551 4.028 3.738 1.00 32.40 H new ATOM 0 HD11 ILE A 69 1.460 1.531 6.517 1.00 62.11 H new ATOM 0 HD12 ILE A 69 1.102 3.226 6.925 1.00 62.11 H new ATOM 0 HD13 ILE A 69 1.250 2.732 5.221 1.00 62.11 H new ATOM 1200 N LYS A 70 5.996 6.243 4.490 1.00 34.42 N ATOM 1201 CA LYS A 70 6.392 7.571 3.975 1.00 61.13 C ATOM 1202 C LYS A 70 5.497 8.022 2.812 1.00 13.54 C ATOM 1203 O LYS A 70 5.530 9.195 2.428 1.00 32.02 O ATOM 1204 CB LYS A 70 7.859 7.535 3.496 1.00 61.20 C ATOM 1205 CG LYS A 70 8.868 7.099 4.572 1.00 2.22 C ATOM 1206 CD LYS A 70 10.327 7.163 4.070 1.00 72.45 C ATOM 1207 CE LYS A 70 10.596 6.236 2.870 1.00 74.12 C ATOM 1208 NZ LYS A 70 12.011 6.319 2.434 1.00 55.11 N ATOM 0 H LYS A 70 6.248 5.476 3.867 1.00 34.42 H new ATOM 0 HA LYS A 70 6.279 8.284 4.792 1.00 61.13 H new ATOM 0 HB2 LYS A 70 7.935 6.855 2.647 1.00 61.20 H new ATOM 0 HB3 LYS A 70 8.135 8.526 3.136 1.00 61.20 H new ATOM 0 HG2 LYS A 70 8.760 7.738 5.448 1.00 2.22 H new ATOM 0 HG3 LYS A 70 8.640 6.081 4.889 1.00 2.22 H new ATOM 0 HD2 LYS A 70 10.563 8.189 3.788 1.00 72.45 H new ATOM 0 HD3 LYS A 70 10.998 6.894 4.886 1.00 72.45 H new ATOM 0 HE2 LYS A 70 10.356 5.208 3.141 1.00 74.12 H new ATOM 0 HE3 LYS A 70 9.941 6.509 2.042 1.00 74.12 H new ATOM 0 HZ1 LYS A 70 12.112 5.880 1.497 1.00 55.11 H new ATOM 0 HZ2 LYS A 70 12.300 7.317 2.382 1.00 55.11 H new ATOM 0 HZ3 LYS A 70 12.615 5.819 3.117 1.00 55.11 H new ATOM 1222 N CYS A 71 4.732 7.084 2.236 1.00 54.21 N ATOM 1223 CA CYS A 71 3.882 7.355 1.066 1.00 52.04 C ATOM 1224 C CYS A 71 2.970 6.161 0.792 1.00 42.54 C ATOM 1225 O CYS A 71 3.419 5.018 0.829 1.00 41.15 O ATOM 1226 CB CYS A 71 4.739 7.646 -0.199 1.00 42.21 C ATOM 1227 SG CYS A 71 3.788 7.831 -1.724 1.00 51.55 S ATOM 0 H CYS A 71 4.684 6.120 2.566 1.00 54.21 H new ATOM 0 HA CYS A 71 3.281 8.236 1.289 1.00 52.04 H new ATOM 0 HB2 CYS A 71 5.313 8.557 -0.031 1.00 42.21 H new ATOM 0 HB3 CYS A 71 5.457 6.836 -0.330 1.00 42.21 H new ATOM 0 HG CYS A 71 3.158 8.968 -1.707 1.00 51.55 H new ATOM 1233 N VAL A 72 1.680 6.439 0.544 1.00 63.44 N ATOM 1234 CA VAL A 72 0.720 5.465 -0.011 1.00 20.44 C ATOM 1235 C VAL A 72 -0.045 6.156 -1.132 1.00 31.22 C ATOM 1236 O VAL A 72 -0.511 7.277 -0.961 1.00 13.12 O ATOM 1237 CB VAL A 72 -0.297 4.902 1.055 1.00 5.34 C ATOM 1238 CG1 VAL A 72 -1.396 4.019 0.397 1.00 43.32 C ATOM 1239 CG2 VAL A 72 0.451 4.107 2.135 1.00 73.52 C ATOM 0 H VAL A 72 1.268 7.355 0.724 1.00 63.44 H new ATOM 0 HA VAL A 72 1.285 4.605 -0.370 1.00 20.44 H new ATOM 0 HB VAL A 72 -0.795 5.754 1.518 1.00 5.34 H new ATOM 0 HG11 VAL A 72 -2.076 3.651 1.166 1.00 43.32 H new ATOM 0 HG12 VAL A 72 -1.954 4.612 -0.327 1.00 43.32 H new ATOM 0 HG13 VAL A 72 -0.929 3.174 -0.109 1.00 43.32 H new ATOM 0 HG21 VAL A 72 -0.263 3.724 2.865 1.00 73.52 H new ATOM 0 HG22 VAL A 72 0.980 3.274 1.673 1.00 73.52 H new ATOM 0 HG23 VAL A 72 1.167 4.758 2.636 1.00 73.52 H new ATOM 1249 N GLU A 73 -0.139 5.492 -2.282 1.00 24.42 N ATOM 1250 CA GLU A 73 -0.857 6.014 -3.448 1.00 5.34 C ATOM 1251 C GLU A 73 -1.184 4.857 -4.391 1.00 71.14 C ATOM 1252 O GLU A 73 -0.522 3.817 -4.335 1.00 65.04 O ATOM 1253 CB GLU A 73 -0.001 7.108 -4.163 1.00 54.24 C ATOM 1254 CG GLU A 73 -0.734 7.909 -5.262 1.00 4.13 C ATOM 1255 CD GLU A 73 -2.020 8.581 -4.752 1.00 11.42 C ATOM 1256 OE1 GLU A 73 -1.924 9.636 -4.096 1.00 13.45 O ATOM 1257 OE2 GLU A 73 -3.124 8.040 -4.998 1.00 64.33 O ATOM 0 H GLU A 73 0.281 4.575 -2.434 1.00 24.42 H new ATOM 0 HA GLU A 73 -1.790 6.482 -3.132 1.00 5.34 H new ATOM 0 HB2 GLU A 73 0.366 7.807 -3.411 1.00 54.24 H new ATOM 0 HB3 GLU A 73 0.872 6.630 -4.607 1.00 54.24 H new ATOM 0 HG2 GLU A 73 -0.063 8.672 -5.658 1.00 4.13 H new ATOM 0 HG3 GLU A 73 -0.981 7.242 -6.088 1.00 4.13 H new ATOM 1264 N ILE A 74 -2.207 5.031 -5.248 1.00 71.21 N ATOM 1265 CA ILE A 74 -2.536 4.043 -6.290 1.00 50.20 C ATOM 1266 C ILE A 74 -1.410 3.987 -7.338 1.00 50.11 C ATOM 1267 O ILE A 74 -0.621 4.939 -7.488 1.00 25.21 O ATOM 1268 CB ILE A 74 -3.907 4.346 -7.000 1.00 3.10 C ATOM 1269 CG1 ILE A 74 -3.895 5.739 -7.708 1.00 21.02 C ATOM 1270 CG2 ILE A 74 -5.066 4.245 -5.993 1.00 64.10 C ATOM 1271 CD1 ILE A 74 -5.160 6.064 -8.489 1.00 50.32 C ATOM 0 H ILE A 74 -2.819 5.847 -5.239 1.00 71.21 H new ATOM 0 HA ILE A 74 -2.633 3.077 -5.794 1.00 50.20 H new ATOM 0 HB ILE A 74 -4.056 3.594 -7.775 1.00 3.10 H new ATOM 0 HG12 ILE A 74 -3.739 6.513 -6.956 1.00 21.02 H new ATOM 0 HG13 ILE A 74 -3.044 5.779 -8.388 1.00 21.02 H new ATOM 0 HG21 ILE A 74 -6.008 4.457 -6.499 1.00 64.10 H new ATOM 0 HG22 ILE A 74 -5.098 3.239 -5.575 1.00 64.10 H new ATOM 0 HG23 ILE A 74 -4.915 4.967 -5.191 1.00 64.10 H new ATOM 0 HD11 ILE A 74 -5.062 7.049 -8.946 1.00 50.32 H new ATOM 0 HD12 ILE A 74 -5.309 5.316 -9.267 1.00 50.32 H new ATOM 0 HD13 ILE A 74 -6.016 6.061 -7.814 1.00 50.32 H new ATOM 1283 N VAL A 75 -1.361 2.875 -8.071 1.00 72.42 N ATOM 1284 CA VAL A 75 -0.300 2.598 -9.037 1.00 55.40 C ATOM 1285 C VAL A 75 -0.888 2.701 -10.445 1.00 4.42 C ATOM 1286 O VAL A 75 -1.952 2.119 -10.715 1.00 24.33 O ATOM 1287 CB VAL A 75 0.319 1.165 -8.840 1.00 3.12 C ATOM 1288 CG1 VAL A 75 1.597 0.992 -9.694 1.00 52.14 C ATOM 1289 CG2 VAL A 75 0.591 0.876 -7.350 1.00 31.05 C ATOM 0 H VAL A 75 -2.062 2.136 -8.010 1.00 72.42 H new ATOM 0 HA VAL A 75 0.498 3.325 -8.887 1.00 55.40 H new ATOM 0 HB VAL A 75 -0.410 0.433 -9.186 1.00 3.12 H new ATOM 0 HG11 VAL A 75 2.005 -0.007 -9.540 1.00 52.14 H new ATOM 0 HG12 VAL A 75 1.351 1.125 -10.748 1.00 52.14 H new ATOM 0 HG13 VAL A 75 2.336 1.736 -9.397 1.00 52.14 H new ATOM 0 HG21 VAL A 75 1.018 -0.121 -7.245 1.00 31.05 H new ATOM 0 HG22 VAL A 75 1.291 1.614 -6.958 1.00 31.05 H new ATOM 0 HG23 VAL A 75 -0.344 0.931 -6.792 1.00 31.05 H new ATOM 1299 N LYS A 76 -0.210 3.453 -11.320 1.00 24.22 N ATOM 1300 CA LYS A 76 -0.561 3.548 -12.738 1.00 1.14 C ATOM 1301 C LYS A 76 -0.360 2.170 -13.412 1.00 3.25 C ATOM 1302 O LYS A 76 0.767 1.779 -13.736 1.00 64.33 O ATOM 1303 CB LYS A 76 0.312 4.635 -13.420 1.00 0.02 C ATOM 1304 CG LYS A 76 0.166 6.049 -12.808 1.00 41.02 C ATOM 1305 CD LYS A 76 1.135 7.080 -13.432 1.00 72.04 C ATOM 1306 CE LYS A 76 0.884 7.340 -14.925 1.00 73.21 C ATOM 1307 NZ LYS A 76 -0.409 8.037 -15.172 1.00 63.10 N ATOM 0 H LYS A 76 0.601 4.015 -11.061 1.00 24.22 H new ATOM 0 HA LYS A 76 -1.607 3.834 -12.843 1.00 1.14 H new ATOM 0 HB2 LYS A 76 1.358 4.333 -13.362 1.00 0.02 H new ATOM 0 HB3 LYS A 76 0.052 4.681 -14.478 1.00 0.02 H new ATOM 0 HG2 LYS A 76 -0.859 6.394 -12.944 1.00 41.02 H new ATOM 0 HG3 LYS A 76 0.344 5.994 -11.734 1.00 41.02 H new ATOM 0 HD2 LYS A 76 1.049 8.021 -12.889 1.00 72.04 H new ATOM 0 HD3 LYS A 76 2.159 6.729 -13.301 1.00 72.04 H new ATOM 0 HE2 LYS A 76 1.700 7.940 -15.328 1.00 73.21 H new ATOM 0 HE3 LYS A 76 0.890 6.391 -15.462 1.00 73.21 H new ATOM 0 HZ1 LYS A 76 -0.532 8.189 -16.193 1.00 63.10 H new ATOM 0 HZ2 LYS A 76 -1.192 7.454 -14.812 1.00 63.10 H new ATOM 0 HZ3 LYS A 76 -0.408 8.955 -14.683 1.00 63.10 H new ATOM 1382 N ILE A 82 -1.721 -7.206 -14.710 1.00 54.03 N ATOM 1383 CA ILE A 82 -1.929 -7.856 -13.406 1.00 2.34 C ATOM 1384 C ILE A 82 -2.088 -9.387 -13.584 1.00 64.11 C ATOM 1385 O ILE A 82 -3.055 -9.825 -14.207 1.00 71.41 O ATOM 1386 CB ILE A 82 -3.186 -7.288 -12.645 1.00 65.23 C ATOM 1387 CG1 ILE A 82 -3.191 -5.721 -12.617 1.00 35.45 C ATOM 1388 CG2 ILE A 82 -3.266 -7.871 -11.208 1.00 1.32 C ATOM 1389 CD1 ILE A 82 -2.000 -5.070 -11.937 1.00 4.23 C ATOM 0 HA ILE A 82 -1.046 -7.640 -12.804 1.00 2.34 H new ATOM 0 HB ILE A 82 -4.073 -7.603 -13.194 1.00 65.23 H new ATOM 0 HG12 ILE A 82 -3.243 -5.358 -13.643 1.00 35.45 H new ATOM 0 HG13 ILE A 82 -4.099 -5.388 -12.115 1.00 35.45 H new ATOM 0 HG21 ILE A 82 -4.141 -7.466 -10.699 1.00 1.32 H new ATOM 0 HG22 ILE A 82 -3.346 -8.957 -11.260 1.00 1.32 H new ATOM 0 HG23 ILE A 82 -2.367 -7.600 -10.655 1.00 1.32 H new ATOM 0 HD11 ILE A 82 -2.107 -3.986 -11.976 1.00 4.23 H new ATOM 0 HD12 ILE A 82 -1.953 -5.393 -10.897 1.00 4.23 H new ATOM 0 HD13 ILE A 82 -1.084 -5.363 -12.449 1.00 4.23 H new ATOM 1401 N PRO A 83 -1.140 -10.223 -13.041 1.00 65.33 N ATOM 1402 CA PRO A 83 -1.175 -11.693 -13.184 1.00 51.52 C ATOM 1403 C PRO A 83 -1.924 -12.369 -12.014 1.00 12.03 C ATOM 1404 O PRO A 83 -1.608 -13.502 -11.629 1.00 52.11 O ATOM 1405 CB PRO A 83 0.338 -12.051 -13.206 1.00 74.13 C ATOM 1406 CG PRO A 83 1.063 -10.887 -12.547 1.00 13.35 C ATOM 1407 CD PRO A 83 0.035 -9.814 -12.235 1.00 0.21 C ATOM 0 HA PRO A 83 -1.713 -12.037 -14.067 1.00 51.52 H new ATOM 0 HB2 PRO A 83 0.525 -12.980 -12.668 1.00 74.13 H new ATOM 0 HB3 PRO A 83 0.688 -12.198 -14.228 1.00 74.13 H new ATOM 0 HG2 PRO A 83 1.561 -11.215 -11.635 1.00 13.35 H new ATOM 0 HG3 PRO A 83 1.835 -10.495 -13.209 1.00 13.35 H new ATOM 0 HD2 PRO A 83 -0.200 -9.779 -11.171 1.00 0.21 H new ATOM 0 HD3 PRO A 83 0.390 -8.823 -12.516 1.00 0.21 H new ATOM 1415 N CYS A 84 -2.942 -11.671 -11.485 1.00 14.44 N ATOM 1416 CA CYS A 84 -3.735 -12.134 -10.340 1.00 42.23 C ATOM 1417 C CYS A 84 -5.165 -11.568 -10.441 1.00 4.11 C ATOM 1418 O CYS A 84 -5.431 -10.675 -11.260 1.00 43.51 O ATOM 1419 CB CYS A 84 -3.044 -11.713 -9.020 1.00 41.25 C ATOM 1420 SG CYS A 84 -3.682 -12.559 -7.565 1.00 61.43 S ATOM 0 H CYS A 84 -3.238 -10.763 -11.844 1.00 14.44 H new ATOM 0 HA CYS A 84 -3.802 -13.222 -10.348 1.00 42.23 H new ATOM 0 HB2 CYS A 84 -1.975 -11.908 -9.102 1.00 41.25 H new ATOM 0 HB3 CYS A 84 -3.163 -10.638 -8.885 1.00 41.25 H new ATOM 0 HG CYS A 84 -2.692 -13.048 -6.878 1.00 61.43 H new ATOM 1426 N GLN A 85 -6.078 -12.092 -9.599 1.00 51.04 N ATOM 1427 CA GLN A 85 -7.527 -11.767 -9.649 1.00 74.10 C ATOM 1428 C GLN A 85 -7.839 -10.321 -9.188 1.00 51.04 C ATOM 1429 O GLN A 85 -8.738 -9.673 -9.743 1.00 42.12 O ATOM 1430 CB GLN A 85 -8.334 -12.798 -8.803 1.00 21.13 C ATOM 1431 CG GLN A 85 -7.888 -12.892 -7.330 1.00 44.52 C ATOM 1432 CD GLN A 85 -8.692 -13.872 -6.484 1.00 71.31 C ATOM 1433 OE1 GLN A 85 -8.068 -14.431 -5.461 1.00 1.44 O flip ATOM 1434 NE2 GLN A 85 -9.870 -14.113 -6.731 1.00 15.31 N flip ATOM 0 H GLN A 85 -5.836 -12.754 -8.862 1.00 51.04 H new ATOM 0 HA GLN A 85 -7.833 -11.830 -10.693 1.00 74.10 H new ATOM 0 HB2 GLN A 85 -9.390 -12.530 -8.835 1.00 21.13 H new ATOM 0 HB3 GLN A 85 -8.240 -13.782 -9.263 1.00 21.13 H new ATOM 0 HG2 GLN A 85 -6.838 -13.183 -7.300 1.00 44.52 H new ATOM 0 HG3 GLN A 85 -7.957 -11.902 -6.879 1.00 44.52 H new ATOM 0 HE21 GLN A 85 -10.326 -13.667 -7.527 1.00 15.31 H new ATOM 0 HE22 GLN A 85 -10.393 -14.759 -6.140 1.00 15.31 H new ATOM 1443 N ASN A 86 -7.100 -9.833 -8.168 1.00 53.12 N ATOM 1444 CA ASN A 86 -7.303 -8.484 -7.593 1.00 75.15 C ATOM 1445 C ASN A 86 -6.659 -7.408 -8.483 1.00 12.02 C ATOM 1446 O ASN A 86 -5.530 -7.571 -8.948 1.00 22.30 O ATOM 1447 CB ASN A 86 -6.733 -8.398 -6.151 1.00 53.11 C ATOM 1448 CG ASN A 86 -7.567 -9.135 -5.101 1.00 31.02 C ATOM 1449 OD1 ASN A 86 -8.208 -10.146 -5.385 1.00 2.42 O ATOM 1450 ND2 ASN A 86 -7.574 -8.626 -3.876 1.00 51.45 N ATOM 0 H ASN A 86 -6.349 -10.360 -7.721 1.00 53.12 H new ATOM 0 HA ASN A 86 -8.377 -8.302 -7.548 1.00 75.15 H new ATOM 0 HB2 ASN A 86 -5.722 -8.806 -6.147 1.00 53.11 H new ATOM 0 HB3 ASN A 86 -6.655 -7.349 -5.865 1.00 53.11 H new ATOM 0 HD21 ASN A 86 -8.121 -9.074 -3.141 1.00 51.45 H new ATOM 0 HD22 ASN A 86 -7.033 -7.786 -3.669 1.00 51.45 H new ATOM 1457 N LYS A 87 -7.390 -6.298 -8.680 1.00 14.24 N ATOM 1458 CA LYS A 87 -7.018 -5.208 -9.606 1.00 30.31 C ATOM 1459 C LYS A 87 -7.017 -3.863 -8.871 1.00 41.32 C ATOM 1460 O LYS A 87 -7.423 -3.776 -7.711 1.00 14.32 O ATOM 1461 CB LYS A 87 -8.019 -5.162 -10.800 1.00 31.40 C ATOM 1462 CG LYS A 87 -8.067 -6.455 -11.643 1.00 22.42 C ATOM 1463 CD LYS A 87 -9.199 -6.428 -12.693 1.00 75.31 C ATOM 1464 CE LYS A 87 -9.300 -7.737 -13.479 1.00 3.25 C ATOM 1465 NZ LYS A 87 -10.443 -7.729 -14.429 1.00 14.02 N ATOM 0 H LYS A 87 -8.270 -6.127 -8.194 1.00 14.24 H new ATOM 0 HA LYS A 87 -6.015 -5.398 -9.988 1.00 30.31 H new ATOM 0 HB2 LYS A 87 -9.017 -4.958 -10.413 1.00 31.40 H new ATOM 0 HB3 LYS A 87 -7.752 -4.329 -11.450 1.00 31.40 H new ATOM 0 HG2 LYS A 87 -7.110 -6.593 -12.147 1.00 22.42 H new ATOM 0 HG3 LYS A 87 -8.207 -7.311 -10.983 1.00 22.42 H new ATOM 0 HD2 LYS A 87 -10.148 -6.233 -12.194 1.00 75.31 H new ATOM 0 HD3 LYS A 87 -9.028 -5.604 -13.386 1.00 75.31 H new ATOM 0 HE2 LYS A 87 -8.373 -7.903 -14.028 1.00 3.25 H new ATOM 0 HE3 LYS A 87 -9.412 -8.569 -12.784 1.00 3.25 H new ATOM 0 HZ1 LYS A 87 -10.475 -8.634 -14.941 1.00 14.02 H new ATOM 0 HZ2 LYS A 87 -11.331 -7.597 -13.903 1.00 14.02 H new ATOM 0 HZ3 LYS A 87 -10.324 -6.951 -15.109 1.00 14.02 H new ATOM 1479 N TYR A 88 -6.578 -2.819 -9.591 1.00 53.12 N ATOM 1480 CA TYR A 88 -6.404 -1.457 -9.062 1.00 54.35 C ATOM 1481 C TYR A 88 -5.492 -1.464 -7.812 1.00 2.31 C ATOM 1482 O TYR A 88 -5.971 -1.301 -6.680 1.00 31.12 O ATOM 1483 CB TYR A 88 -7.773 -0.776 -8.802 1.00 45.40 C ATOM 1484 CG TYR A 88 -8.567 -0.483 -10.084 1.00 63.30 C ATOM 1485 CD1 TYR A 88 -8.259 0.626 -10.879 1.00 41.21 C ATOM 1486 CD2 TYR A 88 -9.611 -1.311 -10.507 1.00 3.33 C ATOM 1487 CE1 TYR A 88 -8.964 0.896 -12.041 1.00 73.41 C ATOM 1488 CE2 TYR A 88 -10.317 -1.041 -11.666 1.00 45.54 C ATOM 1489 CZ TYR A 88 -9.994 0.062 -12.427 1.00 24.34 C ATOM 1490 OH TYR A 88 -10.701 0.329 -13.586 1.00 31.24 O ATOM 0 H TYR A 88 -6.329 -2.899 -10.577 1.00 53.12 H new ATOM 0 HA TYR A 88 -5.899 -0.855 -9.817 1.00 54.35 H new ATOM 0 HB2 TYR A 88 -8.370 -1.416 -8.153 1.00 45.40 H new ATOM 0 HB3 TYR A 88 -7.609 0.158 -8.265 1.00 45.40 H new ATOM 0 HD1 TYR A 88 -7.456 1.284 -10.581 1.00 41.21 H new ATOM 0 HD2 TYR A 88 -9.871 -2.178 -9.918 1.00 3.33 H new ATOM 0 HE1 TYR A 88 -8.709 1.756 -12.642 1.00 73.41 H new ATOM 0 HE2 TYR A 88 -11.120 -1.694 -11.974 1.00 45.54 H new ATOM 0 HH TYR A 88 -11.391 -0.355 -13.713 1.00 31.24 H new ATOM 1500 N PRO A 89 -4.161 -1.723 -8.010 1.00 73.15 N ATOM 1501 CA PRO A 89 -3.206 -1.835 -6.895 1.00 54.44 C ATOM 1502 C PRO A 89 -2.831 -0.467 -6.304 1.00 71.45 C ATOM 1503 O PRO A 89 -2.855 0.555 -6.999 1.00 22.54 O ATOM 1504 CB PRO A 89 -1.983 -2.514 -7.553 1.00 42.20 C ATOM 1505 CG PRO A 89 -2.025 -2.068 -8.986 1.00 15.12 C ATOM 1506 CD PRO A 89 -3.493 -1.928 -9.336 1.00 22.55 C ATOM 0 HA PRO A 89 -3.614 -2.392 -6.052 1.00 54.44 H new ATOM 0 HB2 PRO A 89 -1.054 -2.210 -7.071 1.00 42.20 H new ATOM 0 HB3 PRO A 89 -2.043 -3.600 -7.474 1.00 42.20 H new ATOM 0 HG2 PRO A 89 -1.501 -1.121 -9.116 1.00 15.12 H new ATOM 0 HG3 PRO A 89 -1.536 -2.794 -9.635 1.00 15.12 H new ATOM 0 HD2 PRO A 89 -3.666 -1.085 -10.005 1.00 22.55 H new ATOM 0 HD3 PRO A 89 -3.870 -2.818 -9.840 1.00 22.55 H new ATOM 1514 N PHE A 90 -2.517 -0.471 -5.012 1.00 32.43 N ATOM 1515 CA PHE A 90 -1.948 0.663 -4.303 1.00 25.01 C ATOM 1516 C PHE A 90 -0.637 0.225 -3.647 1.00 60.01 C ATOM 1517 O PHE A 90 -0.526 -0.896 -3.134 1.00 55.44 O ATOM 1518 CB PHE A 90 -2.950 1.211 -3.266 1.00 12.01 C ATOM 1519 CG PHE A 90 -3.489 0.196 -2.247 1.00 71.31 C ATOM 1520 CD1 PHE A 90 -4.541 -0.668 -2.581 1.00 5.13 C ATOM 1521 CD2 PHE A 90 -2.959 0.116 -0.953 1.00 23.42 C ATOM 1522 CE1 PHE A 90 -5.036 -1.571 -1.660 1.00 13.22 C ATOM 1523 CE2 PHE A 90 -3.456 -0.788 -0.040 1.00 21.34 C ATOM 1524 CZ PHE A 90 -4.495 -1.629 -0.392 1.00 31.12 C ATOM 0 H PHE A 90 -2.656 -1.287 -4.416 1.00 32.43 H new ATOM 0 HA PHE A 90 -1.738 1.473 -5.001 1.00 25.01 H new ATOM 0 HB2 PHE A 90 -2.470 2.023 -2.720 1.00 12.01 H new ATOM 0 HB3 PHE A 90 -3.796 1.643 -3.801 1.00 12.01 H new ATOM 0 HD1 PHE A 90 -4.970 -0.627 -3.571 1.00 5.13 H new ATOM 0 HD2 PHE A 90 -2.150 0.772 -0.667 1.00 23.42 H new ATOM 0 HE1 PHE A 90 -5.846 -2.231 -1.932 1.00 13.22 H new ATOM 0 HE2 PHE A 90 -3.033 -0.840 0.952 1.00 21.34 H new ATOM 0 HZ PHE A 90 -4.885 -2.334 0.328 1.00 31.12 H new ATOM 1534 N GLN A 91 0.349 1.115 -3.684 1.00 34.14 N ATOM 1535 CA GLN A 91 1.692 0.854 -3.179 1.00 21.22 C ATOM 1536 C GLN A 91 1.913 1.561 -1.836 1.00 44.11 C ATOM 1537 O GLN A 91 1.486 2.707 -1.637 1.00 62.01 O ATOM 1538 CB GLN A 91 2.751 1.279 -4.225 1.00 65.43 C ATOM 1539 CG GLN A 91 2.691 2.750 -4.673 1.00 1.35 C ATOM 1540 CD GLN A 91 3.700 3.056 -5.777 1.00 64.32 C ATOM 1541 OE1 GLN A 91 3.409 2.904 -6.960 1.00 51.13 O ATOM 1542 NE2 GLN A 91 4.900 3.481 -5.401 1.00 34.51 N ATOM 0 H GLN A 91 0.236 2.052 -4.071 1.00 34.14 H new ATOM 0 HA GLN A 91 1.801 -0.217 -3.008 1.00 21.22 H new ATOM 0 HB2 GLN A 91 3.741 1.084 -3.813 1.00 65.43 H new ATOM 0 HB3 GLN A 91 2.641 0.645 -5.105 1.00 65.43 H new ATOM 0 HG2 GLN A 91 1.686 2.980 -5.027 1.00 1.35 H new ATOM 0 HG3 GLN A 91 2.883 3.397 -3.817 1.00 1.35 H new ATOM 0 HE21 GLN A 91 5.112 3.598 -4.410 1.00 34.51 H new ATOM 0 HE22 GLN A 91 5.610 3.691 -6.103 1.00 34.51 H new ATOM 1551 N VAL A 92 2.585 0.849 -0.923 1.00 33.43 N ATOM 1552 CA VAL A 92 2.924 1.323 0.419 1.00 64.55 C ATOM 1553 C VAL A 92 4.451 1.409 0.499 1.00 4.13 C ATOM 1554 O VAL A 92 5.137 0.380 0.596 1.00 25.42 O ATOM 1555 CB VAL A 92 2.366 0.358 1.535 1.00 44.23 C ATOM 1556 CG1 VAL A 92 2.741 0.859 2.952 1.00 61.24 C ATOM 1557 CG2 VAL A 92 0.835 0.176 1.388 1.00 63.21 C ATOM 0 H VAL A 92 2.916 -0.099 -1.105 1.00 33.43 H new ATOM 0 HA VAL A 92 2.468 2.298 0.593 1.00 64.55 H new ATOM 0 HB VAL A 92 2.834 -0.617 1.401 1.00 44.23 H new ATOM 0 HG11 VAL A 92 2.342 0.172 3.698 1.00 61.24 H new ATOM 0 HG12 VAL A 92 3.826 0.906 3.046 1.00 61.24 H new ATOM 0 HG13 VAL A 92 2.320 1.852 3.110 1.00 61.24 H new ATOM 0 HG21 VAL A 92 0.472 -0.493 2.168 1.00 63.21 H new ATOM 0 HG22 VAL A 92 0.343 1.144 1.482 1.00 63.21 H new ATOM 0 HG23 VAL A 92 0.612 -0.251 0.410 1.00 63.21 H new ATOM 1567 N VAL A 93 4.978 2.633 0.389 1.00 61.13 N ATOM 1568 CA VAL A 93 6.417 2.893 0.433 1.00 35.04 C ATOM 1569 C VAL A 93 6.853 3.091 1.896 1.00 32.10 C ATOM 1570 O VAL A 93 6.304 3.936 2.615 1.00 52.24 O ATOM 1571 CB VAL A 93 6.818 4.157 -0.415 1.00 32.50 C ATOM 1572 CG1 VAL A 93 8.356 4.318 -0.466 1.00 20.32 C ATOM 1573 CG2 VAL A 93 6.210 4.109 -1.840 1.00 5.34 C ATOM 0 H VAL A 93 4.414 3.474 0.266 1.00 61.13 H new ATOM 0 HA VAL A 93 6.925 2.033 -0.002 1.00 35.04 H new ATOM 0 HB VAL A 93 6.401 5.033 0.082 1.00 32.50 H new ATOM 0 HG11 VAL A 93 8.610 5.198 -1.057 1.00 20.32 H new ATOM 0 HG12 VAL A 93 8.743 4.437 0.546 1.00 20.32 H new ATOM 0 HG13 VAL A 93 8.799 3.433 -0.923 1.00 20.32 H new ATOM 0 HG21 VAL A 93 6.510 4.999 -2.394 1.00 5.34 H new ATOM 0 HG22 VAL A 93 6.569 3.220 -2.359 1.00 5.34 H new ATOM 0 HG23 VAL A 93 5.123 4.074 -1.771 1.00 5.34 H new ATOM 1583 N HIS A 94 7.837 2.296 2.313 1.00 53.41 N ATOM 1584 CA HIS A 94 8.422 2.336 3.665 1.00 43.11 C ATOM 1585 C HIS A 94 9.898 1.961 3.568 1.00 11.34 C ATOM 1586 O HIS A 94 10.325 1.409 2.548 1.00 54.13 O ATOM 1587 CB HIS A 94 7.674 1.378 4.636 1.00 21.32 C ATOM 1588 CG HIS A 94 7.539 -0.058 4.164 1.00 42.12 C ATOM 1589 ND1 HIS A 94 6.808 -0.605 3.160 1.00 24.20 N flip ATOM 1590 CD2 HIS A 94 8.197 -1.113 4.757 1.00 23.52 C flip ATOM 1591 CE1 HIS A 94 7.036 -1.957 3.169 1.00 54.05 C flip ATOM 1592 NE2 HIS A 94 7.878 -2.234 4.141 1.00 60.24 N flip ATOM 0 H HIS A 94 8.263 1.589 1.713 1.00 53.41 H new ATOM 0 HA HIS A 94 8.321 3.343 4.069 1.00 43.11 H new ATOM 0 HB2 HIS A 94 8.195 1.380 5.593 1.00 21.32 H new ATOM 0 HB3 HIS A 94 6.676 1.778 4.816 1.00 21.32 H new ATOM 0 HD1 HIS A 94 6.199 -0.101 2.515 1.00 24.20 H new ATOM 0 HD2 HIS A 94 8.871 -1.034 5.597 1.00 23.52 H new ATOM 0 HE1 HIS A 94 6.598 -2.675 2.491 1.00 54.05 H new ATOM 1601 N ASP A 95 10.672 2.258 4.632 1.00 2.40 N ATOM 1602 CA ASP A 95 12.112 1.935 4.682 1.00 73.52 C ATOM 1603 C ASP A 95 12.316 0.428 4.959 1.00 34.10 C ATOM 1604 O ASP A 95 12.531 0.002 6.103 1.00 35.35 O ATOM 1605 CB ASP A 95 12.848 2.804 5.727 1.00 55.43 C ATOM 1606 CG ASP A 95 12.777 4.309 5.418 1.00 74.24 C ATOM 1607 OD1 ASP A 95 13.526 4.776 4.529 1.00 64.44 O ATOM 1608 OD2 ASP A 95 11.973 5.023 6.053 1.00 23.53 O ATOM 0 H ASP A 95 10.322 2.722 5.470 1.00 2.40 H new ATOM 0 HA ASP A 95 12.547 2.165 3.709 1.00 73.52 H new ATOM 0 HB2 ASP A 95 12.417 2.621 6.711 1.00 55.43 H new ATOM 0 HB3 ASP A 95 13.893 2.498 5.774 1.00 55.43 H new ATOM 1613 N ALA A 96 12.107 -0.353 3.893 1.00 33.43 N ATOM 1614 CA ALA A 96 12.428 -1.783 3.803 1.00 64.10 C ATOM 1615 C ALA A 96 12.315 -2.181 2.326 1.00 54.15 C ATOM 1616 O ALA A 96 13.246 -2.745 1.744 1.00 60.24 O ATOM 1617 CB ALA A 96 11.489 -2.635 4.690 