USER MOD reduce.3.24.130724 H: found=0, std=0, add=1358, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1364 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 38 GLN : amide:sc= -7.34! C(o=-9.3!,f=-11!) USER MOD Set 1.2: B 39 THR OG1 : rot 107:sc= -1.95! USER MOD Set 2.1: A 82 THR OG1 : rot -119:sc= 0.404 USER MOD Set 2.2: A 86 ASN :FLIP amide:sc= -1.12 F(o=-7.8!,f=-1.1) USER MOD Set 2.3: B 8 MET CE :methyl 179:sc= -0.346 (180deg=-0.00471) USER MOD Set 3.1: A 38 GLN : amide:sc= -7.17! C(o=-9.1!,f=-11!) USER MOD Set 3.2: A 39 THR OG1 : rot 107:sc= -1.94! USER MOD Set 4.1: A 8 MET CE :methyl 179:sc= -0.125 (180deg=-0.00459) USER MOD Set 4.2: B 82 THR OG1 : rot -120:sc= 0.333 USER MOD Set 4.3: B 86 ASN :FLIP amide:sc= -0.832 F(o=-6.5!,f=-0.62) USER MOD Single : A 2 SER OG : rot -37:sc= 0.0752 USER MOD Single : A 6 THR OG1 : rot -15:sc= 0.341 USER MOD Single : A 10 THR OG1 : rot -160:sc= -3.01! USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 HIS : no HD1:sc= -1.06 X(o=-1.1,f=-1.1) USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 19 SER OG : rot 104:sc= -4.59! USER MOD Single : A 21 LYS NZ :NH3+ 147:sc= -0.144 (180deg=-0.942) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 176:sc= 0.693 (180deg=0.554) USER MOD Single : A 29 SER OG : rot -96:sc= 0.849 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -129:sc= -1.76 (180deg=-4.4!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot -46:sc= 0.777 USER MOD Single : A 43 SER OG : rot -39:sc= 0.765 USER MOD Single : A 48 GLN : amide:sc= -0.269 K(o=-0.27,f=-1.7) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 164:sc= -0.0332 (180deg=-0.38) USER MOD Single : A 58 MET CE :methyl 159:sc= -1.41 (180deg=-1.65) USER MOD Single : A 59 LYS NZ :NH3+ -149:sc= -0.174 (180deg=-0.946) USER MOD Single : A 64 ASN : amide:sc= -0.099 K(o=-0.099,f=-2.1!) USER MOD Single : A 72 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 85 CYS SG : rot 81:sc= 0.541 USER MOD Single : A 87 ASN : amide:sc= -0.259 K(o=-0.26,f=-2.1) USER MOD Single : B 2 SER OG : rot -38:sc= 0.0887 USER MOD Single : B 6 THR OG1 : rot -14:sc= 0.233 USER MOD Single : B 10 THR OG1 : rot -162:sc= -3.24! USER MOD Single : B 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 16 HIS : no HD1:sc= -0.908 X(o=-0.91,f=-1) USER MOD Single : B 18 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : B 19 SER OG : rot 106:sc= -4.52! USER MOD Single : B 21 LYS NZ :NH3+ 149:sc= -0.146 (180deg=-0.846) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ 161:sc= 0.843 (180deg=0.589) USER MOD Single : B 29 SER OG : rot -96:sc= 0.859 USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 LYS NZ :NH3+ -131:sc= -1.68 (180deg=-4.2!) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 SER OG : rot -23:sc= 0.795 USER MOD Single : B 43 SER OG : rot -36:sc= 0.776 USER MOD Single : B 48 GLN : amide:sc= -0.232 K(o=-0.23,f=-1.8) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 162:sc= -0.0449 (180deg=-0.535) USER MOD Single : B 58 MET CE :methyl 171:sc= -1.46 (180deg=-1.7) USER MOD Single : B 59 LYS NZ :NH3+ -152:sc= -0.173 (180deg=-0.937) USER MOD Single : B 64 ASN : amide:sc= -0.166 K(o=-0.17,f=-2.1!) USER MOD Single : B 72 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : B 85 CYS SG : rot 83:sc= 0.514 USER MOD Single : B 87 ASN : amide:sc= -0.302 K(o=-0.3,f=-2!) USER MOD Single : C 6 HIS : no HE2:sc= 0.132 K(o=0.13,f=-1.1) USER MOD Single : C 7 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.136) USER MOD Single : C 10 SER OG : rot -95:sc= 0.891 USER MOD Single : D 6 HIS : no HE2:sc= 0.101 K(o=0.1,f=-1.2) USER MOD Single : D 7 LYS NZ :NH3+ -166:sc= -0.422 (180deg=-1.02) USER MOD Single : D 10 SER OG : rot -88:sc= 1.01 USER MOD ----------------------------------------------------------------- ATOM 97 N HIS C 6 78.404 8.877 5.628 1.00 0.00 N ATOM 98 CA HIS C 6 79.159 9.563 6.715 1.00 0.00 C ATOM 99 C HIS C 6 79.003 11.079 6.599 1.00 0.00 C ATOM 100 O HIS C 6 78.897 11.774 7.590 1.00 0.00 O ATOM 101 CB HIS C 6 80.640 9.188 6.624 1.00 0.00 C ATOM 102 CG HIS C 6 80.820 7.763 7.074 1.00 0.00 C ATOM 103 ND1 HIS C 6 79.763 6.865 7.117 1.00 0.00 N ATOM 104 CD2 HIS C 6 81.921 7.069 7.512 1.00 0.00 C ATOM 105 CE1 HIS C 6 80.244 5.693 7.568 1.00 0.00 C ATOM 106 NE2 HIS C 6 81.551 5.764 7.823 1.00 0.00 N ATOM 0 HA HIS C 6 78.759 9.244 7.677 1.00 0.00 H new ATOM 0 HB2 HIS C 6 80.995 9.306 5.600 1.00 0.00 H new ATOM 0 HB3 HIS C 6 81.235 9.856 7.246 1.00 0.00 H new ATOM 0 HD1 HIS C 6 78.797 7.059 6.854 1.00 0.00 H new ATOM 0 HD2 HIS C 6 82.919 7.473 7.601 1.00 0.00 H new ATOM 0 HE1 HIS C 6 79.646 4.804 7.707 1.00 0.00 H new ATOM 115 N LYS C 7 79.010 11.611 5.409 1.00 0.00 N ATOM 116 CA LYS C 7 78.888 13.088 5.273 1.00 0.00 C ATOM 117 C LYS C 7 77.568 13.565 5.890 1.00 0.00 C ATOM 118 O LYS C 7 77.549 14.492 6.672 1.00 0.00 O ATOM 119 CB LYS C 7 78.913 13.469 3.789 1.00 0.00 C ATOM 120 CG LYS C 7 78.809 14.992 3.651 1.00 0.00 C ATOM 121 CD LYS C 7 79.035 15.405 2.191 1.00 0.00 C ATOM 122 CE LYS C 7 77.835 14.988 1.335 1.00 0.00 C ATOM 123 NZ LYS C 7 77.906 15.675 0.014 1.00 0.00 N ATOM 0 H LYS C 7 79.094 11.094 4.534 1.00 0.00 H new ATOM 0 HA LYS C 7 79.722 13.561 5.792 1.00 0.00 H new ATOM 0 HB2 LYS C 7 79.834 13.113 3.327 1.00 0.00 H new ATOM 0 HB3 LYS C 7 78.087 12.988 3.265 1.00 0.00 H new ATOM 0 HG2 LYS C 7 77.828 15.329 3.985 1.00 0.00 H new ATOM 0 HG3 LYS C 7 79.547 15.474 4.292 1.00 0.00 H new ATOM 0 HD2 LYS C 7 79.179 16.484 2.128 1.00 0.00 H new ATOM 0 HD3 LYS C 7 79.943 14.939 1.809 1.00 0.00 H new ATOM 0 HE2 LYS C 7 77.832 13.907 1.195 1.00 0.00 H new ATOM 0 HE3 LYS C 7 76.905 15.246 1.842 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 77.021 15.516 -0.508 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 78.043 16.696 0.160 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 78.704 15.294 -0.533 1.00 0.00 H new ATOM 137 N LEU C 8 76.462 12.956 5.548 1.00 0.00 N ATOM 138 CA LEU C 8 75.164 13.413 6.131 1.00 0.00 C ATOM 139 C LEU C 8 75.128 13.109 7.633 1.00 0.00 C ATOM 140 O LEU C 8 74.825 13.964 8.440 1.00 0.00 O ATOM 141 CB LEU C 8 73.997 12.697 5.437 1.00 0.00 C ATOM 142 CG LEU C 8 72.653 13.171 6.026 1.00 0.00 C ATOM 143 CD1 LEU C 8 72.480 14.686 5.811 1.00 0.00 C ATOM 144 CD2 LEU C 8 71.506 12.411 5.340 1.00 0.00 C ATOM 0 H LEU C 8 76.400 12.172 4.899 1.00 0.00 H new ATOM 0 HA LEU C 8 75.070 14.488 5.979 1.00 0.00 H new ATOM 0 HB2 LEU C 8 74.024 12.898 4.366 1.00 0.00 H new ATOM 0 HB3 LEU C 8 74.097 11.619 5.562 1.00 0.00 H new ATOM 0 HG LEU C 8 72.638 12.969 7.097 1.00 0.00 H new ATOM 0 HD11 LEU C 8 71.527 15.007 6.232 1.00 0.00 H new ATOM 0 HD12 LEU C 8 73.292 15.219 6.305 1.00 0.00 H new ATOM 0 HD13 LEU C 8 72.498 14.906 4.744 1.00 0.00 H new ATOM 0 HD21 LEU C 8 70.553 12.742 5.752 1.00 0.00 H new ATOM 0 HD22 LEU C 8 71.527 12.611 4.269 1.00 0.00 H new ATOM 0 HD23 LEU C 8 71.624 11.341 5.512 1.00 0.00 H new ATOM 156 N LEU C 9 75.416 11.893 8.013 1.00 0.00 N ATOM 157 CA LEU C 9 75.378 11.537 9.460 1.00 0.00 C ATOM 158 C LEU C 9 76.389 12.385 10.238 1.00 0.00 C ATOM 159 O LEU C 9 76.114 12.831 11.334 1.00 0.00 O ATOM 160 CB LEU C 9 75.713 10.042 9.629 1.00 0.00 C ATOM 161 CG LEU C 9 74.511 9.131 9.274 1.00 0.00 C ATOM 162 CD1 LEU C 9 73.575 8.998 10.481 1.00 0.00 C ATOM 163 CD2 LEU C 9 73.717 9.676 8.072 1.00 0.00 C ATOM 0 H LEU C 9 75.675 11.132 7.385 1.00 0.00 H new ATOM 0 HA LEU C 9 74.380 11.733 9.851 1.00 0.00 H new ATOM 0 HB2 LEU C 9 76.561 9.787 8.993 1.00 0.00 H new ATOM 0 HB3 LEU C 9 76.018 9.854 10.658 1.00 0.00 H new ATOM 0 HG LEU C 9 74.911 8.154 9.004 1.00 0.00 H new ATOM 0 HD11 LEU C 9 72.734 8.356 10.220 1.00 0.00 H new ATOM 0 HD12 LEU C 9 74.120 8.560 11.318 1.00 0.00 H new ATOM 0 HD13 LEU C 9 73.205 9.983 10.765 1.00 0.00 H new ATOM 0 HD21 LEU C 9 72.883 9.009 7.855 1.00 0.00 H new ATOM 0 HD22 LEU C 9 73.336 10.669 8.308 1.00 0.00 H new ATOM 0 HD23 LEU C 9 74.370 9.736 7.201 1.00 0.00 H new ATOM 175 N SER C 10 77.553 12.612 9.695 1.00 0.00 N ATOM 176 CA SER C 10 78.556 13.433 10.432 1.00 0.00 C ATOM 177 C SER C 10 78.211 14.918 10.300 1.00 0.00 C ATOM 178 O SER C 10 78.135 15.635 11.279 1.00 0.00 O ATOM 179 CB SER C 10 79.948 13.181 9.851 1.00 0.00 C ATOM 180 OG SER C 10 79.999 13.683 8.523 1.00 0.00 O ATOM 0 H SER C 10 77.852 12.269 8.782 1.00 0.00 H new ATOM 0 HA SER C 10 78.543 13.153 11.485 1.00 0.00 H new ATOM 0 HB2 SER C 10 80.705 13.668 10.466 1.00 0.00 H new ATOM 0 HB3 SER C 10 80.170 12.114 9.858 1.00 0.00 H new ATOM 0 HG SER C 10 79.809 12.958 7.892 1.00 0.00 H new ATOM 323 N HIS D 6 70.344 -7.936 -13.238 1.00 0.00 N ATOM 324 CA HIS D 6 70.111 -8.616 -14.542 1.00 0.00 C ATOM 325 C HIS D 6 70.039 -10.131 -14.350 1.00 0.00 C ATOM 326 O HIS D 6 69.252 -10.804 -14.984 1.00 0.00 O ATOM 327 CB HIS D 6 71.252 -8.277 -15.504 1.00 0.00 C ATOM 328 CG HIS D 6 71.109 -6.851 -15.960 1.00 0.00 C ATOM 329 ND1 HIS D 6 70.347 -5.928 -15.257 1.00 0.00 N ATOM 330 CD2 HIS D 6 71.613 -6.174 -17.045 1.00 0.00 C ATOM 331 CE1 HIS D 6 70.412 -4.760 -15.919 1.00 0.00 C ATOM 332 NE2 HIS D 6 71.168 -4.857 -17.013 1.00 0.00 N ATOM 0 HA HIS D 6 69.164 -8.269 -14.955 1.00 0.00 H new ATOM 0 HB2 HIS D 6 72.214 -8.419 -15.011 1.00 0.00 H new ATOM 0 HB3 HIS D 6 71.232 -8.949 -16.362 1.00 0.00 H new ATOM 0 HD1 HIS D 6 69.831 -6.104 -14.395 1.00 0.00 H new ATOM 0 HD2 HIS D 6 72.254 -6.598 -17.803 1.00 0.00 H new ATOM 0 HE1 HIS D 6 69.914 -3.855 -15.604 1.00 0.00 H new ATOM 341 N LYS D 7 70.858 -10.685 -13.502 1.00 0.00 N ATOM 342 CA LYS D 7 70.826 -12.162 -13.320 1.00 0.00 C ATOM 343 C LYS D 7 69.438 -12.604 -12.840 1.00 0.00 C ATOM 344 O LYS D 7 68.860 -13.520 -13.384 1.00 0.00 O ATOM 345 CB LYS D 7 71.865 -12.570 -12.271 1.00 0.00 C ATOM 346 CG LYS D 7 71.841 -14.093 -12.089 1.00 0.00 C ATOM 347 CD LYS D 7 73.005 -14.535 -11.190 1.00 0.00 C ATOM 348 CE LYS D 7 72.739 -14.122 -9.737 1.00 0.00 C ATOM 349 NZ LYS D 7 73.710 -14.809 -8.839 1.00 0.00 N ATOM 0 H LYS D 7 71.541 -10.186 -12.932 1.00 0.00 H new ATOM 0 HA LYS D 7 71.050 -12.639 -14.274 1.00 0.00 H new ATOM 0 HB2 LYS D 7 72.858 -12.246 -12.583 1.00 0.00 H new ATOM 0 HB3 LYS D 7 71.652 -12.077 -11.323 1.00 0.00 H new ATOM 0 HG2 LYS D 7 70.893 -14.399 -11.647 1.00 0.00 H new ATOM 0 HG3 LYS D 7 71.914 -14.584 -13.059 1.00 0.00 H new ATOM 0 HD2 LYS D 7 73.131 -15.616 -11.251 1.00 0.00 H new ATOM 0 HD3 LYS D 7 73.935 -14.085 -11.539 1.00 0.00 H new ATOM 0 HE2 LYS D 7 72.832 -13.041 -9.632 1.00 0.00 H new ATOM 0 HE3 LYS D 7 71.719 -14.383 -9.455 1.00 0.00 H new ATOM 0 HZ1 LYS D 7 73.391 -14.724 -7.853 1.00 0.00 H new ATOM 0 HZ2 LYS D 7 73.771 -15.815 -9.098 1.00 0.00 H new ATOM 0 HZ3 LYS D 7 74.647 -14.369 -8.939 1.00 0.00 H new ATOM 363 N LEU D 8 68.895 -11.977 -11.828 1.00 0.00 N ATOM 364 CA LEU D 8 67.547 -12.403 -11.341 1.00 0.00 C ATOM 365 C LEU D 8 66.485 -12.075 -12.394 1.00 0.00 C ATOM 366 O LEU D 8 65.679 -12.906 -12.758 1.00 0.00 O ATOM 367 CB LEU D 8 67.204 -11.673 -10.033 1.00 0.00 C ATOM 368 CG LEU D 8 65.820 -12.122 -9.521 1.00 0.00 C ATOM 369 CD1 LEU D 8 65.824 -13.635 -9.234 1.00 0.00 C ATOM 370 CD2 LEU D 8 65.481 -11.356 -8.236 1.00 0.00 C ATOM 0 H LEU D 8 69.319 -11.199 -11.323 1.00 0.00 H new ATOM 0 HA LEU D 8 67.564 -13.478 -11.162 1.00 0.00 H new ATOM 0 HB2 LEU D 8 67.964 -11.883 -9.280 1.00 0.00 H new ATOM 0 HB3 LEU D 8 67.207 -10.595 -10.197 1.00 0.00 H new ATOM 0 HG LEU D 8 65.071 -11.910 -10.284 1.00 0.00 H new ATOM 0 HD11 LEU D 8 64.842 -13.939 -8.873 1.00 0.00 H new ATOM 0 HD12 LEU D 8 66.059 -14.178 -10.149 1.00 0.00 H new ATOM 0 HD13 LEU D 8 66.574 -13.860 -8.476 1.00 0.00 H new ATOM 0 HD21 LEU D 8 64.503 -11.671 -7.872 1.00 0.00 H new ATOM 0 HD22 LEU D 8 66.236 -11.565 -7.478 1.00 0.00 H new ATOM 0 HD23 LEU D 8 65.463 -10.286 -8.444 1.00 0.00 H new ATOM 382 N LEU D 9 66.469 -10.860 -12.870 1.00 0.00 N ATOM 383 CA LEU D 9 65.449 -10.464 -13.882 1.00 0.00 C ATOM 384 C LEU D 9 65.604 -11.319 -15.146 1.00 0.00 C ATOM 385 O LEU D 9 64.630 -11.735 -15.740 1.00 0.00 O ATOM 386 CB LEU D 9 65.630 -8.974 -14.234 1.00 0.00 C ATOM 387 CG LEU D 9 65.010 -8.044 -13.159 1.00 0.00 C ATOM 388 CD1 LEU D 9 63.502 -7.897 -13.387 1.00 0.00 C ATOM 389 CD2 LEU D 9 65.248 -8.581 -11.739 1.00 0.00 C ATOM 0 H LEU D 9 67.120 -10.123 -12.601 1.00 0.00 H new ATOM 0 HA LEU D 9 64.452 -10.622 -13.470 1.00 0.00 H new ATOM 0 HB2 LEU D 9 66.692 -8.752 -14.336 1.00 0.00 H new ATOM 0 HB3 LEU D 9 65.167 -8.771 -15.200 1.00 0.00 H new ATOM 0 HG LEU D 9 65.498 -7.074 -13.252 1.00 0.00 H new ATOM 0 HD11 LEU D 9 63.081 -7.241 -12.625 1.00 0.00 H new ATOM 0 HD12 LEU D 9 63.323 -7.468 -14.373 1.00 0.00 H new ATOM 0 HD13 LEU D 9 63.028 -8.876 -13.326 1.00 0.00 H new ATOM 0 HD21 LEU D 9 64.799 -7.903 -11.013 1.00 0.00 H new ATOM 0 HD22 LEU D 9 64.794 -9.567 -11.642 1.00 0.00 H new ATOM 0 HD23 LEU D 9 66.319 -8.654 -11.553 1.00 0.00 H new ATOM 401 N SER D 10 66.810 -11.583 -15.567 1.00 0.00 N ATOM 402 CA SER D 10 66.992 -12.407 -16.795 1.00 0.00 C