1.00 63.04 C ATOM 0 H ALA A 96 11.693 0.008 3.034 1.00 33.43 H new ATOM 0 HA ALA A 96 13.437 -1.967 4.172 1.00 64.10 H new ATOM 0 HB1 ALA A 96 11.757 -3.687 4.597 1.00 63.04 H new ATOM 0 HB2 ALA A 96 11.590 -2.325 5.730 1.00 63.04 H new ATOM 0 HB3 ALA A 96 10.457 -2.494 4.368 1.00 63.04 H new ATOM 1623 N ASN A 97 11.160 -1.832 1.727 1.00 72.42 N ATOM 1624 CA ASN A 97 10.868 -2.056 0.297 1.00 54.20 C ATOM 1625 C ASN A 97 9.605 -1.283 -0.116 1.00 44.41 C ATOM 1626 O ASN A 97 8.820 -0.837 0.744 1.00 34.42 O ATOM 1627 CB ASN A 97 10.699 -3.576 -0.024 1.00 51.41 C ATOM 1628 CG ASN A 97 9.482 -4.248 0.646 1.00 25.30 C ATOM 1629 OD1 ASN A 97 9.057 -3.884 1.746 1.00 54.51 O ATOM 1630 ND2 ASN A 97 8.915 -5.250 -0.016 1.00 32.34 N ATOM 0 H ASN A 97 10.394 -1.381 2.228 1.00 72.42 H new ATOM 0 HA ASN A 97 11.718 -1.687 -0.277 1.00 54.20 H new ATOM 0 HB2 ASN A 97 10.614 -3.698 -1.104 1.00 51.41 H new ATOM 0 HB3 ASN A 97 11.602 -4.101 0.286 1.00 51.41 H new ATOM 0 HD21 ASN A 97 8.112 -5.735 0.383 1.00 32.34 H new ATOM 0 HD22 ASN A 97 9.283 -5.534 -0.924 1.00 32.34 H new ATOM 1637 N THR A 98 9.431 -1.102 -1.433 1.00 63.44 N ATOM 1638 CA THR A 98 8.196 -0.559 -2.006 1.00 71.02 C ATOM 1639 C THR A 98 7.186 -1.718 -2.149 1.00 63.22 C ATOM 1640 O THR A 98 7.329 -2.568 -3.034 1.00 75.34 O ATOM 1641 CB THR A 98 8.462 0.118 -3.397 1.00 31.25 C ATOM 1642 OG1 THR A 98 9.602 0.990 -3.306 1.00 24.12 O ATOM 1643 CG2 THR A 98 7.247 0.935 -3.885 1.00 25.51 C ATOM 0 H THR A 98 10.143 -1.328 -2.128 1.00 63.44 H new ATOM 0 HA THR A 98 7.796 0.213 -1.348 1.00 71.02 H new ATOM 0 HB THR A 98 8.648 -0.681 -4.115 1.00 31.25 H new ATOM 0 HG1 THR A 98 10.265 0.733 -3.980 1.00 24.12 H new ATOM 0 HG21 THR A 98 7.476 1.386 -4.851 1.00 25.51 H new ATOM 0 HG22 THR A 98 6.384 0.278 -3.987 1.00 25.51 H new ATOM 0 HG23 THR A 98 7.022 1.720 -3.163 1.00 25.51 H new ATOM 1651 N LEU A 99 6.196 -1.774 -1.241 1.00 22.40 N ATOM 1652 CA LEU A 99 5.197 -2.863 -1.205 1.00 31.23 C ATOM 1653 C LEU A 99 4.069 -2.561 -2.205 1.00 12.44 C ATOM 1654 O LEU A 99 3.726 -1.402 -2.409 1.00 33.12 O ATOM 1655 CB LEU A 99 4.619 -3.018 0.231 1.00 52.11 C ATOM 1656 CG LEU A 99 3.510 -4.113 0.420 1.00 72.50 C ATOM 1657 CD1 LEU A 99 4.019 -5.516 0.038 1.00 51.31 C ATOM 1658 CD2 LEU A 99 2.949 -4.098 1.853 1.00 43.30 C ATOM 0 H LEU A 99 6.064 -1.071 -0.514 1.00 22.40 H new ATOM 0 HA LEU A 99 5.680 -3.800 -1.484 1.00 31.23 H new ATOM 0 HB2 LEU A 99 5.442 -3.244 0.909 1.00 52.11 H new ATOM 0 HB3 LEU A 99 4.207 -2.057 0.540 1.00 52.11 H new ATOM 0 HG LEU A 99 2.696 -3.867 -0.262 1.00 72.50 H new ATOM 0 HD11 LEU A 99 3.221 -6.244 0.183 1.00 51.31 H new ATOM 0 HD12 LEU A 99 4.327 -5.519 -1.007 1.00 51.31 H new ATOM 0 HD13 LEU A 99 4.869 -5.779 0.668 1.00 51.31 H new ATOM 0 HD21 LEU A 99 2.183 -4.867 1.952 1.00 43.30 H new ATOM 0 HD22 LEU A 99 3.754 -4.294 2.561 1.00 43.30 H new ATOM 0 HD23 LEU A 99 2.512 -3.122 2.062 1.00 43.30 H new ATOM 1670 N TYR A 100 3.521 -3.617 -2.840 1.00 73.45 N ATOM 1671 CA TYR A 100 2.399 -3.505 -3.795 1.00 24.21 C ATOM 1672 C TYR A 100 1.259 -4.421 -3.358 1.00 24.22 C ATOM 1673 O TYR A 100 1.395 -5.645 -3.365 1.00 64.20 O ATOM 1674 CB TYR A 100 2.868 -3.833 -5.242 1.00 31.14 C ATOM 1675 CG TYR A 100 3.712 -2.701 -5.837 1.00 10.45 C ATOM 1676 CD1 TYR A 100 5.085 -2.613 -5.593 1.00 54.51 C ATOM 1677 CD2 TYR A 100 3.119 -1.682 -6.574 1.00 65.20 C ATOM 1678 CE1 TYR A 100 5.825 -1.558 -6.078 1.00 53.35 C ATOM 1679 CE2 TYR A 100 3.858 -0.621 -7.051 1.00 13.01 C ATOM 1680 CZ TYR A 100 5.203 -0.560 -6.798 1.00 41.20 C ATOM 1681 OH TYR A 100 5.941 0.512 -7.256 1.00 73.30 O ATOM 0 H TYR A 100 3.845 -4.575 -2.705 1.00 73.45 H new ATOM 0 HA TYR A 100 2.035 -2.477 -3.798 1.00 24.21 H new ATOM 0 HB2 TYR A 100 3.449 -4.755 -5.235 1.00 31.14 H new ATOM 0 HB3 TYR A 100 1.998 -4.009 -5.875 1.00 31.14 H new ATOM 0 HD1 TYR A 100 5.573 -3.384 -5.015 1.00 54.51 H new ATOM 0 HD2 TYR A 100 2.059 -1.723 -6.777 1.00 65.20 H new ATOM 0 HE1 TYR A 100 6.888 -1.512 -5.895 1.00 53.35 H new ATOM 0 HE2 TYR A 100 3.378 0.160 -7.622 1.00 13.01 H new ATOM 0 HH TYR A 100 5.550 0.845 -8.091 1.00 73.30 H new ATOM 1691 N ILE A 101 0.150 -3.798 -2.930 1.00 54.14 N ATOM 1692 CA ILE A 101 -1.067 -4.490 -2.479 1.00 30.34 C ATOM 1693 C ILE A 101 -2.181 -4.263 -3.518 1.00 51.23 C ATOM 1694 O ILE A 101 -2.399 -3.139 -3.958 1.00 22.14 O ATOM 1695 CB ILE A 101 -1.539 -3.961 -1.074 1.00 21.23 C ATOM 1696 CG1 ILE A 101 -0.366 -3.937 -0.046 1.00 12.21 C ATOM 1697 CG2 ILE A 101 -2.707 -4.817 -0.542 1.00 12.24 C ATOM 1698 CD1 ILE A 101 -0.720 -3.318 1.301 1.00 50.22 C ATOM 0 H ILE A 101 0.073 -2.782 -2.887 1.00 54.14 H new ATOM 0 HA ILE A 101 -0.849 -5.553 -2.380 1.00 30.34 H new ATOM 0 HB ILE A 101 -1.884 -2.935 -1.204 1.00 21.23 H new ATOM 0 HG12 ILE A 101 -0.021 -4.958 0.117 1.00 12.21 H new ATOM 0 HG13 ILE A 101 0.468 -3.384 -0.478 1.00 12.21 H new ATOM 0 HG21 ILE A 101 -3.022 -4.439 0.430 1.00 12.24 H new ATOM 0 HG22 ILE A 101 -3.543 -4.766 -1.240 1.00 12.24 H new ATOM 0 HG23 ILE A 101 -2.382 -5.853 -0.440 1.00 12.24 H new ATOM 0 HD11 ILE A 101 0.153 -3.343 1.953 1.00 50.22 H new ATOM 0 HD12 ILE A 101 -1.035 -2.285 1.155 1.00 50.22 H new ATOM 0 HD13 ILE A 101 -1.532 -3.883 1.759 1.00 50.22 H new ATOM 1710 N PHE A 102 -2.879 -5.337 -3.891 1.00 62.14 N ATOM 1711 CA PHE A 102 -3.883 -5.344 -4.968 1.00 3.44 C ATOM 1712 C PHE A 102 -5.280 -5.470 -4.341 1.00 31.30 C ATOM 1713 O PHE A 102 -5.525 -6.387 -3.545 1.00 22.20 O ATOM 1714 CB PHE A 102 -3.585 -6.519 -5.952 1.00 22.11 C ATOM 1715 CG PHE A 102 -2.209 -6.433 -6.642 1.00 44.32 C ATOM 1716 CD1 PHE A 102 -1.024 -6.610 -5.914 1.00 25.11 C ATOM 1717 CD2 PHE A 102 -2.096 -6.151 -8.005 1.00 54.01 C ATOM 1718 CE1 PHE A 102 0.212 -6.506 -6.521 1.00 72.12 C ATOM 1719 CE2 PHE A 102 -0.849 -6.046 -8.607 1.00 31.02 C ATOM 1720 CZ PHE A 102 0.300 -6.221 -7.866 1.00 34.24 C ATOM 0 H PHE A 102 -2.763 -6.248 -3.446 1.00 62.14 H new ATOM 0 HA PHE A 102 -3.842 -4.416 -5.538 1.00 3.44 H new ATOM 0 HB2 PHE A 102 -3.646 -7.460 -5.405 1.00 22.11 H new ATOM 0 HB3 PHE A 102 -4.361 -6.543 -6.717 1.00 22.11 H new ATOM 0 HD1 PHE A 102 -1.079 -6.832 -4.858 1.00 25.11 H new ATOM 0 HD2 PHE A 102 -2.988 -6.013 -8.598 1.00 54.01 H new ATOM 0 HE1 PHE A 102 1.111 -6.648 -5.940 1.00 72.12 H new ATOM 0 HE2 PHE A 102 -0.779 -5.826 -9.662 1.00 31.02 H new ATOM 0 HZ PHE A 102 1.267 -6.135 -8.339 1.00 34.24 H new ATOM 1730 N ALA A 103 -6.181 -4.540 -4.696 1.00 63.33 N ATOM 1731 CA ALA A 103 -7.522 -4.433 -4.088 1.00 1.35 C ATOM 1732 C ALA A 103 -8.537 -5.351 -4.810 1.00 74.32 C ATOM 1733 O ALA A 103 -8.424 -5.562 -6.016 1.00 24.14 O ATOM 1734 CB ALA A 103 -7.987 -2.968 -4.131 1.00 22.22 C ATOM 0 H ALA A 103 -6.002 -3.838 -5.414 1.00 63.33 H new ATOM 0 HA ALA A 103 -7.465 -4.762 -3.050 1.00 1.35 H new ATOM 0 HB1 ALA A 103 -8.977 -2.887 -3.682 1.00 22.22 H new ATOM 0 HB2 ALA A 103 -7.285 -2.347 -3.575 1.00 22.22 H new ATOM 0 HB3 ALA A 103 -8.029 -2.630 -5.166 1.00 22.22 H new ATOM 1740 N PRO A 104 -9.548 -5.934 -4.083 1.00 21.04 N ATOM 1741 CA PRO A 104 -10.612 -6.746 -4.724 1.00 53.04 C ATOM 1742 C PRO A 104 -11.590 -5.902 -5.574 1.00 72.13 C ATOM 1743 O PRO A 104 -12.325 -6.455 -6.394 1.00 12.31 O ATOM 1744 CB PRO A 104 -11.325 -7.410 -3.516 1.00 2.22 C ATOM 1745 CG PRO A 104 -11.100 -6.465 -2.377 1.00 64.40 C ATOM 1746 CD PRO A 104 -9.714 -5.889 -2.602 1.00 74.00 C ATOM 0 HA PRO A 104 -10.207 -7.464 -5.437 1.00 53.04 H new ATOM 0 HB2 PRO A 104 -12.388 -7.549 -3.711 1.00 2.22 H new ATOM 0 HB3 PRO A 104 -10.909 -8.394 -3.302 1.00 2.22 H new ATOM 0 HG2 PRO A 104 -11.855 -5.679 -2.363 1.00 64.40 H new ATOM 0 HG3 PRO A 104 -11.160 -6.982 -1.419 1.00 64.40 H new ATOM 0 HD2 PRO A 104 -9.637 -4.871 -2.221 1.00 74.00 H new ATOM 0 HD3 PRO A 104 -8.949 -6.477 -2.095 1.00 74.00 H new ATOM 1754 N SER A 105 -11.589 -4.564 -5.376 1.00 43.34 N ATOM 1755 CA SER A 105 -12.495 -3.644 -6.091 1.00 15.44 C ATOM 1756 C SER A 105 -11.863 -2.241 -6.276 1.00 71.22 C ATOM 1757 O SER A 105 -11.013 -1.828 -5.470 1.00 13.20 O ATOM 1758 CB SER A 105 -13.841 -3.525 -5.329 1.00 3.20 C ATOM 1759 OG SER A 105 -14.500 -4.778 -5.234 1.00 32.12 O ATOM 0 H SER A 105 -10.963 -4.097 -4.720 1.00 43.34 H new ATOM 0 HA SER A 105 -12.673 -4.059 -7.083 1.00 15.44 H new ATOM 0 HB2 SER A 105 -13.660 -3.132 -4.329 1.00 3.20 H new ATOM 0 HB3 SER A 105 -14.487 -2.811 -5.840 1.00 3.20 H new ATOM 0 HG SER A 105 -15.343 -4.668 -4.747 1.00 32.12 H new ATOM 1765 N PRO A 106 -12.283 -1.473 -7.351 1.00 71.30 N ATOM 1766 CA PRO A 106 -11.944 -0.025 -7.509 1.00 62.35 C ATOM 1767 C PRO A 106 -12.493 0.849 -6.358 1.00 44.43 C ATOM 1768 O PRO A 106 -12.045 1.981 -6.169 1.00 34.30 O ATOM 1769 CB PRO A 106 -12.602 0.364 -8.866 1.00 25.10 C ATOM 1770 CG PRO A 106 -13.640 -0.694 -9.109 1.00 54.30 C ATOM 1771 CD PRO A 106 -13.061 -1.965 -8.527 1.00 22.41 C ATOM 0 HA PRO A 106 -10.867 0.139 -7.486 1.00 62.35 H new ATOM 0 HB2 PRO A 106 -13.052 1.355 -8.817 1.00 25.10 H new ATOM 0 HB3 PRO A 106 -11.866 0.388 -9.670 1.00 25.10 H new ATOM 0 HG2 PRO A 106 -14.584 -0.436 -8.629 1.00 54.30 H new ATOM 0 HG3 PRO A 106 -13.844 -0.807 -10.174 1.00 54.30 H new ATOM 0 HD2 PRO A 106 -13.842 -2.665 -8.230 1.00 22.41 H new ATOM 0 HD3 PRO A 106 -12.424 -2.483 -9.244 1.00 22.41 H new ATOM 1779 N GLN A 107 -13.460 0.304 -5.596 1.00 2.42 N ATOM 1780 CA GLN A 107 -14.001 0.961 -4.397 1.00 75.44 C ATOM 1781 C GLN A 107 -13.038 0.727 -3.218 1.00 73.23 C ATOM 1782 O GLN A 107 -12.734 1.655 -2.457 1.00 43.31 O ATOM 1783 CB GLN A 107 -15.415 0.412 -4.055 1.00 65.23 C ATOM 1784 CG GLN A 107 -16.541 0.838 -5.022 1.00 31.21 C ATOM 1785 CD GLN A 107 -16.829 2.350 -5.013 1.00 21.20 C ATOM 1786 OE1 GLN A 107 -16.604 3.042 -4.016 1.00 40.02 O ATOM 1787 NE2 GLN A 107 -17.374 2.864 -6.105 1.00 51.53 N ATOM 0 H GLN A 107 -13.885 -0.601 -5.796 1.00 2.42 H new ATOM 0 HA GLN A 107 -14.095 2.030 -4.588 1.00 75.44 H new ATOM 0 HB2 GLN A 107 -15.369 -0.677 -4.035 1.00 65.23 H new ATOM 0 HB3 GLN A 107 -15.680 0.738 -3.049 1.00 65.23 H new ATOM 0 HG2 GLN A 107 -16.272 0.535 -6.034 1.00 31.21 H new ATOM 0 HG3 GLN A 107 -17.454 0.302 -4.761 1.00 31.21 H new ATOM 0 HE21 GLN A 107 -17.549 2.270 -6.915 1.00 51.53 H new ATOM 0 HE22 GLN A 107 -17.618 3.854 -6.136 1.00 51.53 H new ATOM 1796 N SER A 108 -12.552 -0.530 -3.110 1.00 51.12 N ATOM 1797 CA SER A 108 -11.648 -0.974 -2.037 1.00 3.53 C ATOM 1798 C SER A 108 -10.350 -0.152 -2.015 1.00 62.25 C ATOM 1799 O SER A 108 -9.965 0.356 -0.950 1.00 15.20 O ATOM 1800 CB SER A 108 -11.323 -2.473 -2.209 1.00 62.42 C ATOM 1801 OG SER A 108 -12.505 -3.241 -2.296 1.00 5.24 O ATOM 0 H SER A 108 -12.782 -1.269 -3.775 1.00 51.12 H new ATOM 0 HA SER A 108 -12.156 -0.819 -1.085 1.00 3.53 H new ATOM 0 HB2 SER A 108 -10.724 -2.618 -3.108 1.00 62.42 H new ATOM 0 HB3 SER A 108 -10.723 -2.817 -1.367 1.00 62.42 H new ATOM 0 HG SER A 108 -12.604 -3.782 -1.485 1.00 5.24 H new ATOM 1807 N ARG A 109 -9.708 0.001 -3.213 1.00 72.51 N ATOM 1808 CA ARG A 109 -8.443 0.759 -3.356 1.00 41.41 C ATOM 1809 C ARG A 109 -8.555 2.170 -2.735 1.00 64.53 C ATOM 1810 O ARG A 109 -7.656 2.596 -2.038 1.00 74.43 O ATOM 1811 CB ARG A 109 -7.985 0.898 -4.846 1.00 12.44 C ATOM 1812 CG ARG A 109 -8.891 1.796 -5.728 1.00 60.12 C ATOM 1813 CD ARG A 109 -8.194 2.351 -6.975 1.00 33.30 C ATOM 1814 NE ARG A 109 -9.044 3.333 -7.675 1.00 33.14 N ATOM 1815 CZ ARG A 109 -9.047 4.661 -7.446 1.00 63.12 C ATOM 1816 NH1 ARG A 109 -8.236 5.204 -6.535 1.00 42.32 N ATOM 1817 NH2 ARG A 109 -9.880 5.445 -8.118 1.00 73.31 N ATOM 0 H ARG A 109 -10.053 -0.394 -4.088 1.00 72.51 H new ATOM 0 HA ARG A 109 -7.693 0.179 -2.819 1.00 41.41 H new ATOM 0 HB2 ARG A 109 -6.972 1.301 -4.863 1.00 12.44 H new ATOM 0 HB3 ARG A 109 -7.940 -0.096 -5.291 1.00 12.44 H new ATOM 0 HG2 ARG A 109 -9.764 1.221 -6.038 1.00 60.12 H new ATOM 0 HG3 ARG A 109 -9.255 2.629 -5.127 1.00 60.12 H new ATOM 0 HD2 ARG A 109 -7.253 2.821 -6.689 1.00 33.30 H new ATOM 0 HD3 ARG A 109 -7.949 1.532 -7.651 1.00 33.30 H new ATOM 0 HE ARG A 109 -9.680 2.978 -8.389 1.00 33.14 H new ATOM 0 HH11 ARG A 109 -7.601 4.612 -6.000 1.00 42.32 H new ATOM 0 HH12 ARG A 109 -8.251 6.211 -6.374 1.00 42.32 H new ATOM 0 HH21 ARG A 109 -10.516 5.042 -8.806 1.00 73.31 H new ATOM 0 HH22 ARG A 109 -9.884 6.450 -7.947 1.00 73.31 H new ATOM 1831 N ASP A 110 -9.709 2.840 -2.958 1.00 73.52 N ATOM 1832 CA ASP A 110 -9.913 4.251 -2.599 1.00 51.23 C ATOM 1833 C ASP A 110 -9.814 4.453 -1.086 1.00 64.00 C ATOM 1834 O ASP A 110 -9.066 5.314 -0.627 1.00 12.34 O ATOM 1835 CB ASP A 110 -11.286 4.745 -3.125 1.00 52.42 C ATOM 1836 CG ASP A 110 -11.563 6.220 -2.767 1.00 24.42 C ATOM 1837 OD1 ASP A 110 -11.109 7.110 -3.511 1.00 14.04 O ATOM 1838 OD2 ASP A 110 -12.224 6.494 -1.740 1.00 45.30 O ATOM 0 H ASP A 110 -10.525 2.410 -3.394 1.00 73.52 H new ATOM 0 HA ASP A 110 -9.125 4.840 -3.068 1.00 51.23 H new ATOM 0 HB2 ASP A 110 -11.320 4.625 -4.208 1.00 52.42 H new ATOM 0 HB3 ASP A 110 -12.076 4.120 -2.710 1.00 52.42 H new ATOM 1843 N LEU A 111 -10.556 3.625 -0.331 1.00 14.30 N ATOM 1844 CA LEU A 111 -10.643 3.752 1.126 1.00 24.20 C ATOM 1845 C LEU A 111 -9.331 3.310 1.791 1.00 13.53 C ATOM 1846 O LEU A 111 -8.916 3.913 2.774 1.00 13.21 O ATOM 1847 CB LEU A 111 -11.856 2.954 1.678 1.00 64.10 C ATOM 1848 CG LEU A 111 -12.131 3.081 3.215 1.00 44.33 C ATOM 1849 CD1 LEU A 111 -12.327 4.549 3.646 1.00 11.42 C ATOM 1850 CD2 LEU A 111 -13.335 2.215 3.634 1.00 74.52 C ATOM 0 H LEU A 111 -11.107 2.856 -0.714 1.00 14.30 H new ATOM 0 HA LEU A 111 -10.800 4.803 1.370 1.00 24.20 H new ATOM 0 HB2 LEU A 111 -12.749 3.277 1.143 1.00 64.10 H new ATOM 0 HB3 LEU A 111 -11.707 1.900 1.443 1.00 64.10 H new ATOM 0 HG LEU A 111 -11.247 2.709 3.733 1.00 44.33 H new ATOM 0 HD11 LEU A 111 -12.515 4.591 4.719 1.00 11.42 H new ATOM 0 HD12 LEU A 111 -11.428 5.120 3.412 1.00 11.42 H new ATOM 0 HD13 LEU A 111 -13.176 4.975 3.112 1.00 11.42 H new ATOM 0 HD21 LEU A 111 -13.504 2.321 4.706 1.00 74.52 H new ATOM 0 HD22 LEU A 111 -14.223 2.540 3.092 1.00 74.52 H new ATOM 0 HD23 LEU A 111 -13.130 1.170 3.401 1.00 74.52 H new ATOM 1862 N TRP A 112 -8.667 2.278 1.229 1.00 41.01 N ATOM 1863 CA TRP A 112 -7.363 1.802 1.742 1.00 23.14 C ATOM 1864 C TRP A 112 -6.249 2.853 1.540 1.00 20.21 C ATOM 1865 O TRP A 112 -5.436 3.070 2.443 1.00 21.12 O ATOM 1866 CB TRP A 112 -6.976 0.443 1.100 1.00 44.32 C ATOM 1867 CG TRP A 112 -7.648 -0.749 1.754 1.00 75.44 C ATOM 1868 CD1 TRP A 112 -8.741 -1.449 1.313 1.00 31.40 C ATOM 1869 CD2 TRP A 112 -7.259 -1.361 2.996 1.00 71.43 C ATOM 1870 NE1 TRP A 112 -9.046 -2.451 2.200 1.00 24.03 N ATOM 1871 CE2 TRP A 112 -8.152 -2.421 3.237 1.00 64.52 C ATOM 1872 CE3 TRP A 112 -6.234 -1.116 3.925 1.00 34.33 C ATOM 1873 CZ2 TRP A 112 -8.053 -3.229 4.366 1.00 63.12 C ATOM 1874 CZ3 TRP A 112 -6.142 -1.921 5.045 1.00 24.04 C ATOM 1875 CH2 TRP A 112 -7.045 -2.969 5.255 1.00 2.15 C ATOM 0 H TRP A 112 -9.011 1.759 0.421 1.00 41.01 H new ATOM 0 HA TRP A 112 -7.471 1.650 2.816 1.00 23.14 H new ATOM 0 HB2 TRP A 112 -7.238 0.462 0.042 1.00 44.32 H new ATOM 0 HB3 TRP A 112 -5.895 0.318 1.158 1.00 44.32 H new ATOM 0 HD1 TRP A 112 -9.282 -1.242 0.402 1.00 31.40 H new ATOM 0 HE1 TRP A 112 -9.816 -3.113 2.102 1.00 24.03 H new ATOM 0 HE3 TRP A 112 -5.530 -0.312 3.767 1.00 34.33 H new ATOM 0 HZ2 TRP A 112 -8.750 -4.036 4.535 1.00 63.12 H new ATOM 0 HZ3 TRP A 112 -5.361 -1.738 5.769 1.00 24.04 H new ATOM 0 HH2 TRP A 112 -6.945 -3.585 6.136 1.00 2.15 H new ATOM 1886 N VAL A 113 -6.237 3.505 0.362 1.00 34.44 N ATOM 1887 CA VAL A 113 -5.261 4.567 0.043 1.00 45.52 C ATOM 1888 C VAL A 113 -5.492 5.774 0.949 1.00 2.40 C ATOM 1889 O VAL A 113 -4.570 6.202 1.645 1.00 11.33 O ATOM 1890 CB VAL A 113 -5.331 5.001 -1.475 1.00 34.25 C ATOM 1891 CG1 VAL A 113 -4.456 6.240 -1.781 1.00 62.25 C ATOM 1892 CG2 VAL A 113 -4.916 3.838 -2.381 1.00 34.14 C ATOM 0 H VAL A 113 -6.898 3.313 -0.391 1.00 34.44 H new ATOM 0 HA VAL A 113 -4.264 4.164 0.219 1.00 45.52 H new ATOM 0 HB VAL A 113 -6.367 5.275 -1.676 1.00 34.25 H new ATOM 0 HG11 VAL A 113 -4.542 6.494 -2.838 1.00 62.25 H new ATOM 0 HG12 VAL A 113 -4.794 7.082 -1.177 1.00 62.25 H new ATOM 0 HG13 VAL A 113 -3.415 6.018 -1.545 1.00 62.25 H new ATOM 0 HG21 VAL A 113 -4.969 4.152 -3.423 1.00 34.14 H new ATOM 0 HG22 VAL A 113 -3.895 3.538 -2.144 1.00 34.14 H new ATOM 0 HG23 VAL A 113 -5.588 2.995 -2.221 1.00 34.14 H new ATOM 1902 N LYS A 114 -6.740 6.275 0.956 1.00 50.20 N ATOM 1903 CA LYS A 114 -7.099 7.503 1.669 1.00 64.35 C ATOM 1904 C LYS A 114 -6.842 7.351 3.179 1.00 72.43 C ATOM 1905 O LYS A 114 -6.329 8.275 3.797 1.00 32.24 O ATOM 1906 CB LYS A 114 -8.572 7.924 1.370 1.00 33.21 C ATOM 1907 CG LYS A 114 -9.676 7.175 2.147 1.00 40.42 C ATOM 1908 CD LYS A 114 -11.103 7.635 1.769 1.00 11.42 C ATOM 1909 CE LYS A 114 -11.344 9.141 1.995 1.00 31.22 C ATOM 1910 NZ LYS A 114 -11.128 9.554 3.409 1.00 23.02 N ATOM 0 H LYS A 114 -7.522 5.838 0.468 1.00 50.20 H new ATOM 0 HA LYS A 114 -6.459 8.307 1.305 1.00 64.35 H new ATOM 0 HB2 LYS A 114 -8.671 8.989 1.579 1.00 33.21 H new ATOM 0 HB3 LYS A 114 -8.755 7.790 0.304 1.00 33.21 H new ATOM 0 HG2 LYS A 114 -9.583 6.106 1.958 1.00 40.42 H new ATOM 0 HG3 LYS A 114 -9.524 7.324 3.216 1.00 40.42 H new ATOM 0 HD2 LYS A 114 -11.286 7.399 0.721 1.00 11.42 H new ATOM 0 HD3 LYS A 114 -11.826 7.068 2.355 1.00 11.42 H new ATOM 0 HE2 LYS A 114 -10.677 9.712 1.349 1.00 31.22 H new ATOM 0 HE3 LYS A 114 -12.364 9.389 1.700 1.00 31.22 H new ATOM 0 HZ1 LYS A 114 -11.254 10.583 3.493 1.00 23.02 H new ATOM 0 HZ2 LYS A 114 -11.815 9.070 4.021 1.00 23.02 H new ATOM 0 HZ3 LYS A 114 -10.163 9.298 3.702 1.00 23.02 H new ATOM 1924 N LYS A 115 -7.193 6.162 3.740 1.00 33.00 N ATOM 1925 CA LYS A 115 -6.979 5.845 5.162 1.00 64.22 C ATOM 1926 C LYS A 115 -5.507 5.917 5.544 1.00 75.02 C ATOM 1927 O LYS A 115 -5.161 6.636 6.472 1.00 30.23 O ATOM 1928 CB LYS A 115 -7.584 4.459 5.554 1.00 11.20 C ATOM 1929 CG LYS A 115 -9.034 4.541 6.081 1.00 24.23 C ATOM 1930 CD LYS A 115 -9.121 5.391 7.380 1.00 41.20 C ATOM 1931 CE LYS A 115 -10.544 5.493 7.933 1.00 1.25 C ATOM 1932 NZ LYS A 115 -10.586 6.242 9.213 1.00 5.23 N ATOM 0 H LYS A 115 -7.630 5.405 3.214 1.00 33.00 H new ATOM 0 HA LYS A 115 -7.510 6.609 5.729 1.00 64.22 H new ATOM 0 HB2 LYS A 115 -7.560 3.803 4.684 1.00 11.20 H new ATOM 0 HB3 LYS A 115 -6.955 4.001 6.317 1.00 11.20 H new ATOM 0 HG2 LYS A 115 -9.676 4.977 5.316 1.00 24.23 H new ATOM 0 HG3 LYS A 115 -9.409 3.536 6.277 1.00 24.23 H new ATOM 0 HD2 LYS A 115 -8.473 4.953 8.139 1.00 41.20 H new ATOM 0 HD3 LYS A 115 -8.743 6.393 7.178 1.00 41.20 H new ATOM 0 HE2 LYS A 115 -11.183 5.987 7.202 1.00 1.25 H new ATOM 0 HE3 LYS A 115 -10.948 4.492 8.084 1.00 1.25 H new ATOM 0 HZ1 LYS A 115 -11.567 6.289 9.555 1.00 5.23 H new ATOM 0 HZ2 LYS A 115 -9.996 5.757 9.919 1.00 5.23 H new ATOM 0 HZ3 LYS A 115 -10.225 7.206 9.063 1.00 5.23 H new ATOM 1946 N LEU A 116 -4.654 5.185 4.818 1.00 74.41 N ATOM 1947 CA LEU A 116 -3.215 5.148 5.106 1.00 22.31 C ATOM 1948 C LEU A 116 -2.604 6.566 5.017 1.00 62.22 C ATOM 1949 O LEU A 116 -1.908 6.989 5.938 1.00 1.35 O ATOM 1950 CB LEU A 116 -2.512 4.137 4.165 1.00 75.41 C ATOM 1951 CG LEU A 116 -2.874 2.628 4.402 1.00 23.34 C ATOM 1952 CD1 LEU A 116 -2.261 1.711 3.321 1.00 2.50 C ATOM 1953 CD2 LEU A 116 -2.456 2.171 5.815 1.00 33.42 C ATOM 0 H LEU A 116 -4.936 4.609 4.025 1.00 74.41 H new ATOM 0 HA LEU A 116 -3.059 4.804 6.128 1.00 22.31 H new ATOM 0 HB2 LEU A 116 -2.759 4.394 3.135 1.00 75.41 H new ATOM 0 HB3 LEU A 116 -1.434 4.255 4.274 1.00 75.41 H new ATOM 0 HG LEU A 116 -3.958 2.542 4.324 1.00 23.34 H new ATOM 0 HD11 LEU A 116 -2.536 0.676 3.523 1.00 2.50 H new ATOM 0 HD12 LEU A 116 -2.638 2.002 2.341 1.00 2.50 H new ATOM 0 HD13 LEU A 116 -1.175 1.807 3.335 1.00 2.50 H new ATOM 0 HD21 LEU A 116 -2.719 1.122 5.951 1.00 33.42 H new ATOM 0 HD22 LEU A 116 -1.379 2.293 5.933 1.00 33.42 H new ATOM 0 HD23 LEU A 116 -2.974 2.774 6.561 1.00 33.42 H new ATOM 1965 N LYS A 117 -2.928 7.302 3.929 1.00 32.35 N ATOM 1966 CA LYS A 117 -2.515 8.718 3.734 1.00 1.22 C ATOM 1967 C LYS A 117 -2.917 9.642 4.909 1.00 45.13 C ATOM 1968 O LYS A 117 -2.088 10.428 5.388 1.00 31.41 O ATOM 1969 CB LYS A 117 -3.075 9.266 2.395 1.00 52.23 C ATOM 1970 CG LYS A 117 -2.509 8.551 1.155 1.00 61.05 