ATOM 403 C SER D 10 66.799 -13.889 -16.459 1.00 0.00 C ATOM 404 O SER D 10 66.049 -14.588 -17.111 1.00 0.00 O ATOM 405 CB SER D 10 68.400 -12.192 -17.346 1.00 0.00 C ATOM 406 OG SER D 10 69.348 -12.723 -16.431 1.00 0.00 O ATOM 0 H SER D 10 67.670 -11.267 -15.119 1.00 0.00 H new ATOM 0 HA SER D 10 66.256 -12.108 -17.541 1.00 0.00 H new ATOM 0 HB2 SER D 10 68.502 -12.679 -18.316 1.00 0.00 H new ATOM 0 HB3 SER D 10 68.584 -11.129 -17.502 1.00 0.00 H new ATOM 0 HG SER D 10 69.587 -12.037 -15.773 1.00 0.00 H new ATOM 462 N SER A 2 49.854 -9.268 7.869 1.00 0.00 N ATOM 463 CA SER A 2 49.128 -8.448 6.848 1.00 0.00 C ATOM 464 C SER A 2 49.642 -7.009 6.917 1.00 0.00 C ATOM 465 O SER A 2 49.277 -6.166 6.121 1.00 0.00 O ATOM 466 CB SER A 2 47.626 -8.478 7.141 1.00 0.00 C ATOM 467 OG SER A 2 47.385 -7.913 8.423 1.00 0.00 O ATOM 0 HA SER A 2 49.302 -8.853 5.851 1.00 0.00 H new ATOM 0 HB2 SER A 2 47.084 -7.920 6.377 1.00 0.00 H new ATOM 0 HB3 SER A 2 47.258 -9.503 7.108 1.00 0.00 H new ATOM 0 HG SER A 2 48.107 -8.169 9.034 1.00 0.00 H new ATOM 473 N GLU A 3 50.494 -6.723 7.866 1.00 0.00 N ATOM 474 CA GLU A 3 51.040 -5.341 7.986 1.00 0.00 C ATOM 475 C GLU A 3 51.972 -5.050 6.813 1.00 0.00 C ATOM 476 O GLU A 3 51.876 -4.031 6.173 1.00 0.00 O ATOM 477 CB GLU A 3 51.840 -5.215 9.285 1.00 0.00 C ATOM 478 CG GLU A 3 50.898 -5.310 10.488 1.00 0.00 C ATOM 479 CD GLU A 3 49.961 -4.100 10.511 1.00 0.00 C ATOM 480 OE1 GLU A 3 50.460 -2.986 10.489 1.00 0.00 O ATOM 481 OE2 GLU A 3 48.759 -4.308 10.547 1.00 0.00 O ATOM 0 H GLU A 3 50.835 -7.386 8.562 1.00 0.00 H new ATOM 0 HA GLU A 3 50.211 -4.634 7.987 1.00 0.00 H new ATOM 0 HB2 GLU A 3 52.592 -6.003 9.337 1.00 0.00 H new ATOM 0 HB3 GLU A 3 52.373 -4.264 9.303 1.00 0.00 H new ATOM 0 HG2 GLU A 3 50.317 -6.230 10.434 1.00 0.00 H new ATOM 0 HG3 GLU A 3 51.476 -5.351 11.411 1.00 0.00 H new ATOM 488 N LEU A 4 52.907 -5.913 6.565 1.00 0.00 N ATOM 489 CA LEU A 4 53.886 -5.657 5.469 1.00 0.00 C ATOM 490 C LEU A 4 53.142 -5.507 4.134 1.00 0.00 C ATOM 491 O LEU A 4 53.453 -4.654 3.326 1.00 0.00 O ATOM 492 CB LEU A 4 54.872 -6.829 5.410 1.00 0.00 C ATOM 493 CG LEU A 4 55.931 -6.642 4.291 1.00 0.00 C ATOM 494 CD1 LEU A 4 56.478 -5.211 4.271 1.00 0.00 C ATOM 495 CD2 LEU A 4 57.109 -7.591 4.545 1.00 0.00 C ATOM 0 H LEU A 4 53.041 -6.788 7.072 1.00 0.00 H new ATOM 0 HA LEU A 4 54.434 -4.734 5.660 1.00 0.00 H new ATOM 0 HB2 LEU A 4 55.375 -6.929 6.372 1.00 0.00 H new ATOM 0 HB3 LEU A 4 54.324 -7.756 5.239 1.00 0.00 H new ATOM 0 HG LEU A 4 55.448 -6.855 3.337 1.00 0.00 H new ATOM 0 HD11 LEU A 4 57.217 -5.115 3.476 1.00 0.00 H new ATOM 0 HD12 LEU A 4 55.661 -4.512 4.093 1.00 0.00 H new ATOM 0 HD13 LEU A 4 56.946 -4.987 5.230 1.00 0.00 H new ATOM 0 HD21 LEU A 4 57.855 -7.463 3.761 1.00 0.00 H new ATOM 0 HD22 LEU A 4 57.557 -7.364 5.513 1.00 0.00 H new ATOM 0 HD23 LEU A 4 56.753 -8.621 4.542 1.00 0.00 H new ATOM 507 N GLU A 5 52.138 -6.313 3.917 1.00 0.00 N ATOM 508 CA GLU A 5 51.337 -6.214 2.659 1.00 0.00 C ATOM 509 C GLU A 5 50.870 -4.771 2.478 1.00 0.00 C ATOM 510 O GLU A 5 51.015 -4.166 1.427 1.00 0.00 O ATOM 511 CB GLU A 5 50.098 -7.106 2.825 1.00 0.00 C ATOM 512 CG GLU A 5 49.265 -7.084 1.541 1.00 0.00 C ATOM 513 CD GLU A 5 48.070 -8.029 1.690 1.00 0.00 C ATOM 514 OE1 GLU A 5 48.049 -8.778 2.653 1.00 0.00 O ATOM 515 OE2 GLU A 5 47.200 -7.994 0.835 1.00 0.00 O ATOM 0 H GLU A 5 51.835 -7.043 4.562 1.00 0.00 H new ATOM 0 HA GLU A 5 51.933 -6.522 1.800 1.00 0.00 H new ATOM 0 HB2 GLU A 5 50.402 -8.127 3.054 1.00 0.00 H new ATOM 0 HB3 GLU A 5 49.497 -6.757 3.665 1.00 0.00 H new ATOM 0 HG2 GLU A 5 48.918 -6.071 1.338 1.00 0.00 H new ATOM 0 HG3 GLU A 5 49.878 -7.387 0.692 1.00 0.00 H new ATOM 522 N THR A 6 50.305 -4.219 3.511 1.00 0.00 N ATOM 523 CA THR A 6 49.810 -2.823 3.447 1.00 0.00 C ATOM 524 C THR A 6 50.965 -1.857 3.214 1.00 0.00 C ATOM 525 O THR A 6 50.805 -0.859 2.568 1.00 0.00 O ATOM 526 CB THR A 6 49.130 -2.469 4.764 1.00 0.00 C ATOM 527 OG1 THR A 6 50.018 -2.711 5.841 1.00 0.00 O ATOM 528 CG2 THR A 6 47.874 -3.318 4.935 1.00 0.00 C ATOM 0 H THR A 6 50.164 -4.683 4.408 1.00 0.00 H new ATOM 0 HA THR A 6 49.103 -2.741 2.621 1.00 0.00 H new ATOM 0 HB THR A 6 48.855 -1.414 4.755 1.00 0.00 H new ATOM 0 HG1 THR A 6 50.767 -3.261 5.530 1.00 0.00 H new ATOM 0 HG21 THR A 6 47.389 -3.064 5.877 1.00 0.00 