C ATOM 1971 CD LYS A 117 -3.095 9.070 -0.184 1.00 21.30 C ATOM 1972 CE LYS A 117 -2.712 10.519 -0.497 1.00 54.01 C ATOM 1973 NZ LYS A 117 -3.216 10.958 -1.825 1.00 53.10 N ATOM 0 H LYS A 117 -3.484 6.933 3.158 1.00 32.35 H new ATOM 0 HA LYS A 117 -1.425 8.720 3.701 1.00 1.22 H new ATOM 0 HB2 LYS A 117 -4.161 9.168 2.397 1.00 52.23 H new ATOM 0 HB3 LYS A 117 -2.851 10.330 2.325 1.00 52.23 H new ATOM 0 HG2 LYS A 117 -1.426 8.672 1.139 1.00 61.05 H new ATOM 0 HG3 LYS A 117 -2.709 7.483 1.239 1.00 61.05 H new ATOM 0 HD2 LYS A 117 -2.751 8.428 -0.995 1.00 21.30 H new ATOM 0 HD3 LYS A 117 -4.181 8.988 -0.152 1.00 21.30 H new ATOM 0 HE2 LYS A 117 -3.112 11.174 0.277 1.00 54.01 H new ATOM 0 HE3 LYS A 117 -1.627 10.620 -0.470 1.00 54.01 H new ATOM 0 HZ1 LYS A 117 -3.053 11.979 -1.938 1.00 53.10 H new ATOM 0 HZ2 LYS A 117 -2.713 10.442 -2.575 1.00 53.10 H new ATOM 0 HZ3 LYS A 117 -4.235 10.761 -1.892 1.00 53.10 H new ATOM 1987 N GLU A 118 -4.182 9.560 5.367 1.00 62.11 N ATOM 1988 CA GLU A 118 -4.676 10.430 6.457 1.00 71.12 C ATOM 1989 C GLU A 118 -4.136 10.003 7.839 1.00 54.51 C ATOM 1990 O GLU A 118 -3.987 10.845 8.730 1.00 45.21 O ATOM 1991 CB GLU A 118 -6.227 10.535 6.451 1.00 40.40 C ATOM 1992 CG GLU A 118 -6.994 9.227 6.721 1.00 12.44 C ATOM 1993 CD GLU A 118 -8.512 9.329 6.466 1.00 63.02 C ATOM 1994 OE1 GLU A 118 -9.243 9.797 7.360 1.00 14.30 O ATOM 1995 OE2 GLU A 118 -8.980 8.961 5.359 1.00 1.35 O ATOM 0 H GLU A 118 -4.876 8.907 5.004 1.00 62.11 H new ATOM 0 HA GLU A 118 -4.283 11.428 6.264 1.00 71.12 H new ATOM 0 HB2 GLU A 118 -6.524 11.268 7.200 1.00 40.40 H new ATOM 0 HB3 GLU A 118 -6.541 10.924 5.482 1.00 40.40 H new ATOM 0 HG2 GLU A 118 -6.582 8.439 6.091 1.00 12.44 H new ATOM 0 HG3 GLU A 118 -6.829 8.927 7.756 1.00 12.44 H new ATOM 2002 N GLU A 119 -3.820 8.711 8.015 1.00 22.34 N ATOM 2003 CA GLU A 119 -3.204 8.218 9.266 1.00 64.43 C ATOM 2004 C GLU A 119 -1.725 8.662 9.366 1.00 75.15 C ATOM 2005 O GLU A 119 -1.205 8.867 10.467 1.00 44.12 O ATOM 2006 CB GLU A 119 -3.315 6.669 9.390 1.00 63.04 C ATOM 2007 CG GLU A 119 -4.758 6.107 9.489 1.00 43.34 C ATOM 2008 CD GLU A 119 -5.605 6.730 10.616 1.00 42.21 C ATOM 2009 OE1 GLU A 119 -5.347 6.429 11.805 1.00 44.14 O ATOM 2010 OE2 GLU A 119 -6.529 7.532 10.315 1.00 30.11 O ATOM 0 H GLU A 119 -3.978 7.988 7.313 1.00 22.34 H new ATOM 0 HA GLU A 119 -3.757 8.660 10.095 1.00 64.43 H new ATOM 0 HB2 GLU A 119 -2.827 6.217 8.527 1.00 63.04 H new ATOM 0 HB3 GLU A 119 -2.759 6.352 10.273 1.00 63.04 H new ATOM 0 HG2 GLU A 119 -5.265 6.269 8.538 1.00 43.34 H new ATOM 0 HG3 GLU A 119 -4.706 5.029 9.643 1.00 43.34 H new ATOM 2017 N ILE A 120 -1.051 8.824 8.205 1.00 55.20 N ATOM 2018 CA ILE A 120 0.392 9.183 8.161 1.00 71.14 C ATOM 2019 C ILE A 120 0.622 10.703 7.986 1.00 74.42 C ATOM 2020 O ILE A 120 1.756 11.168 8.136 1.00 50.52 O ATOM 2021 CB ILE A 120 1.169 8.392 7.029 1.00 2.11 C ATOM 2022 CG1 ILE A 120 0.715 8.836 5.598 1.00 61.00 C ATOM 2023 CG2 ILE A 120 1.006 6.870 7.214 1.00 14.24 C ATOM 2024 CD1 ILE A 120 1.385 8.107 4.432 1.00 12.53 C ATOM 0 H ILE A 120 -1.479 8.713 7.286 1.00 55.20 H new ATOM 0 HA ILE A 120 0.794 8.889 9.131 1.00 71.14 H new ATOM 0 HB ILE A 120 2.227 8.636 7.124 1.00 2.11 H new ATOM 0 HG12 ILE A 120 -0.363 8.695 5.519 1.00 61.00 H new ATOM 0 HG13 ILE A 120 0.905 9.904 5.492 1.00 61.00 H new ATOM 0 HG21 ILE A 120 1.548 6.348 6.426 1.00 14.24 H new ATOM 0 HG22 ILE A 120 1.406 6.577 8.185 1.00 14.24 H new ATOM 0 HG23 ILE A 120 -0.051 6.608 7.163 1.00 14.24 H new ATOM 0 HD11 ILE A 120 0.996 8.493 3.490 1.00 12.53 H new ATOM 0 HD12 ILE A 120 2.462 8.268 4.473 1.00 12.53 H new ATOM 0 HD13 ILE A 120 1.174 7.040 4.501 1.00 12.53 H new ATOM 2036 N LYS A 121 -0.450 11.470 7.701 1.00 74.12 N ATOM 2037 CA LYS A 121 -0.331 12.898 7.310 1.00 45.51 C ATOM 2038 C LYS A 121 0.189 13.813 8.439 1.00 53.43 C ATOM 2039 O LYS A 121 0.674 14.921 8.173 1.00 14.43 O ATOM 2040 CB LYS A 121 -1.679 13.429 6.757 1.00 61.34 C ATOM 2041 CG LYS A 121 -2.782 13.684 7.813 1.00 20.11 C ATOM 2042 CD LYS A 121 -4.124 14.108 7.165 1.00 21.30 C ATOM 2043 CE LYS A 121 -5.244 14.327 8.193 1.00 2.32 C ATOM 2044 NZ LYS A 121 -6.541 14.639 7.541 1.00 2.34 N ATOM 0 H LYS A 121 -1.410 11.128 7.733 1.00 74.12 H new ATOM 0 HA LYS A 121 0.423 12.930 6.524 1.00 45.51 H new ATOM 0 HB2 LYS A 121 -1.490 14.360 6.223 1.00 61.34 H new ATOM 0 HB3 LYS A 121 -2.058 12.714 6.027 1.00 61.34 H new ATOM 0 HG2 LYS A 121 -2.935 12.780 8.403 1.00 20.11 H new ATOM 0 HG3 LYS A 121 -2.451 14.461 8.502 1.00 20.11 H new ATOM 0 HD2 LYS A 121 -3.973 15.027 6.599 1.00 21.30 H new ATOM 0 HD3 LYS A 121 -4.436 13.343 6.454 1.00 21.30 H new ATOM 0 HE2 LYS A 121 -5.352 13.433 8.808 1.00 2.32 H new ATOM 0 HE3 LYS A 121 -4.968 15.142 8.862 1.00 2.32 H new ATOM 0 HZ1 LYS A 121 -7.270 14.780 8.269 1.00 2.34 H new ATOM 0 HZ2 LYS A 121 -6.445 15.506 6.975 1.00 2.34 H new ATOM 0 HZ3 LYS A 121 -6.817 13.850 6.922 1.00 2.34 H new ATOM 2058 N ASN A 122 0.088 13.346 9.693 1.00 45.01 N ATOM 2059 CA ASN A 122 0.549 14.107 10.875 1.00 42.45 C ATOM 2060 C ASN A 122 2.038 13.858 11.176 1.00 21.32 C ATOM 2061 O ASN A 122 2.602 14.487 12.074 1.00 21.13 O ATOM 2062 CB ASN A 122 -0.327 13.758 12.110 1.00 32.44 C ATOM 2063 CG ASN A 122 -1.807 14.142 11.950 1.00 14.30 C ATOM 2064 OD1 ASN A 122 -2.094 15.264 11.295 1.00 4.31 O flip ATOM 2065 ND2 ASN A 122 -2.692 13.444 12.450 1.00 22.34 N flip ATOM 0 H ASN A 122 -0.313 12.436 9.920 1.00 45.01 H new ATOM 0 HA ASN A 122 0.441 15.168 10.650 1.00 42.45 H new ATOM 0 HB2 ASN A 122 -0.258 12.687 12.302 1.00 32.44 H new ATOM 0 HB3 ASN A 122 0.078 14.265 12.986 1.00 32.44 H new ATOM 0 HD21 ASN A 122 -2.446 12.588 12.947 1.00 22.34 H new ATOM 0 HD22 ASN A 122 -3.670 13.723 12.366 1.00 22.34 H new ATOM 2072 N ASN A 123 2.664 12.952 10.408 1.00 5.33 N ATOM 2073 CA ASN A 123 4.090 12.599 10.560 1.00 12.34 C ATOM 2074 C ASN A 123 4.928 13.401 9.550 1.00 12.21 C ATOM 2075 O ASN A 123 4.434 13.774 8.481 1.00 73.20 O ATOM 2076 CB ASN A 123 4.295 11.080 10.346 1.00 21.01 C ATOM 2077 CG ASN A 123 3.491 10.226 11.323 1.00 14.43 C ATOM 2078 OD1 ASN A 123 3.978 9.836 12.384 1.00 65.23 O ATOM 2079 ND2 ASN A 123 2.241 9.960 10.987 1.00 60.24 N ATOM 0 H ASN A 123 2.196 12.440 9.660 1.00 5.33 H new ATOM 0 HA ASN A 123 4.414 12.848 11.570 1.00 12.34 H new ATOM 0 HB2 ASN A 123 4.011 10.821 9.326 1.00 21.01 H new ATOM 0 HB3 ASN A 123 5.354 10.843 10.451 1.00 21.01 H new ATOM 0 HD21 ASN A 123 1.649 9.416 11.615 1.00 60.24 H new ATOM 0 HD22 ASN A 123 1.868 10.298 10.100 1.00 60.24 H new ATOM 2086 N ASN A 124 6.202 13.645 9.896 1.00 44.22 N ATOM 2087 CA ASN A 124 7.144 14.453 9.077 1.00 2.23 C ATOM 2088 C ASN A 124 8.144 13.553 8.324 1.00 24.03 C ATOM 2089 O ASN A 124 9.209 14.014 7.898 1.00 43.04 O ATOM 2090 CB ASN A 124 7.908 15.462 9.983 1.00 74.23 C ATOM 2091 CG ASN A 124 6.993 16.475 10.669 1.00 42.11 C ATOM 2092 OD1 ASN A 124 6.519 16.252 11.775 1.00 64.51 O ATOM 2093 ND2 ASN A 124 6.721 17.595 10.011 1.00 5.15 N ATOM 0 H ASN A 124 6.618 13.289 10.756 1.00 44.22 H new ATOM 0 HA ASN A 124 6.563 15.003 8.337 1.00 2.23 H new ATOM 0 HB2 ASN A 124 8.461 14.910 10.743 1.00 74.23 H new ATOM 0 HB3 ASN A 124 8.642 15.997 9.380 1.00 74.23 H new ATOM 0 HD21 ASN A 124 6.104 18.293 10.426 1.00 5.15 H new ATOM 0 HD22 ASN A 124 7.129 17.757 9.090 1.00 5.15 H new ATOM 2100 N ASN A 125 7.777 12.281 8.111 1.00 53.03 N ATOM 2101 CA ASN A 125 8.624 11.297 7.384 1.00 42.32 C ATOM 2102 C ASN A 125 8.121 11.121 5.942 1.00 71.10 C ATOM 2103 O ASN A 125 8.669 10.321 5.180 1.00 22.34 O ATOM 2104 CB ASN A 125 8.615 9.922 8.117 1.00 23.23 C ATOM 2105 CG ASN A 125 7.235 9.241 8.160 1.00 72.15 C ATOM 2106 OD1 ASN A 125 6.203 9.899 8.199 1.00 63.11 O ATOM 2107 ND2 ASN A 125 7.203 7.922 8.156 1.00 13.31 N ATOM 0 H ASN A 125 6.889 11.896 8.433 1.00 53.03 H new ATOM 0 HA ASN A 125 9.645 11.677 7.360 1.00 42.32 H new ATOM 0 HB2 ASN A 125 9.322 9.255 7.624 1.00 23.23 H new ATOM 0 HB3 ASN A 125 8.970 10.064 9.138 1.00 23.23 H new ATOM 0 HD21 ASN A 125 6.308 7.433 8.186 1.00 13.31 H new ATOM 0 HD22 ASN A 125 8.073 7.391 8.123 1.00 13.31 H new ATOM 2114 N ILE A 126 7.104 11.917 5.569 1.00 42.05 N ATOM 2115 CA ILE A 126 6.367 11.734 4.317 1.00 24.33 C ATOM 2116 C ILE A 126 7.146 12.394 3.181 1.00 5.13 C ATOM 2117 O ILE A 126 7.487 13.585 3.261 1.00 33.33 O ATOM 2118 CB ILE A 126 4.910 12.322 4.387 1.00 71.44 C ATOM 2119 CG1 ILE A 126 4.167 11.818 5.669 1.00 25.13 C ATOM 2120 CG2 ILE A 126 4.114 11.967 3.103 1.00 3.54 C ATOM 2121 CD1 ILE A 126 4.092 10.311 5.809 1.00 64.14 C ATOM 0 H ILE A 126 6.774 12.703 6.129 1.00 42.05 H new ATOM 0 HA ILE A 126 6.267 10.663 4.138 1.00 24.33 H new ATOM 0 HB ILE A 126 4.982 13.408 4.449 1.00 71.44 H new ATOM 0 HG12 ILE A 126 4.669 12.226 6.547 1.00 25.13 H new ATOM 0 HG13 ILE A 126 3.154 12.219 5.666 1.00 25.13 H new ATOM 0 HG21 ILE A 126 3.109 12.383 3.171 1.00 3.54 H new ATOM 0 HG22 ILE A 126 4.621 12.385 2.233 1.00 3.54 H new ATOM 0 HG23 ILE A 126 4.052 10.884 3.001 1.00 3.54 H new ATOM 0 HD11 ILE A 126 3.560 10.057 6.726 1.00 64.14 H new ATOM 0 HD12 ILE A 126 3.562 9.892 4.954 1.00 64.14 H new ATOM 0 HD13 ILE A 126 5.100 9.899 5.848 1.00 64.14 H new ATOM 2133 N MET A 127 7.428 11.610 2.139 1.00 14.24 N ATOM 2134 CA MET A 127 8.234 12.051 1.005 1.00 61.01 C ATOM 2135 C MET A 127 7.407 12.950 0.081 1.00 23.44 C ATOM 2136 O MET A 127 6.209 12.723 -0.127 1.00 43.33 O ATOM 2137 CB MET A 127 8.780 10.839 0.219 1.00 72.23 C ATOM 2138 CG MET A 127 9.614 9.861 1.056 1.00 15.44 C ATOM 2139 SD MET A 127 10.290 8.509 0.072 1.00 3.52 S ATOM 2140 CE MET A 127 8.804 7.834 -0.671 1.00 11.52 C ATOM 0 H MET A 127 7.101 10.647 2.060 1.00 14.24 H new ATOM 0 HA MET A 127 9.079 12.623 1.388 1.00 61.01 H new ATOM 0 HB2 MET A 127 7.941 10.298 -0.219 1.00 72.23 H new ATOM 0 HB3 MET A 127 9.391 11.203 -0.607 1.00 72.23 H new ATOM 0 HG2 MET A 127 10.431 10.402 1.533 1.00 15.44 H new ATOM 0 HG3 MET A 127 8.994 9.451 1.853 1.00 15.44 H new ATOM 0 HE1 MET A 127 9.077 7.085 -1.414 1.00 11.52 H new ATOM 0 HE2 MET A 127 8.189 7.372 0.101 1.00 11.52 H new ATOM 0 HE3 MET A 127 8.242 8.634 -1.152 1.00 11.52 H new ATOM 2150 N ILE A 128 8.076 13.972 -0.452 1.00 13.05 N ATOM 2151 CA ILE A 128 7.499 14.924 -1.420 1.00 74.35 C ATOM 2152 C ILE A 128 7.480 14.295 -2.839 1.00 1.24 C ATOM 2153 O ILE A 128 6.878 14.847 -3.759 1.00 41.41 O ATOM 2154 CB ILE A 128 8.322 16.282 -1.413 1.00 50.24 C ATOM 2155 CG1 ILE A 128 8.539 16.785 0.051 1.00 61.41 C ATOM 2156 CG2 ILE A 128 7.630 17.384 -2.262 1.00 54.14 C ATOM 2157 CD1 ILE A 128 9.443 18.002 0.180 1.00 10.43 C ATOM 0 H ILE A 128 9.050 14.171 -0.224 1.00 13.05 H new ATOM 0 HA ILE A 128 6.472 15.148 -1.130 1.00 74.35 H new ATOM 0 HB ILE A 128 9.291 16.075 -1.866 1.00 50.24 H new ATOM 0 HG12 ILE A 128 7.568 17.023 0.486 1.00 61.41 H new ATOM 0 HG13 ILE A 128 8.962 15.972 0.641 1.00 61.41 H new ATOM 0 HG21 ILE A 128 8.226 18.296 -2.230 1.00 54.14 H new ATOM 0 HG22 ILE A 128 7.540 17.045 -3.294 1.00 54.14 H new ATOM 0 HG23 ILE A 128 6.638 17.585 -1.858 1.00 54.14 H new ATOM 0 HD11 ILE A 128 9.534 18.278 1.231 1.00 10.43 H new ATOM 0 HD12 ILE A 128 10.429 17.767 -0.221 1.00 10.43 H new ATOM 0 HD13 ILE A 128 9.014 18.835 -0.378 1.00 10.43 H new ATOM 2169 N LYS A 129 8.195 13.155 -3.003 1.00 62.11 N ATOM 2170 CA LYS A 129 8.312 12.393 -4.277 1.00 70.44 C ATOM 2171 C LYS A 129 7.920 10.912 -4.057 1.00 41.41 C ATOM 2172 O LYS A 129 8.117 10.384 -2.958 1.00 41.03 O ATOM 2173 CB LYS A 129 9.784 12.474 -4.826 1.00 35.14 C ATOM 2174 CG LYS A 129 10.121 13.679 -5.745 1.00 4.50 C ATOM 2175 CD LYS A 129 9.901 15.054 -5.086 1.00 74.41 C ATOM 2176 CE LYS A 129 10.479 16.208 -5.913 1.00 33.14 C ATOM 2177 NZ LYS A 129 11.970 16.179 -5.942 1.00 31.53 N ATOM 0 H LYS A 129 8.719 12.728 -2.239 1.00 62.11 H new ATOM 0 HA LYS A 129 7.633 12.835 -5.006 1.00 70.44 H new ATOM 0 HB2 LYS A 129 10.464 12.495 -3.974 1.00 35.14 H new ATOM 0 HB3 LYS A 129 9.992 11.557 -5.377 1.00 35.14 H new ATOM 0 HG2 LYS A 129 11.161 13.602 -6.060 1.00 4.50 H new ATOM 0 HG3 LYS A 129 9.510 13.618 -6.645 1.00 4.50 H new ATOM 0 HD2 LYS A 129 8.833 15.216 -4.942 1.00 74.41 H new ATOM 0 HD3 LYS A 129 10.360 15.056 -4.097 1.00 74.41 H new ATOM 0 HE2 LYS A 129 10.095 16.153 -6.932 1.00 33.14 H new ATOM 0 HE3 LYS A 129 10.142 17.157 -5.497 1.00 33.14 H new ATOM 0 HZ1 LYS A 129 12.328 17.081 -6.316 1.00 31.53 H new ATOM 0 HZ2 LYS A 129 12.333 16.035 -4.978 1.00 31.53 H new ATOM 0 HZ3 LYS A 129 12.290 15.400 -6.552 1.00 31.53 H new ATOM 2191 N TYR A 130 7.365 10.255 -5.105 1.00 24.42 N ATOM 2192 CA TYR A 130 7.135 8.791 -5.114 1.00 15.41 C ATOM 2193 C TYR A 130 7.299 8.228 -6.553 1.00 74.22 C ATOM 2194 O TYR A 130 7.499 8.983 -7.518 1.00 51.24 O ATOM 2195 CB TYR A 130 5.744 8.418 -4.476 1.00 52.00 C ATOM 2196 CG TYR A 130 4.552 8.182 -5.448 1.00 60.33 C ATOM 2197 CD1 TYR A 130 4.033 9.209 -6.251 1.00 62.15 C ATOM 2198 CD2 TYR A 130 3.949 6.921 -5.543 1.00 73.20 C ATOM 2199 CE1 TYR A 130 2.968 8.980 -7.103 1.00 1.42 C ATOM 2200 CE2 TYR A 130 2.891 6.695 -6.394 1.00 25.33 C ATOM 2201 CZ TYR A 130 2.403 7.722 -7.168 1.00 4.42 C ATOM 2202 OH TYR A 130 1.345 7.483 -8.020 1.00 1.34 O ATOM 0 H TYR A 130 7.067 10.722 -5.961 1.00 24.42 H new ATOM 0 HA TYR A 130 7.892 8.318 -4.488 1.00 15.41 H new ATOM 0 HB2 TYR A 130 5.878 7.515 -3.881 1.00 52.00 H new ATOM 0 HB3 TYR A 130 5.464 9.215 -3.787 1.00 52.00 H new ATOM 0 HD1 TYR A 130 4.472 10.194 -6.203 1.00 62.15 H new ATOM 0 HD2 TYR A 130 4.322 6.109 -4.936 1.00 73.20 H new ATOM 0 HE1 TYR A 130 2.580 9.781 -7.714 1.00 1.42 H new ATOM 0 HE2 TYR A 130 2.445 5.713 -6.454 1.00 25.33 H new ATOM 0 HH TYR A 130 0.849 6.696 -7.713 1.00 1.34 H new ATOM 2212 N HIS A 131 7.238 6.896 -6.669 1.00 74.45 N ATOM 2213 CA HIS A 131 7.377 6.177 -7.950 1.00 64.45 C ATOM 2214 C HIS A 131 5.980 5.728 -8.428 1.00 20.22 C ATOM 2215 O HIS A 131 5.369 4.891 -7.772 1.00 2.03 O ATOM 2216 CB HIS A 131 8.303 4.961 -7.752 1.00 41.33 C ATOM 2217 CG HIS A 131 9.670 5.318 -7.230 1.00 55.23 C ATOM 2218 ND1 HIS A 131 10.675 5.717 -8.072 1.00 73.54 N ATOM 2219 CD2 HIS A 131 10.143 5.299 -5.958 1.00 10.42 C ATOM 2220 CE1 HIS A 131 11.725 5.927 -7.313 1.00 74.10 C ATOM 2221 NE2 HIS A 131 11.452 5.687 -6.021 1.00 33.24 N ATOM 0 H HIS A 131 7.090 6.278 -5.872 1.00 74.45 H new ATOM 0 HA HIS A 131 7.815 6.829 -8.706 1.00 64.45 H new ATOM 0 HB2 HIS A 131 7.830 4.265 -7.060 1.00 41.33 H new ATOM 0 HB3 HIS A 131 8.412 4.440 -8.703 1.00 41.33 H new ATOM 0 HD2 HIS A 131 9.592 5.030 -5.069 1.00 10.42 H new ATOM 0 HE1 HIS A 131 12.687 6.252 -7.681 1.00 74.10 H new ATOM 0 HE2 HIS A 131 12.098 5.777 -5.237 1.00 33.24 H new ATOM 2229 N PRO A 132 5.449 6.268 -9.567 1.00 41.53 N ATOM 2230 CA PRO A 132 4.029 6.064 -9.962 1.00 44.42 C ATOM 2231 C PRO A 132 3.726 4.686 -10.600 1.00 75.01 C ATOM 2232 O PRO A 132 2.571 4.250 -10.605 1.00 54.15 O ATOM 2233 CB PRO A 132 3.815 7.210 -10.975 1.00 31.12 C ATOM 2234 CG PRO A 132 5.140 7.338 -11.655 1.00 13.54 C ATOM 2235 CD PRO A 132 6.170 7.115 -10.556 1.00 42.40 C ATOM 0 HA PRO A 132 3.363 6.076 -9.100 1.00 44.42 H new ATOM 0 HB2 PRO A 132 3.022 6.973 -11.685 1.00 31.12 H new ATOM 0 HB3 PRO A 132 3.530 8.137 -10.476 1.00 31.12 H new ATOM 0 HG2 PRO A 132 5.247 6.602 -12.452 1.00 13.54 H new ATOM 0 HG3 PRO A 132 5.256 8.321 -12.111 1.00 13.54 H new ATOM 0 HD2 PRO A 132 7.061 6.616 -10.937 1.00 42.40 H new ATOM 0 HD3 PRO A 132 6.496 8.057 -10.115 1.00 42.40 H new ATOM 2243 N LYS A 133 4.758 4.028 -11.157 1.00 32.32 N ATOM 2244 CA LYS A 133 4.624 2.713 -11.822 1.00 73.22 C ATOM 2245 C LYS A 133 5.053 1.590 -10.861 1.00 55.03 C ATOM 2246 O LYS A 133 5.203 1.823 -9.656 1.00 24.42 O ATOM 2247 CB LYS A 133 5.461 2.695 -13.133 1.00 71.22 C ATOM 2248 CG LYS A 133 4.931 3.602 -14.267 1.00 70.54 C ATOM 2249 CD LYS A 133 3.564 3.129 -14.808 1.00 43.53 C ATOM 2250 CE LYS A 133 3.076 3.959 -16.007 1.00 44.41 C ATOM 2251 NZ LYS A 133 3.980 3.844 -17.185 1.00 2.32 N ATOM 0 H LYS A 133 5.711 4.391 -11.160 1.00 32.32 H new ATOM 0 HA LYS A 133 3.581 2.543 -12.088 1.00 73.22 H new ATOM 0 HB2 LYS A 133 6.482 2.995 -12.897 1.00 71.22 H new ATOM 0 HB3 LYS A 133 5.507 1.670 -13.501 1.00 71.22 H new ATOM 0 HG2 LYS A 133 4.839 4.624 -13.899 1.00 70.54 H new ATOM 0 HG3 LYS A 133 5.655 3.621 -15.082 1.00 70.54 H new ATOM 0 HD2 LYS A 133 3.638 2.082 -15.103 1.00 43.53 H new ATOM 0 HD3 LYS A 133 2.824 3.184 -14.009 1.00 43.53 H new ATOM 0 HE2 LYS A 133 2.075 3.632 -16.288 1.00 44.41 H new ATOM 0 HE3 LYS A 133 2.999 5.006 -15.713 1.00 44.41 H new ATOM 0 HZ1 LYS A 133 3.534 4.294 -18.010 1.00 2.32 H new ATOM 0 HZ2 LYS A 133 4.882 4.318 -16.978 1.00 2.32 H new ATOM 0 HZ3 LYS A 133 4.156 2.840 -17.391 1.00 2.32 H new ATOM 2265 N PHE A 134 5.253 0.371 -11.405 1.00 1.13 N ATOM 2266 CA PHE A 134 5.593 -0.815 -10.608 1.00 62.15 C ATOM 2267 C PHE A 134 7.111 -0.909 -10.413 1.00 12.02 C ATOM 2268 O PHE A 134 7.868 -0.944 -11.388 1.00 14.44 O ATOM 2269 CB PHE A 134 5.061 -2.115 -11.278 1.00 1.11 C ATOM 2270 CG PHE A 134 3.542 -2.241 -11.253 1.00 50.44 C ATOM 2271 CD1 PHE A 134 2.887 -2.555 -10.064 1.00 13.41 C ATOM 2272 CD2 PHE A 134 2.772 -2.035 -12.399 1.00 54.54 C ATOM 2273 CE1 PHE A 134 1.516 -2.657 -10.016 1.00 35.02 C ATOM 2274 CE2 PHE A 134 1.396 -2.141 -12.354 1.00 11.42 C ATOM 2275 CZ PHE A 134 0.767 -2.450 -11.166 1.00 70.03 C ATOM 0 H PHE A 134 5.182 0.187 -12.406 1.00 1.13 H new ATOM 0 HA PHE A 134 5.114 -0.712 -9.635 1.00 62.15 H new ATOM 0 HB2 PHE A 134 5.402 -2.145 -12.313 1.00 1.11 H new ATOM 0 HB3 PHE A 134 5.496 -2.977 -10.773 1.00 1.11 H new ATOM 0 HD1 PHE A 134 3.464 -2.721 -9.166 1.00 13.41 H new ATOM 0 HD2 PHE A 134 3.258 -1.790 -13.332 1.00 54.54 H new ATOM 0 HE1 PHE A 134 1.024 -2.898 -9.085 1.00 35.02 H new ATOM 0 HE2 PHE A 134 0.812 -1.982 -13.249 1.00 11.42 H new ATOM 0 HZ PHE A 134 -0.309 -2.531 -11.131 1.00 70.03 H new ATOM 2285 N TRP A 135 7.533 -0.953 -9.142 1.00 1.31 N ATOM 2286 CA TRP A 135 8.922 -1.208 -8.737 1.00 50.20 C ATOM 2287 C TRP A 135 9.175 -2.719 -8.725 1.00 73.13 C ATOM 2288 O TRP A 135 9.359 -3.344 -7.670 1.00 74.41 O ATOM 2289 CB TRP A 135 9.239 -0.539 -7.347 1.00 32.53 C ATOM 2290 CG TRP A 135 10.161 0.652 -7.436 1.00 71.53 C ATOM 2291 CD1 TRP A 135 9.994 1.756 -8.217 1.00 75.31 C ATOM 2292 CD2 TRP A 135 11.390 0.854 -6.717 1.00 70.51 C ATOM 2293 NE1 TRP A 135 11.045 2.617 -8.043 1.00 51.24 N ATOM 2294 CE2 TRP A 135 11.910 2.092 -7.125 1.00 63.12 C ATOM 2295 CE3 TRP A 135 12.102 0.104 -5.777 1.00 60.32 C ATOM 2296 CZ2 TRP A 135 13.100 2.603 -6.620 1.00 14.41 C ATOM 2297 CZ3 TRP A 135 13.287 0.613 -5.271 1.00 55.14 C ATOM 2298 CH2 TRP A 135 13.777 1.853 -5.700 1.00 40.33 C ATOM 0 H TRP A 135 6.906 -0.809 -8.351 1.00 1.31 H new ATOM 0 HA TRP A 135 9.601 -0.753 -9.458 1.00 50.20 H new ATOM 0 HB2 TRP A 135 8.303 -0.227 -6.883 1.00 32.53 H new ATOM 0 HB3 TRP A 135 9.687 -1.284 -6.690 1.00 32.53 H new ATOM 0 HD1 TRP A 135 9.156 1.927 -8.876 1.00 75.31 H new ATOM 0 HE1 TRP A 135 11.163 3.509 -8.523 1.00 51.24 H new ATOM 0 HE3 TRP A 135 11.734 -0.857 -5.450 1.00 60.32 H new ATOM 0 HZ2 TRP A 135 13.477 3.562 -6.944 1.00 14.41 H new ATOM 0 HZ3 TRP A 135 13.840 0.046 -4.536 1.00 55.14 H new ATOM 0 HH2 TRP A 135 14.708 2.223 -5.296 1.00 40.33 H new ATOM 2309 N THR A 136 9.108 -3.298 -9.924 1.00 34.31 N ATOM 2310 CA THR A 136 9.452 -4.686 -10.176 1.00 64.44 C ATOM 2311 C THR A 136 10.985 -4.749 -10.310 1.00 4.33 C ATOM 2312 O THR A 136 11.533 -4.408 -11.359 1.00 75.14 O ATOM 2313 CB THR A 136 8.710 -5.185 -11.462 1.00 43.43 C ATOM 2314 OG1 THR A 136 7.297 -4.944 -11.312 1.00 11.21 O ATOM 2315 CG2 THR A 136 8.945 -6.677 -11.738 1.00 15.10 C ATOM 0 H THR A 136 8.806 -2.799 -10.761 1.00 34.31 H new ATOM 0 HA THR A 136 9.138 -5.344 -9.366 1.00 64.44 H new ATOM 0 HB THR A 136 9.113 -4.632 -12.311 1.00 43.43 H new ATOM 0 HG1 THR A 136 6.811 -5.792 -11.382 1.00 11.21 H new ATOM 0 HG21 THR A 136 8.408 -6.969 -12.640 1.00 15.10 H new ATOM 0 HG22 THR A 136 10.011 -6.858 -11.876 1.00 15.10 H new ATOM 0 HG23 THR A 136 8.583 -7.265 -10.894 1.00 15.10 H new ATOM 2323 N ASP A 137 11.653 -5.089 -9.187 1.00 31.45 N ATOM 2324 CA ASP A 137 13.118 -4.974 -9.020 1.00 71.22 C ATOM 2325 C ASP A 137 13.885 -5.697 -10.146 1.00 2.12 C ATOM 2326 O ASP