H new ATOM 0 HG22 THR A 6 47.189 -3.124 4.110 1.00 0.00 H new ATOM 0 HG23 THR A 6 48.146 -4.373 4.940 1.00 0.00 H new ATOM 536 N ALA A 7 52.115 -2.144 3.750 1.00 0.00 N ATOM 537 CA ALA A 7 53.288 -1.228 3.579 1.00 0.00 C ATOM 538 C ALA A 7 53.459 -0.864 2.099 1.00 0.00 C ATOM 539 O ALA A 7 53.564 0.288 1.747 1.00 0.00 O ATOM 540 CB ALA A 7 54.550 -1.929 4.087 1.00 0.00 C ATOM 0 H ALA A 7 52.300 -2.979 4.305 1.00 0.00 H new ATOM 0 HA ALA A 7 53.120 -0.314 4.149 1.00 0.00 H new ATOM 0 HB1 ALA A 7 55.408 -1.267 3.965 1.00 0.00 H new ATOM 0 HB2 ALA A 7 54.429 -2.176 5.142 1.00 0.00 H new ATOM 0 HB3 ALA A 7 54.713 -2.843 3.516 1.00 0.00 H new ATOM 546 N MET A 8 53.498 -1.833 1.230 1.00 0.00 N ATOM 547 CA MET A 8 53.666 -1.516 -0.211 1.00 0.00 C ATOM 548 C MET A 8 52.502 -0.636 -0.675 1.00 0.00 C ATOM 549 O MET A 8 52.678 0.289 -1.443 1.00 0.00 O ATOM 550 CB MET A 8 53.672 -2.821 -1.006 1.00 0.00 C ATOM 551 CG MET A 8 53.989 -2.530 -2.471 1.00 0.00 C ATOM 552 SD MET A 8 54.003 -4.088 -3.395 1.00 0.00 S ATOM 553 CE MET A 8 54.245 -3.379 -5.042 1.00 0.00 C ATOM 0 H MET A 8 53.421 -2.825 1.454 1.00 0.00 H new ATOM 0 HA MET A 8 54.604 -0.984 -0.370 1.00 0.00 H new ATOM 0 HB2 MET A 8 54.412 -3.506 -0.593 1.00 0.00 H new ATOM 0 HB3 MET A 8 52.702 -3.312 -0.924 1.00 0.00 H new ATOM 0 HG2 MET A 8 53.245 -1.852 -2.889 1.00 0.00 H new ATOM 0 HG3 MET A 8 54.956 -2.034 -2.555 1.00 0.00 H new ATOM 0 HE1 MET A 8 54.302 -4.181 -5.778 1.00 0.00 H new ATOM 0 HE2 MET A 8 53.408 -2.724 -5.283 1.00 0.00 H new ATOM 0 HE3 MET A 8 55.171 -2.805 -5.058 1.00 0.00 H new ATOM 563 N GLU A 9 51.314 -0.922 -0.222 1.00 0.00 N ATOM 564 CA GLU A 9 50.129 -0.105 -0.646 1.00 0.00 C ATOM 565 C GLU A 9 50.276 1.383 -0.247 1.00 0.00 C ATOM 566 O GLU A 9 49.903 2.270 -0.989 1.00 0.00 O ATOM 567 CB GLU A 9 48.881 -0.688 0.025 1.00 0.00 C ATOM 568 CG GLU A 9 47.631 0.072 -0.427 1.00 0.00 C ATOM 569 CD GLU A 9 46.399 -0.543 0.240 1.00 0.00 C ATOM 570 OE1 GLU A 9 46.559 -1.533 0.935 1.00 0.00 O ATOM 571 OE2 GLU A 9 45.317 -0.014 0.044 1.00 0.00 O ATOM 0 H GLU A 9 51.106 -1.684 0.423 1.00 0.00 H new ATOM 0 HA GLU A 9 50.051 -0.146 -1.732 1.00 0.00 H new ATOM 0 HB2 GLU A 9 48.784 -1.744 -0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 9 48.980 -0.627 1.109 1.00 0.00 H new ATOM 0 HG2 GLU A 9 47.715 1.126 -0.161 1.00 0.00 H new ATOM 0 HG3 GLU A 9 47.534 0.024 -1.512 1.00 0.00 H new ATOM 578 N THR A 10 50.773 1.658 0.928 1.00 0.00 N ATOM 579 CA THR A 10 50.890 3.085 1.381 1.00 0.00 C ATOM 580 C THR A 10 52.009 3.806 0.639 1.00 0.00 C ATOM 581 O THR A 10 51.873 4.942 0.240 1.00 0.00 O ATOM 582 CB THR A 10 51.184 3.174 2.886 1.00 0.00 C ATOM 583 OG1 THR A 10 51.766 4.435 3.158 1.00 0.00 O ATOM 584 CG2 THR A 10 52.164 2.098 3.324 1.00 0.00 C ATOM 0 H THR A 10 51.104 0.962 1.597 1.00 0.00 H new ATOM 0 HA THR A 10 49.932 3.559 1.165 1.00 0.00 H new ATOM 0 HB THR A 10 50.247 3.038 3.427 1.00 0.00 H new ATOM 0 HG1 THR A 10 52.238 4.399 4.016 1.00 0.00 H new ATOM 0 HG21 THR A 10 52.350 2.189 4.394 1.00 0.00 H new ATOM 0 HG22 THR A 10 51.744 1.115 3.111 1.00 0.00 H new ATOM 0 HG23 THR A 10 53.102 2.217 2.781 1.00 0.00 H new ATOM 592 N LEU A 11 53.127 3.157 0.479 1.00 0.00 N ATOM 593 CA LEU A 11 54.279 3.800 -0.200 1.00 0.00 C ATOM 594 C LEU A 11 53.864 4.271 -1.591 1.00 0.00 C ATOM 595 O LEU A 11 54.250 5.325 -2.030 1.00 0.00 O ATOM 596 CB LEU A 11 55.399 2.758 -0.379 1.00 0.00 C ATOM 597 CG LEU A 11 55.983 2.326 0.977 1.00 0.00 C ATOM 598 CD1 LEU A 11 56.893 1.108 0.758 1.00 0.00 C ATOM 599 CD2 LEU A 11 56.800 3.481 1.615 1.00 0.00 C ATOM 0 H LEU A 11 53.291 2.201 0.793 1.00 0.00 H new ATOM 0 HA LEU A 11 54.617 4.644 0.401 1.00 0.00 H new ATOM 0 HB2 LEU A 11 55.007 1.886 -0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 11 56.190 3.175 -1.002 1.00 0.00 H new ATOM 0 HG LEU A 11 55.167 2.070 1.653 1.00 0.00 H new ATOM 0 HD11 LEU A 11 57.314 0.792 1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 11 56.311 0.292 0.329 1.00 0.00 H new ATOM 0 HD13 LEU A 11 57.701 1.375 0.076 1.00 0.00 H new ATOM 0 HD21 LEU A 11 57.204 3.155 2.573 1.00 0.00 H new ATOM 0 HD22 LEU A 11 57.619 3.757 0.951 1.00 0.00 H new ATOM 0 HD23 LEU A 11 56.151 4.343 1.770 1.00 0.00 H new ATOM 611 N ILE A 12 53.106 3.482 -2.291 1.00 0.00 N ATOM 612 CA ILE A 12 52.687 3.858 -3.675 1.00 0.00 C ATOM 613 C ILE A 12 51.530 4.870 -3.662 1.00 0.00 C ATOM 614 O ILE A 12 51.388 5.651 -4.581 1.00 0.00 O ATOM 615 CB ILE A 12 52.281 2.595 -4.430 1.00 0.00 C ATOM 616 CG1 ILE A 12 53.418 1.571 -4.330 1.00 0.00 C ATOM 617 CG2 ILE A 12 52.016 2.939 -5.898 1.00 0.00 C ATOM 618 CD1 ILE A 12 52.993 0.266 -4.993 1.00 0.00 C ATOM 0 H ILE A 12 52.752 2.582 -1.965 1.00 0.00 H new ATOM 0 HA ILE A 12 53.528 4.337 -4.176 1.00 0.00 H new ATOM 0 HB ILE A 12 51.373 2.177 -3.996 1.00 0.00 H new ATOM 0 HG12 ILE A 12 54.315 1.960 -4.813 1.00 0.00 H new ATOM 0 HG13 ILE A 12 53.670 1.394 -3.284 1.00 0.00 H new ATOM 0 HG21 ILE A 12 51.726 2.037 -6.437 1.00 0.00 H new ATOM 0 HG22 ILE A 12 51.212 3.673 -5.960 1.00 0.00 H new ATOM 0 HG23 ILE A 12 52.921 3.353 -6.344 1.00 0.00 H new ATOM 0 HD11 ILE A 12 53.803 -0.460 -4.920 1.00 0.00 H new ATOM 0 HD12 ILE A 12 52.109 -0.126 -4.491 1.00 0.00 H new ATOM 0 HD13 ILE A 12 52.763 0.449 -6.043 1.00 0.00 H new ATOM 630 N ASN A 13 50.714 4.892 -2.654 1.00 0.00 N ATOM 631 CA ASN A 13 49.601 5.882 -2.641 1.00 0.00 C ATOM 632 C ASN A 13 50.180 7.300 -2.632 1.00 0.00 C ATOM 633 O ASN A 13 49.678 8.199 -3.275 1.00 0.00 O ATOM 634 CB ASN A 13 48.738 5.665 -1.398 1.00 0.00 C ATOM 635 CG ASN A 13 47.618 6.704 -1.369 1.00 0.00 C ATOM 636 OD1 ASN A 13 47.577 7.545 -0.494 1.00 0.00 O ATOM 637 ND2 ASN A 13 46.703 6.684 -2.298 1.00 0.00 N ATOM 0 H ASN A 13 50.764 4.275 -1.843 1.00 0.00 H new ATOM 0 HA ASN A 13 48.985 5.751 -3.531 1.00 0.00 H new ATOM 0 HB2 ASN A 13 48.316 4.660 -1.406 1.00 0.00 H new ATOM 0 HB3 ASN A 13 49.349 5.748 -0.499 1.00 0.00 H new ATOM 0 HD21 ASN A 13 45.953 7.375 -2.290 1.00 0.00 H new ATOM 0 HD22 ASN A 13 46.738 5.977 -3.033 1.00 0.00 H new ATOM 644 N VAL A 14 51.226 7.492 -1.883 1.00 0.00 N ATOM 645 CA VAL A 14 51.853 8.847 -1.793 1.00 0.00 C ATOM 646 C VAL A 14 52.840 9.091 -2.944 1.00 0.00 C ATOM 647 O VAL A 14 53.010 10.205 -3.399 1.00 0.00 O ATOM 648 CB VAL A 14 52.585 8.984 -0.459 1.00 0.00 C ATOM 649 CG1 VAL A 14 51.557 9.071 0.672 1.00 0.00 C ATOM 650 CG2 VAL A 14 53.523 7.787 -0.225 1.00 0.00 C ATOM 0 H VAL A 14 51.680 6.769 -1.325 1.00 0.00 H new ATOM 0 HA VAL A 14 51.059 9.590 -1.865 1.00 0.00 H new ATOM 0 HB VAL A 14 53.190 9.891 -0.479 1.00 0.00 H new ATOM 0 HG11 VAL A 14 52.074 9.169 1.627 1.00 0.00 H new ATOM 0 HG12 VAL A 14 50.916 9.939 0.515 1.00 0.00 H new ATOM 0 HG13 VAL A 14 50.948 8.167 0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 14 54.033 7.906 0.731 1.00 0.00 H new ATOM 0 HG22 VAL A 14 52.941 6.866 -0.213 1.00 0.00 H new ATOM 0 HG23 VAL A 14 54.260 7.740 -1.027 1.00 0.00 H new ATOM 660 N PHE A 15 53.508 8.071 -3.396 1.00 0.00 N ATOM 661 CA PHE A 15 54.505 8.242 -4.492 1.00 0.00 C ATOM 662 C PHE A 15 53.834 8.792 -5.749 1.00 0.00 C ATOM 663 O PHE A 15 54.252 9.779 -6.313 1.00 0.00 O ATOM 664 CB PHE A 15 55.120 6.854 -4.809 1.00 0.00 C ATOM 665 CG PHE A 15 56.628 6.953 -4.887 1.00 0.00 C ATOM 666 CD1 PHE A 15 57.220 7.958 -5.659 1.00 0.00 C ATOM 667 CD2 PHE A 15 57.428 6.055 -4.168 1.00 0.00 C ATOM 668 CE1 PHE A 15 58.611 8.062 -5.715 1.00 0.00 C ATOM 669 CE2 PHE A 15 58.818 6.166 -4.222 1.00 0.00 C ATOM 670 CZ PHE A 15 59.407 7.169 -4.995 1.00 0.00 C ATOM 0 H PHE A 15 53.407 7.116 -3.052 1.00 0.00 H new ATOM 0 HA PHE A 15 55.275 8.945 -4.175 1.00 0.00 H new ATOM 0 HB2 PHE A 15 54.835 6.138 -4.038 1.00 0.00 H new ATOM 0 HB3 PHE A 15 54.724 6.480 -5.753 1.00 0.00 H new ATOM 0 HD1 PHE A 15 56.603 8.652 -6.210 1.00 0.00 H new ATOM 0 HD2 PHE A 15 56.970 5.279 -3.573 1.00 0.00 H new ATOM 0 HE1 PHE A 15 59.071 8.833 -6.315 1.00 0.00 H new ATOM 0 HE2 PHE A 15 59.437 5.477 -3.667 1.00 0.00 H new ATOM 0 HZ PHE A 15 60.483 7.254 -5.036 1.00 0.00 H new ATOM 680 N HIS A 16 52.819 8.124 -6.201 1.00 0.00 N ATOM 681 CA HIS A 16 52.127 8.553 -7.443 1.00 0.00 C ATOM 682 C HIS A 16 51.277 9.800 -7.203 1.00 0.00 C ATOM 683 O HIS A 16 50.959 10.515 -8.132 1.00 0.00 O ATOM 684 CB HIS A 16 51.229 7.418 -7.937 1.00 0.00 C ATOM 685 CG HIS A 16 52.069 6.260 -8.416 1.00 0.00 C ATOM 686 ND1 HIS A 16 51.636 4.945 -8.297 1.00 0.00 N ATOM 687 CD2 HIS A 16 53.305 6.191 -9.020 1.00 0.00 C ATOM 688 CE1 HIS A 16 52.592 4.152 -8.815 1.00 0.00 C ATOM 689 NE2 HIS A 16 53.626 4.861 -9.267 1.00 0.00 N ATOM 0 H HIS A 16 52.433 7.289 -5.760 1.00 0.00 H new ATOM 0 HA HIS A 16 52.883 