A 137 13.749 -6.911 -10.319 1.00 14.24 O ATOM 2327 CB ASP A 137 13.530 -5.533 -7.631 1.00 22.22 C ATOM 2328 CG ASP A 137 15.040 -5.416 -7.333 1.00 70.01 C ATOM 2329 OD1 ASP A 137 15.797 -6.357 -7.655 1.00 73.20 O ATOM 2330 OD2 ASP A 137 15.473 -4.388 -6.763 1.00 65.14 O ATOM 0 H ASP A 137 11.183 -5.456 -8.359 1.00 31.45 H new ATOM 0 HA ASP A 137 13.383 -3.919 -9.080 1.00 71.22 H new ATOM 0 HB2 ASP A 137 12.975 -5.003 -6.857 1.00 22.22 H new ATOM 0 HB3 ASP A 137 13.238 -6.581 -7.571 1.00 22.22 H new ATOM 2335 N GLY A 138 14.662 -4.915 -10.915 1.00 14.34 N ATOM 2336 CA GLY A 138 15.456 -5.438 -12.029 1.00 32.44 C ATOM 2337 C GLY A 138 14.668 -5.546 -13.324 1.00 13.33 C ATOM 2338 O GLY A 138 14.945 -6.415 -14.158 1.00 52.34 O ATOM 0 H GLY A 138 14.754 -3.908 -10.779 1.00 14.34 H new ATOM 0 HA2 GLY A 138 16.318 -4.790 -12.188 1.00 32.44 H new ATOM 0 HA3 GLY A 138 15.841 -6.422 -11.762 1.00 32.44 H new ATOM 2342 N SER A 139 13.689 -4.650 -13.494 1.00 51.41 N ATOM 2343 CA SER A 139 12.838 -4.583 -14.701 1.00 53.00 C ATOM 2344 C SER A 139 12.694 -3.130 -15.168 1.00 74.41 C ATOM 2345 O SER A 139 13.223 -2.202 -14.530 1.00 14.20 O ATOM 2346 CB SER A 139 11.445 -5.177 -14.398 1.00 61.10 C ATOM 2347 OG SER A 139 11.545 -6.495 -13.899 1.00 73.24 O ATOM 0 H SER A 139 13.458 -3.943 -12.796 1.00 51.41 H new ATOM 0 HA SER A 139 13.309 -5.163 -15.494 1.00 53.00 H new ATOM 0 HB2 SER A 139 10.930 -4.549 -13.671 1.00 61.10 H new ATOM 0 HB3 SER A 139 10.841 -5.175 -15.306 1.00 61.10 H new ATOM 0 HG SER A 139 10.687 -6.954 -14.014 1.00 73.24 H new ATOM 2353 N TYR A 140 11.988 -2.937 -16.305 1.00 35.41 N ATOM 2354 CA TYR A 140 11.596 -1.607 -16.770 1.00 35.13 C ATOM 2355 C TYR A 140 10.496 -1.069 -15.843 1.00 42.11 C ATOM 2356 O TYR A 140 9.341 -1.497 -15.909 1.00 41.15 O ATOM 2357 CB TYR A 140 11.122 -1.627 -18.246 1.00 32.44 C ATOM 2358 CG TYR A 140 12.202 -2.071 -19.246 1.00 1.02 C ATOM 2359 CD1 TYR A 140 13.349 -1.297 -19.459 1.00 22.35 C ATOM 2360 CD2 TYR A 140 12.073 -3.250 -19.992 1.00 41.51 C ATOM 2361 CE1 TYR A 140 14.317 -1.681 -20.369 1.00 12.32 C ATOM 2362 CE2 TYR A 140 13.041 -3.637 -20.900 1.00 24.04 C ATOM 2363 CZ TYR A 140 14.157 -2.852 -21.085 1.00 24.04 C ATOM 2364 OH TYR A 140 15.117 -3.236 -21.998 1.00 54.12 O ATOM 0 H TYR A 140 11.682 -3.696 -16.913 1.00 35.41 H new ATOM 0 HA TYR A 140 12.464 -0.948 -16.735 1.00 35.13 H new ATOM 0 HB2 TYR A 140 10.265 -2.295 -18.332 1.00 32.44 H new ATOM 0 HB3 TYR A 140 10.777 -0.630 -18.519 1.00 32.44 H new ATOM 0 HD1 TYR A 140 13.481 -0.381 -18.901 1.00 22.35 H new ATOM 0 HD2 TYR A 140 11.199 -3.869 -19.855 1.00 41.51 H new ATOM 0 HE1 TYR A 140 15.194 -1.069 -20.519 1.00 12.32 H new ATOM 0 HE2 TYR A 140 12.922 -4.552 -21.462 1.00 24.04 H new ATOM 0 HH TYR A 140 14.852 -4.083 -22.414 1.00 54.12 H new ATOM 2374 N GLN A 141 10.908 -0.199 -14.921 1.00 43.30 N ATOM 2375 CA GLN A 141 10.018 0.452 -13.951 1.00 53.22 C ATOM 2376 C GLN A 141 9.658 1.862 -14.455 1.00 60.24 C ATOM 2377 O GLN A 141 9.774 2.144 -15.659 1.00 21.44 O ATOM 2378 CB GLN A 141 10.755 0.492 -12.585 1.00 12.24 C ATOM 2379 CG GLN A 141 11.128 -0.908 -12.035 1.00 15.11 C ATOM 2380 CD GLN A 141 12.132 -0.906 -10.879 1.00 74.45 C ATOM 2381 OE1 GLN A 141 12.888 -1.861 -10.714 1.00 24.40 O ATOM 2382 NE2 GLN A 141 12.151 0.143 -10.065 1.00 52.10 N ATOM 0 H GLN A 141 11.884 0.080 -14.823 1.00 43.30 H new ATOM 0 HA GLN A 141 9.084 -0.097 -13.832 1.00 53.22 H new ATOM 0 HB2 GLN A 141 11.664 1.085 -12.690 1.00 12.24 H new ATOM 0 HB3 GLN A 141 10.124 1.002 -11.857 1.00 12.24 H new ATOM 0 HG2 GLN A 141 10.217 -1.405 -11.703 1.00 15.11 H new ATOM 0 HG3 GLN A 141 11.538 -1.504 -12.850 1.00 15.11 H new ATOM 0 HE21 GLN A 141 11.513 0.923 -10.223 1.00 52.10 H new ATOM 0 HE22 GLN A 141 12.803 0.169 -9.281 1.00 52.10 H new ATOM 2391 N CYS A 142 9.193 2.721 -13.532 1.00 23.23 N ATOM 2392 CA CYS A 142 8.936 4.149 -13.778 1.00 12.12 C ATOM 2393 C CYS A 142 10.208 4.854 -14.298 1.00 25.53 C ATOM 2394 O CYS A 142 10.296 5.209 -15.475 1.00 13.53 O ATOM 2395 CB CYS A 142 8.421 4.773 -12.453 1.00 63.53 C ATOM 2396 SG CYS A 142 9.164 4.008 -10.972 1.00 62.31 S ATOM 0 H CYS A 142 8.981 2.436 -12.576 1.00 23.23 H new ATOM 0 HA CYS A 142 8.180 4.276 -14.553 1.00 12.12 H new ATOM 0 HB2 CYS A 142 8.638 5.841 -12.452 1.00 63.53 H new ATOM 0 HB3 CYS A 142 7.337 4.668 -12.405 1.00 63.53 H new ATOM 0 HG CYS A 142 8.273 3.280 -10.367 1.00 62.31 H new ATOM 2401 N CYS A 143 11.199 5.007 -13.418 1.00 11.12 N ATOM 2402 CA CYS A 143 12.517 5.575 -13.762 1.00 74.03 C ATOM 2403 C CYS A 143 13.550 4.468 -14.014 1.00 21.23 C ATOM 2404 O CYS A 143 14.704 4.765 -14.343 1.00 62.43 O ATOM 2405 CB CYS A 143 12.972 6.462 -12.602 1.00 54.34 C ATOM 2406 SG CYS A 143 12.802 5.648 -10.988 1.00 70.42 S ATOM 0 H CYS A 143 11.115 4.740 -12.437 1.00 11.12 H new ATOM 0 HA CYS A 143 12.431 6.158 -14.679 1.00 74.03 H new ATOM 0 HB2 CYS A 143 14.014 6.745 -12.754 1.00 54.34 H new ATOM 0 HB3 CYS A 143 12.388 7.382 -12.603 1.00 54.34 H new ATOM 0 HG CYS A 143 13.338 6.394 -10.067 1.00 70.42 H new ATOM 2411 N ARG A 144 13.117 3.190 -13.855 1.00 45.24 N ATOM 2412 CA ARG A 144 13.992 1.995 -13.933 1.00 11.13 C ATOM 2413 C ARG A 144 15.081 2.009 -12.825 1.00 32.13 C ATOM 2414 O ARG A 144 16.074 1.272 -12.918 1.00 31.35 O ATOM 2415 CB ARG A 144 14.644 1.819 -15.349 1.00 61.20 C ATOM 2416 CG ARG A 144 13.685 1.491 -16.528 1.00 34.42 C ATOM 2417 CD ARG A 144 12.807 2.673 -16.968 1.00 42.13 C ATOM 2418 NE ARG A 144 13.611 3.856 -17.320 1.00 14.40 N ATOM 2419 CZ ARG A 144 13.115 5.042 -17.713 1.00 12.41 C ATOM 2420 NH1 ARG A 144 11.804 5.237 -17.827 1.00 14.33 N ATOM 2421 NH2 ARG A 144 13.942 6.046 -17.974 1.00 12.10 N ATOM 0 H ARG A 144 12.141 2.960 -13.667 1.00 45.24 H new ATOM 0 HA ARG A 144 13.346 1.133 -13.765 1.00 11.13 H new ATOM 0 HB2 ARG A 144 15.180 2.737 -15.592 1.00 61.20 H new ATOM 0 HB3 ARG A 144 15.387 1.024 -15.284 1.00 61.20 H new ATOM 0 HG2 ARG A 144 14.275 1.154 -17.380 1.00 34.42 H new ATOM 0 HG3 ARG A 144 13.040 0.661 -16.238 1.00 34.42 H new ATOM 0 HD2 ARG A 144 12.203 2.377 -17.826 1.00 42.13 H new ATOM 0 HD3 ARG A 144 12.116 2.930 -16.165 1.00 42.13 H new ATOM 0 HE ARG A 144 14.625 3.768 -17.261 1.00 14.40 H new ATOM 0 HH11 ARG A 144 11.155 4.479 -17.615 1.00 14.33 H new ATOM 0 HH12 ARG A 144 11.448 6.144 -18.127 1.00 14.33 H new ATOM 0 HH21 ARG A 144 14.949 5.916 -17.876 1.00 12.10 H new ATOM 0 HH22 ARG A 144 13.571 6.948 -18.273 1.00 12.10 H new ATOM 2435 N GLN A 145 14.885 2.843 -11.776 1.00 41.51 N ATOM 2436 CA GLN A 145 15.789 2.903 -10.617 1.00 52.54 C ATOM 2437 C GLN A 145 15.610 1.642 -9.756 1.00 33.23 C ATOM 2438 O GLN A 145 14.562 1.441 -9.139 1.00 4.44 O ATOM 2439 CB GLN A 145 15.542 4.188 -9.776 1.00 12.15 C ATOM 2440 CG GLN A 145 16.052 5.489 -10.440 1.00 5.32 C ATOM 2441 CD GLN A 145 15.757 6.770 -9.635 1.00 5.11 C ATOM 2442 OE1 GLN A 145 14.598 6.840 -8.988 1.00 22.20 O flip ATOM 2443 NE2 GLN A 145 16.552 7.716 -9.639 1.00 20.50 N flip ATOM 0 H GLN A 145 14.097 3.488 -11.715 1.00 41.51 H new ATOM 0 HA GLN A 145 16.817 2.943 -10.978 1.00 52.54 H new ATOM 0 HB2 GLN A 145 14.473 4.285 -9.587 1.00 12.15 H new ATOM 0 HB3 GLN A 145 16.028 4.073 -8.807 1.00 12.15 H new ATOM 0 HG2 GLN A 145 17.129 5.408 -10.590 1.00 5.32 H new ATOM 0 HG3 GLN A 145 15.598 5.581 -11.427 1.00 5.32 H new ATOM 0 HE21 GLN A 145 17.435 7.638 -10.143 1.00 20.50 H new ATOM 0 HE22 GLN A 145 16.325 8.575 -9.138 1.00 20.50 H new ATOM 2452 N THR A 146 16.632 0.787 -9.765 1.00 43.13 N ATOM 2453 CA THR A 146 16.654 -0.464 -9.004 1.00 24.42 C ATOM 2454 C THR A 146 18.109 -0.811 -8.660 1.00 61.54 C ATOM 2455 O THR A 146 18.882 -1.290 -9.506 1.00 53.23 O ATOM 2456 CB THR A 146 15.925 -1.634 -9.764 1.00 25.31 C ATOM 2457 OG1 THR A 146 16.203 -2.899 -9.155 1.00 13.51 O ATOM 2458 CG2 THR A 146 16.283 -1.695 -11.255 1.00 35.02 C ATOM 0 H THR A 146 17.481 0.945 -10.309 1.00 43.13 H new ATOM 0 HA THR A 146 16.095 -0.327 -8.078 1.00 24.42 H new ATOM 0 HB THR A 146 14.859 -1.418 -9.688 1.00 25.31 H new ATOM 0 HG1 THR A 146 15.710 -2.971 -8.311 1.00 13.51 H new ATOM 0 HG21 THR A 146 15.749 -2.522 -11.724 1.00 35.02 H new ATOM 0 HG22 THR A 146 15.998 -0.760 -11.736 1.00 35.02 H new ATOM 0 HG23 THR A 146 17.357 -1.847 -11.365 1.00 35.02 H new ATOM 2466 N GLU A 147 18.488 -0.485 -7.415 1.00 4.02 N ATOM 2467 CA GLU A 147 19.828 -0.749 -6.873 1.00 51.31 C ATOM 2468 C GLU A 147 19.671 -1.048 -5.370 1.00 63.12 C ATOM 2469 O GLU A 147 20.089 -2.101 -4.882 1.00 25.33 O ATOM 2470 CB GLU A 147 20.779 0.469 -7.123 1.00 33.42 C ATOM 2471 CG GLU A 147 22.297 0.139 -7.166 1.00 2.03 C ATOM 2472 CD GLU A 147 22.863 -0.532 -5.892 1.00 75.12 C ATOM 2473 OE1 GLU A 147 22.930 0.134 -4.845 1.00 44.22 O ATOM 2474 OE2 GLU A 147 23.233 -1.722 -5.933 1.00 25.43 O ATOM 0 H GLU A 147 17.866 -0.026 -6.750 1.00 4.02 H new ATOM 0 HA GLU A 147 20.283 -1.604 -7.373 1.00 51.31 H new ATOM 0 HB2 GLU A 147 20.500 0.936 -8.067 1.00 33.42 H new ATOM 0 HB3 GLU A 147 20.608 1.207 -6.339 1.00 33.42 H new ATOM 0 HG2 GLU A 147 22.486 -0.516 -8.016 1.00 2.03 H new ATOM 0 HG3 GLU A 147 22.848 1.062 -7.346 1.00 2.03 H new ATOM 2481 N LYS A 148 19.054 -0.095 -4.655 1.00 12.34 N ATOM 2482 CA LYS A 148 18.746 -0.221 -3.224 1.00 22.24 C ATOM 2483 C LYS A 148 17.331 0.356 -2.978 1.00 30.43 C ATOM 2484 O LYS A 148 16.338 -0.350 -3.178 1.00 34.31 O ATOM 2485 CB LYS A 148 19.860 0.473 -2.366 1.00 31.25 C ATOM 2486 CG LYS A 148 19.653 0.392 -0.832 1.00 24.53 C ATOM 2487 CD LYS A 148 19.719 -1.044 -0.267 1.00 30.23 C ATOM 2488 CE LYS A 148 21.125 -1.658 -0.362 1.00 2.42 C ATOM 2489 NZ LYS A 148 21.165 -3.035 0.192 1.00 10.52 N ATOM 0 H LYS A 148 18.753 0.792 -5.058 1.00 12.34 H new ATOM 0 HA LYS A 148 18.739 -1.266 -2.913 1.00 22.24 H new ATOM 0 HB2 LYS A 148 20.821 0.021 -2.612 1.00 31.25 H new ATOM 0 HB3 LYS A 148 19.918 1.523 -2.654 1.00 31.25 H new ATOM 0 HG2 LYS A 148 20.412 1.001 -0.340 1.00 24.53 H new ATOM 0 HG3 LYS A 148 18.685 0.826 -0.582 1.00 24.53 H new ATOM 0 HD2 LYS A 148 19.402 -1.034 0.776 1.00 30.23 H new ATOM 0 HD3 LYS A 148 19.015 -1.675 -0.809 1.00 30.23 H new ATOM 0 