8.793 -8.191 1.00 0.00 H new ATOM 0 HB2 HIS A 16 50.569 7.090 -7.133 1.00 0.00 H new ATOM 0 HB3 HIS A 16 50.592 7.774 -8.747 1.00 0.00 H new ATOM 0 HD2 HIS A 16 53.928 7.039 -9.264 1.00 0.00 H new ATOM 0 HE1 HIS A 16 52.529 3.075 -8.859 1.00 0.00 H new ATOM 0 HE2 HIS A 16 54.476 4.503 -9.703 1.00 0.00 H new ATOM 698 N ALA A 17 50.870 10.069 -5.990 1.00 0.00 N ATOM 699 CA ALA A 17 50.011 11.265 -5.772 1.00 0.00 C ATOM 700 C ALA A 17 50.826 12.563 -5.840 1.00 0.00 C ATOM 701 O ALA A 17 50.546 13.429 -6.645 1.00 0.00 O ATOM 702 CB ALA A 17 49.338 11.159 -4.401 1.00 0.00 C ATOM 0 H ALA A 17 51.091 9.523 -5.157 1.00 0.00 H new ATOM 0 HA ALA A 17 49.261 11.295 -6.562 1.00 0.00 H new ATOM 0 HB1 ALA A 17 48.708 12.033 -4.237 1.00 0.00 H new ATOM 0 HB2 ALA A 17 48.726 10.258 -4.365 1.00 0.00 H new ATOM 0 HB3 ALA A 17 50.101 11.111 -3.624 1.00 0.00 H new ATOM 708 N HIS A 18 51.782 12.747 -4.972 1.00 0.00 N ATOM 709 CA HIS A 18 52.536 14.035 -4.970 1.00 0.00 C ATOM 710 C HIS A 18 53.436 14.179 -6.203 1.00 0.00 C ATOM 711 O HIS A 18 53.577 15.251 -6.756 1.00 0.00 O ATOM 712 CB HIS A 18 53.401 14.096 -3.712 1.00 0.00 C ATOM 713 CG HIS A 18 52.518 14.264 -2.508 1.00 0.00 C ATOM 714 ND1 HIS A 18 51.899 13.186 -1.890 1.00 0.00 N ATOM 715 CD2 HIS A 18 52.125 15.375 -1.804 1.00 0.00 C ATOM 716 CE1 HIS A 18 51.171 13.667 -0.866 1.00 0.00 C ATOM 717 NE2 HIS A 18 51.277 14.994 -0.772 1.00 0.00 N ATOM 0 H HIS A 18 52.073 12.068 -4.269 1.00 0.00 H new ATOM 0 HA HIS A 18 51.812 14.850 -4.990 1.00 0.00 H new ATOM 0 HB2 HIS A 18 53.992 13.185 -3.619 1.00 0.00 H new ATOM 0 HB3 HIS A 18 54.104 14.926 -3.780 1.00 0.00 H new ATOM 0 HD2 HIS A 18 52.428 16.389 -2.019 1.00 0.00 H new ATOM 0 HE1 HIS A 18 50.576 13.056 -0.203 1.00 0.00 H new ATOM 0 HE2 HIS A 18 50.829 15.601 -0.086 1.00 0.00 H new ATOM 726 N SER A 19 54.078 13.119 -6.615 1.00 0.00 N ATOM 727 CA SER A 19 55.008 13.200 -7.780 1.00 0.00 C ATOM 728 C SER A 19 54.298 13.708 -9.030 1.00 0.00 C ATOM 729 O SER A 19 54.932 14.176 -9.955 1.00 0.00 O ATOM 730 CB SER A 19 55.565 11.811 -8.073 1.00 0.00 C ATOM 731 OG SER A 19 56.428 11.414 -7.017 1.00 0.00 O ATOM 0 H SER A 19 53.998 12.194 -6.192 1.00 0.00 H new ATOM 0 HA SER A 19 55.806 13.897 -7.524 1.00 0.00 H new ATOM 0 HB2 SER A 19 54.750 11.096 -8.179 1.00 0.00 H new ATOM 0 HB3 SER A 19 56.108 11.817 -9.018 1.00 0.00 H new ATOM 0 HG SER A 19 55.969 10.763 -6.446 1.00 0.00 H new ATOM 737 N GLY A 20 53.001 13.606 -9.082 1.00 0.00 N ATOM 738 CA GLY A 20 52.247 14.072 -10.294 1.00 0.00 C ATOM 739 C GLY A 20 51.361 15.262 -9.935 1.00 0.00 C ATOM 740 O GLY A 20 50.414 15.565 -10.634 1.00 0.00 O ATOM 0 H GLY A 20 52.421 13.219 -8.337 1.00 0.00 H new ATOM 0 HA2 GLY A 20 52.947 14.354 -11.081 1.00 0.00 H new ATOM 0 HA3 GLY A 20 51.636 13.259 -10.687 1.00 0.00 H new ATOM 744 N LYS A 21 51.651 15.955 -8.866 1.00 0.00 N ATOM 745 CA LYS A 21 50.796 17.126 -8.521 1.00 0.00 C ATOM 746 C LYS A 21 51.097 18.252 -9.511 1.00 0.00 C ATOM 747 O LYS A 21 50.208 18.867 -10.067 1.00 0.00 O ATOM 748 CB LYS A 21 51.085 17.585 -7.085 1.00 0.00 C ATOM 749 CG LYS A 21 50.063 18.652 -6.647 1.00 0.00 C ATOM 750 CD LYS A 21 48.781 17.981 -6.107 1.00 0.00 C ATOM 751 CE LYS A 21 48.929 17.691 -4.609 1.00 0.00 C ATOM 752 NZ LYS A 21 49.047 18.978 -3.865 1.00 0.00 N ATOM 0 H LYS A 21 52.425 15.767 -8.230 1.00 0.00 H new ATOM 0 HA LYS A 21 49.743 16.852 -8.583 1.00 0.00 H new ATOM 0 HB2 LYS A 21 51.042 16.732 -6.408 1.00 0.00 H new ATOM 0 HB3 LYS A 21 52.094 17.992 -7.022 1.00 0.00 H new ATOM 0 HG2 LYS A 21 50.500 19.288 -5.877 1.00 0.00 H new ATOM 0 HG3 LYS A 21 49.816 19.296 -7.491 1.00 0.00 H new ATOM 0 HD2 LYS A 21 47.922 18.631 -6.276 1.00 0.00 H new ATOM 0 HD3 LYS A 21 48.591 17.054 -6.648 1.00 0.00 H new ATOM 0 HE2 LYS A 21 48.068 17.128 -4.249 1.00 0.00 H new ATOM 0 HE3 LYS A 21 49.810 17.074 -4.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 48.605 18.880 -2.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 50.051 19.222 -3.