HE2 LYS A 148 21.444 -1.676 -1.404 1.00 2.42 H new ATOM 0 HE3 LYS A 148 21.833 -1.029 0.177 1.00 2.42 H new ATOM 0 HZ1 LYS A 148 22.130 -3.414 0.110 1.00 10.52 H new ATOM 0 HZ2 LYS A 148 20.885 -3.015 1.193 1.00 10.52 H new ATOM 0 HZ3 LYS A 148 20.508 -3.642 -0.339 1.00 10.52 H new ATOM 2503 N LEU A 149 17.243 1.652 -2.613 1.00 72.42 N ATOM 2504 CA LEU A 149 15.971 2.377 -2.420 1.00 13.41 C ATOM 2505 C LEU A 149 16.151 3.795 -2.972 1.00 73.23 C ATOM 2506 O LEU A 149 17.203 4.410 -2.776 1.00 1.43 O ATOM 2507 CB LEU A 149 15.567 2.434 -0.907 1.00 21.44 C ATOM 2508 CG LEU A 149 15.179 1.078 -0.218 1.00 21.30 C ATOM 2509 CD1 LEU A 149 14.876 1.276 1.287 1.00 62.21 C ATOM 2510 CD2 LEU A 149 13.989 0.405 -0.937 1.00 71.11 C ATOM 0 H LEU A 149 18.065 2.231 -2.442 1.00 72.42 H new ATOM 0 HA LEU A 149 15.172 1.855 -2.946 1.00 13.41 H new ATOM 0 HB2 LEU A 149 16.397 2.870 -0.352 1.00 21.44 H new ATOM 0 HB3 LEU A 149 14.723 3.117 -0.808 1.00 21.44 H new ATOM 0 HG LEU A 149 16.039 0.413 -0.299 1.00 21.30 H new ATOM 0 HD11 LEU A 149 14.611 0.318 1.734 1.00 62.21 H new ATOM 0 HD12 LEU A 149 15.758 1.677 1.786 1.00 62.21 H new ATOM 0 HD13 LEU A 149 14.045 1.972 1.402 1.00 62.21 H new ATOM 0 HD21 LEU A 149 13.744 -0.532 -0.436 1.00 71.11 H new ATOM 0 HD22 LEU A 149 13.125 1.068 -0.909 1.00 71.11 H new ATOM 0 HD23 LEU A 149 14.258 0.203 -1.974 1.00 71.11 H new ATOM 2522 N ALA A 150 15.135 4.300 -3.678 1.00 12.43 N ATOM 2523 CA ALA A 150 15.124 5.667 -4.222 1.00 62.13 C ATOM 2524 C ALA A 150 13.918 6.430 -3.637 1.00 35.23 C ATOM 2525 O ALA A 150 12.876 5.804 -3.386 1.00 74.00 O ATOM 2526 CB ALA A 150 15.084 5.624 -5.764 1.00 34.01 C ATOM 0 H ALA A 150 14.290 3.770 -3.891 1.00 12.43 H new ATOM 0 HA ALA A 150 16.035 6.193 -3.937 1.00 62.13 H new ATOM 0 HB1 ALA A 150 15.076 6.641 -6.156 1.00 34.01 H new ATOM 0 HB2 ALA A 150 15.963 5.098 -6.136 1.00 34.01 H new ATOM 0 HB3 ALA A 150 14.184 5.102 -6.090 1.00 34.01 H new ATOM 2532 N PRO A 151 14.039 7.779 -3.382 1.00 30.04 N ATOM 2533 CA PRO A 151 12.922 8.601 -2.845 1.00 34.45 C ATOM 2534 C PRO A 151 11.676 8.558 -3.750 1.00 74.52 C ATOM 2535 O PRO A 151 10.597 8.128 -3.331 1.00 15.21 O ATOM 2536 CB PRO A 151 13.514 10.039 -2.773 1.00 44.01 C ATOM 2537 CG PRO A 151 15.004 9.864 -2.794 1.00 23.25 C ATOM 2538 CD PRO A 151 15.272 8.594 -3.578 1.00 71.14 C ATOM 0 HA PRO A 151 12.577 8.234 -1.879 1.00 34.45 H new ATOM 0 HB2 PRO A 151 13.179 10.644 -3.616 1.00 44.01 H new ATOM 0 HB3 PRO A 151 13.192 10.550 -1.866 1.00 44.01 H new ATOM 0 HG2 PRO A 151 15.490 10.720 -3.263 1.00 23.25 H new ATOM 0 HG3 PRO A 151 15.401 9.787 -1.782 1.00 23.25 H new ATOM 0 HD2 PRO A 151 15.446 8.806 -4.633 1.00 71.14 H new ATOM 0 HD3 PRO A 151 16.156 8.075 -3.207 1.00 71.14 H new ATOM 2546 N GLY A 152 11.865 8.958 -5.010 1.00 22.41 N ATOM 2547 CA GLY A 152 10.781 9.058 -5.964 1.00 40.41 C ATOM 2548 C GLY A 152 11.225 9.768 -7.218 1.00 64.43 C ATOM 2549 O GLY A 152 11.983 10.741 -7.140 1.00 62.44 O ATOM 0 H GLY A 152 12.776 9.219 -5.388 1.00 22.41 H new ATOM 0 HA2 GLY A 152 10.421 8.061 -6.215 1.00 40.41 H new ATOM 0 HA3 GLY A 152 9.946 9.595 -5.515 1.00 40.41 H new ATOM 2553 N CYS A 153 10.774 9.268 -8.374 1.00 3.24 N ATOM 2554 CA CYS A 153 11.083 9.858 -9.678 1.00 21.51 C ATOM 2555 C CYS A 153 10.129 11.014 -9.974 1.00 31.40 C ATOM 2556 O CYS A 153 10.548 12.080 -10.440 1.00 74.54 O ATOM 2557 CB CYS A 153 10.967 8.778 -10.760 1.00 10.41 C ATOM 2558 SG CYS A 153 9.374 7.899 -10.743 1.00 4.04 S ATOM 0 H CYS A 153 10.182 8.439 -8.430 1.00 3.24 H new ATOM 0 HA CYS A 153 12.100 10.250 -9.668 1.00 21.51 H new ATOM 0 HB2 CYS A 153 11.108 9.238 -11.738 1.00 10.41 H new ATOM 0 HB3 CYS A 153 11.773 8.056 -10.629 1.00 10.41 H new ATOM 0 HG CYS A 153 9.586 6.617 -10.704 1.00 4.04 H new ATOM 2563 N GLU A 154 8.841 10.795 -9.673 1.00 72.34 N ATOM 2564 CA GLU A 154 7.783 11.796 -9.874 1.00 23.04 C ATOM 2565 C GLU A 154 7.431 12.409 -8.526 1.00 1.33 C ATOM 2566 O GLU A 154 7.732 11.822 -7.484 1.00 51.20 O ATOM 2567 CB GLU A 154 6.536 11.140 -10.516 1.00 54.51 C ATOM 2568 CG GLU A 154 6.788 10.529 -11.911 1.00 62.25 C ATOM 2569 CD GLU A 154 7.219 11.551 -12.976 1.00 53.22 C ATOM 2570 OE1 GLU A 154 6.347 12.312 -13.464 1.00 71.42 O ATOM 2571 OE2 GLU A 154 8.422 11.599 -13.323 1.00 13.23 O ATOM 0 H GLU A 154 8.502 9.916 -9.282 1.00 72.34 H new ATOM 0 HA GLU A 154 8.135 12.576 -10.549 1.00 23.04 H new ATOM 0 HB2 GLU A 154 6.168 10.359 -9.851 1.00 54.51 H new ATOM 0 HB3 GLU A 154 5.747 11.888 -10.597 1.00 54.51 H new ATOM 0 HG2 GLU A 154 7.558 9.762 -11.826 1.00 62.25 H new ATOM 0 HG3 GLU A 154 5.878 10.031 -12.248 1.00 62.25 H new ATOM 2578 N LYS A 155 6.813 13.597 -8.536 1.00 51.31 N ATOM 2579 CA LYS A 155 6.410 14.263 -7.297 1.00 55.24 C ATOM 2580 C LYS A 155 5.107 13.630 -6.750 1.00 70.14 C ATOM 2581 O LYS A 155 4.219 13.230 -7.513 1.00 31.43 O ATOM 2582 CB LYS A 155 6.295 15.804 -7.506 1.00 62.22 C ATOM 2583 CG LYS A 155 5.194 16.308 -8.488 1.00 53.31 C ATOM 2584 CD LYS A 155 3.838 16.592 -7.789 1.00 42.24 C ATOM 2585 CE LYS A 155 2.759 17.066 -8.764 1.00 71.12 C ATOM 2586 NZ LYS A 155 1.464 17.300 -8.079 1.00 52.40 N ATOM 0 H LYS A 155 6.583 14.112 -9.386 1.00 51.31 H new ATOM 0 HA LYS A 155 7.181 14.113 -6.541 1.00 55.24 H new ATOM 0 HB2 LYS A 155 6.118 16.265 -6.534 1.00 62.22 H new ATOM 0 HB3 LYS A 155 7.258 16.170 -7.861 1.00 62.22 H new ATOM 0 HG2 LYS A 155 5.541 17.218 -8.977 1.00 53.31 H new ATOM 0 HG3 LYS A 155 5.044 15.563 -9.269 1.00 53.31 H new ATOM 0 HD2 LYS A 155 3.496 15.687 -7.287 1.00 42.24 H new ATOM 0 HD3 LYS A 155 3.983 17.349 -7.018 1.00 42.24 H new ATOM 0 HE2 LYS A 155 3.086 17.986 -9.249 1.00 71.12 H new ATOM 0 HE3 LYS A 155 2.626 16.322 -9.549 1.00 71.12 H new ATOM 0 HZ1 LYS A 155 0.689 17.235 -8.770 1.00 52.40 H new ATOM 0 HZ2 LYS A 155 1.328 16.583 -7.338 1.00 52.40 H new ATOM 0 HZ3 LYS A 155 1.465 18.247 -7.648 1.00 52.40 H new ATOM 2600 N TYR A 156 5.050 13.501 -5.430 1.00 12.33 N ATOM 2601 CA TYR A 156 3.892 13.011 -4.680 1.00 30.00 C ATOM 2602 C TYR A 156 3.339 14.141 -3.809 1.00 11.22 C ATOM 2603 O TYR A 156 4.045 14.667 -2.938 1.00 32.43 O ATOM 2604 CB TYR A 156 4.326 11.816 -3.795 1.00 53.32 C ATOM 2605 CG TYR A 156 3.268 11.309 -2.800 1.00 50.22 C ATOM 2606 CD1 TYR A 156 2.069 10.737 -3.240 1.00 51.31 C ATOM 2607 CD2 TYR A 156 3.480 11.406 -1.422 1.00 34.23 C ATOM 2608 CE1 TYR A 156 1.127 10.283 -2.337 1.00 4.22 C ATOM 2609 CE2 TYR A 156 2.547 10.952 -0.523 1.00 74.30 C ATOM 2610 CZ TYR A 156 1.374 10.389 -0.978 1.00 32.35 C ATOM 2611 OH TYR A 156 0.447 9.931 -0.071 1.00 63.02 O ATOM 0 H TYR A 156 5.836 13.743 -4.827 1.00 12.33 H new ATOM 0 HA TYR A 156 3.114 12.680 -5.368 1.00 30.00 H new ATOM 0 HB2 TYR A 156 4.613 10.990 -4.446 1.00 53.32 H new ATOM 0 HB3 TYR A 156 5.216 12.105 -3.236 1.00 53.32 H new ATOM 0 HD1 TYR A 156 1.878 10.649 -4.299 1.00 51.31 H new ATOM 0 HD2 TYR A 156 4.396 11.847 -1.057 1.00 34.23 H new ATOM 0 HE1 TYR A 156 0.203 9.848 -2.689 1.00 4.22 H new ATOM 0 HE2 TYR A 156 2.732 11.036 0.538 1.00 74.30 H new ATOM 0 HH TYR A 156 0.119 9.052 -0.354 1.00 63.02 H new ATOM 2621 N ASN A 157 2.088 14.534 -4.062 1.00 20.20 N ATOM 2622 CA ASN A 157 1.353 15.448 -3.174 1.00 64.51 C ATOM 2623 C ASN A 157 0.479 14.640 -2.185 1.00 24.44 C ATOM 2624 O ASN A 157 -0.465 13.950 -2.580 1.00 64.14 O ATOM 2625 CB ASN A 157 0.544 16.504 -3.984 1.00 60.24 C ATOM 2626 CG ASN A 157 -0.209 16.013 -5.238 1.00 54.31 C ATOM 2627 OD1 ASN A 157 -0.413 16.787 -6.178 1.00 51.42 O ATOM 2628 ND2 ASN A 157 -0.651 14.767 -5.279 1.00 74.31 N ATOM 0 H ASN A 157 1.557 14.233 -4.879 1.00 20.20 H new ATOM 0 HA ASN A 157 2.068 16.018 -2.581 1.00 64.51 H new ATOM 0 HB2 ASN A 157 -0.183 16.960 -3.312 1.00 60.24 H new ATOM 0 HB3 ASN A 157 1.232 17.292 -4.291 1.00 60.24 H new ATOM 0 HD21 ASN A 157 -1.167 14.436 -6.094 1.00 74.31 H new ATOM 0 HD22 ASN A 157 -0.476 14.138 -4.496 1.00 74.31 H new ATOM 2635 N LEU A 158 0.833 14.722 -0.892 1.00 74.44 N ATOM 2636 CA LEU A 158 0.190 13.938 0.183 1.00 31.43 C ATOM 2637 C LEU A 158 -1.305 14.285 0.338 1.00 53.22 C ATOM 2638 O LEU A 158 -2.157 13.402 0.293 1.00 72.33 O ATOM 2639 CB LEU A 158 0.933 14.156 1.525 1.00 30.31 C ATOM 2640 CG LEU A 158 0.332 13.438 2.784 1.00 4.30 C ATOM 2641 CD1 LEU A 158 0.330 11.897 2.635 1.00 3.31 C ATOM 2642 CD2 LEU A 158 1.078 13.880 4.051 1.00 34.23 C ATOM 0 H LEU A 158 1.576 15.336 -0.558 1.00 74.44 H new ATOM 0 HA LEU A 158 0.254 12.887 -0.098 1.00 31.43 H new ATOM 0 HB2 LEU A 158 1.964 13.823 1.402 1.00 30.31 H new ATOM 0 HB3 LEU A 158 0.966 15.227 1.726 1.00 30.31 H new ATOM 0 HG LEU A 158 -0.712 13.739 2.872 1.00 4.30 H new ATOM 0 HD11 LEU A 158 -0.095 11.445 3.531 1.00 3.31 H new ATOM 0 HD12 LEU A 158 -0.268 11.616 1.768 1.00 3.31 H new ATOM 0 HD13 LEU A 158 1.352 11.543 2.500 1.00 3.31 H new ATOM 0 HD21 LEU A 158 0.652 13.375 4.918 1.00 34.23 H new ATOM 0 HD22 LEU A 158 2.133 13.620 3.961 1.00 34.23 H new ATOM 0 HD23 LEU A 158 0.979 14.959 4.174 1.00 34.23 H new ATOM 2654 N PHE A 159 -1.621 15.577 0.477 1.00 11.31 N ATOM 2655 CA PHE A 159 -3.016 16.046 0.668 1.00 74.52 C ATOM 2656 C PHE A 159 -3.648 16.382 -0.709 1.00 33.12 C ATOM 2657 O PHE A 159 -4.547 17.220 -0.789 1.00 40.12 O ATOM 2658 CB PHE A 159 -3.032 17.305 1.590 1.00 0.32 C ATOM 2659 CG PHE A 159 -2.208 17.189 2.876 1.00 3.20 C ATOM 2660 CD1 PHE A 159 -0.847 17.525 2.892 1.00 61.04 C ATOM 2661 CD2 PHE A 159 -2.788 16.759 4.069 1.00 1.42 C ATOM 2662 CE1 PHE A 159 -0.105 17.436 4.054 1.00 3.44 C ATOM 2663 CE2 PHE A 159 -2.040 16.673 5.227 1.00 62.44 C ATOM 2664 CZ PHE A 159 -0.701 17.007 5.220 1.00 20.55 C ATOM 0 H PHE A 159 -0.931 16.328 0.462 1.00 11.31 H new ATOM 0 HA PHE A 159 -3.599 15.257 1.143 1.00 74.52 H new ATOM 0 HB2 PHE A 159 -2.664 18.157 1.019 1.00 0.32 H new ATOM 0 HB3 PHE A 159 -4.065 17.524 1.859 1.00 0.32 H new ATOM 0 HD1 PHE A 159 -0.371 17.859 1.982 1.00 61.04 H new ATOM 0 HD2 PHE A 159 -3.834 16.490 4.088 1.00 1.42 H new ATOM 0 HE1 PHE A 159 0.942 17.703 4.048 1.00 3.44 H new ATOM 0 HE2 PHE A 159 -2.506 16.342 6.144 1.00 62.44 H new ATOM 0 HZ PHE A 159 -0.121 16.932 6.128 1.00 20.55 H new