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 48.567 19.732 -4.397 1.00 0.00 H new ATOM 822 N TYR A 26 54.894 10.950 -13.740 1.00 0.00 N ATOM 823 CA TYR A 26 55.524 10.130 -12.660 1.00 0.00 C ATOM 824 C TYR A 26 57.052 10.248 -12.690 1.00 0.00 C ATOM 825 O TYR A 26 57.767 9.285 -12.887 1.00 0.00 O ATOM 826 CB TYR A 26 55.105 8.662 -12.786 1.00 0.00 C ATOM 827 CG TYR A 26 53.594 8.556 -12.753 1.00 0.00 C ATOM 828 CD1 TYR A 26 52.893 8.917 -11.596 1.00 0.00 C ATOM 829 CD2 TYR A 26 52.897 8.094 -13.878 1.00 0.00 C ATOM 830 CE1 TYR A 26 51.495 8.817 -11.565 1.00 0.00 C ATOM 831 CE2 TYR A 26 51.502 7.995 -13.846 1.00 0.00 C ATOM 832 CZ TYR A 26 50.800 8.356 -12.690 1.00 0.00 C ATOM 833 OH TYR A 26 49.425 8.258 -12.661 1.00 0.00 O ATOM 0 HA TYR A 26 55.173 10.517 -11.703 1.00 0.00 H new ATOM 0 HB2 TYR A 26 55.488 8.243 -13.717 1.00 0.00 H new ATOM 0 HB3 TYR A 26 55.538 8.079 -11.973 1.00 0.00 H new ATOM 0 HD1 TYR A 26 53.429 9.272 -10.728 1.00 0.00 H new ATOM 0 HD2 TYR A 26 53.437 7.814 -14.770 1.00 0.00 H new ATOM 0 HE1 TYR A 26 50.954 9.096 -10.673 1.00 0.00 H new ATOM 0 HE2 TYR A 26 50.966 7.640 -14.714 1.00 0.00 H new ATOM 0 HH TYR A 26 49.103 7.922 -13.524 1.00 0.00 H new ATOM 843 N LYS A 27 57.545 11.430 -12.428 1.00 0.00 N ATOM 844 CA LYS A 27 59.016 11.671 -12.354 1.00 0.00 C ATOM 845 C LYS A 27 59.217 12.613 -11.167 1.00 0.00 C ATOM 846 O LYS A 27 58.429 13.516 -10.970 1.00 0.00 O ATOM 847 CB LYS A 27 59.507 12.336 -13.644 1.00 0.00 C ATOM 848 CG LYS A 27 61.043 12.409 -13.659 1.00 0.00 C ATOM 849 CD LYS A 27 61.642 10.983 -13.640 1.00 0.00 C ATOM 850 CE LYS A 27 62.960 10.948 -14.419 1.00 0.00 C ATOM 851 NZ LYS A 27 63.476 9.549 -14.457 1.00 0.00 N ATOM 0 H LYS A 27 56.975 12.258 -12.258 1.00 0.00 H new ATOM 0 HA LYS A 27 59.574 10.742 -12.234 1.00 0.00 H new ATOM 0 HB2 LYS A 27 59.155 11.772 -14.508 1.00 0.00 H new ATOM 0 HB3 LYS A 27 59.088 13.339 -13.726 1.00 0.00 H new ATOM 0 HG2 LYS A 27 61.381 12.942 -14.548 1.00 0.00 H new ATOM 0 HG3 LYS A 27 61.397 12.972 -12.795 1.00 0.00 H new ATOM 0 HD2 LYS A 27 61.812 10.667 -12.611 1.00 0.00 H new ATOM 0 HD3 LYS A 27 60.935 10.279 -14.078 1.00 0.00 H new ATOM 0 HE2 LYS A 27 62.806 11.318 -15.433 1.00 0.00 H new ATOM 0 HE3 LYS A 27 63.691 11.604 -13.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 64.335 9.512 -15.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 63.701 9.236 -13.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 62.752 8.923 -14.864 1.00 0.00 H new ATOM 865 N LEU A 28 60.233 12.424 -10.353 1.00 0.00 N ATOM 866 CA LEU A 28 60.409 13.336 -9.176 1.00 0.00 C ATOM 867 C LEU A 28 61.421 14.417 -9.508 1.00 0.00 C ATOM 868 O LEU A 28 62.306 14.237 -10.312 1.00 0.00 O ATOM 869 CB LEU A 28 60.903 12.541 -7.955 1.00 0.00 C ATOM 870 CG LEU A 28 59.743 11.765 -7.303 1.00 0.00 C ATOM 871 CD1 LEU A 28 58.784 12.717 -6.555 1.00 0.00 C ATOM 872 CD2 LEU A 28 58.964 11.019 -8.379 1.00 0.00 C ATOM 0 H LEU A 28 60.936 11.691 -10.450 1.00 0.00 H new ATOM 0 HA LEU A 28 59.447 13.792 -8.944 1.00 0.00 H new ATOM 0 HB2 LEU A 28 61.686 11.846 -8.260 1.00 0.00 H new ATOM 0 HB3 LEU A 28 61.346 13.221 -7.227 1.00 0.00 H new ATOM 0 HG LEU A 28 60.165 11.063 -6.584 1.00 0.00 H new ATOM 0 HD11 LEU A 28 57.976 12.140 -6.106 1.00 0.00 H new ATOM 0 HD12 LEU A 28 59.331 13.245 -5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 28 58.367 13.439 -7.257 1.00 0.00 H new ATOM 0 HD21 LEU A 28 58.143 10.469 -7.919 1.00 0.00 H new ATOM 0 HD22 LEU A 28 58.564 11.733 -9.100 1.00 0.00 H new ATOM 0 HD23 LEU A 28 59.627 10.320 -8.890 1.00 0.00 H new ATOM 884 N SER A 29 61.283 15.534 -8.871 1.00 0.00 N ATOM 885 CA SER A 29 62.214 16.670 -9.077 1.00 0.00 C ATOM 886 C SER A 29 62.645 17.144 -7.698 1.00 0.00 C ATOM 887 O SER A 29 62.012 16.831 -6.710 1.00 0.00 O ATOM 888 CB SER A 29 61.492 17.803 -9.809 1.00 0.00 C ATOM 889 OG SER A 29 60.383 18.231 -9.031 1.00 0.00 O ATOM 0 H SER A 29 60.541 15.715 -8.195 1.00 0.00 H new ATOM 0 HA SER A 29 63.074 16.368 -9.675 1.00 0.00 H new ATOM 0 HB2 SER A 29 62.175 18.635 -9.979 1.00 0.00 H new ATOM 0 HB3 SER A 29 61.155 17.463 -10.788 1.00 0.00 H new ATOM 0 HG SER A 29 59.571 17.778 -9.342 1.00 0.00 H new ATOM 895 N LYS A 30 63.698 17.898 -7.605 1.00 0.00 N ATOM 896 CA LYS A 30 64.128 18.386 -6.258 1.00 0.00 C ATOM 897 C LYS A 30 62.911 18.942 -5.494 1.00 0.00 C ATOM 898 O LYS A 30 62.772 18.750 -4.301 1.00 0.00 O ATOM 899 CB LYS A 30 65.163 19.504 -6.443 1.00 0.00 C ATOM 900 CG LYS A 30 65.448 20.174 -5.095 1.00 0.00 C ATOM 901 CD LYS A 30 66.687 21.065 -5.206 1.00 0.00 C ATOM 902 CE LYS A 30 66.700 22.070 -4.053 1.00 0.00 C ATOM 903 NZ LYS A 30 68.024 22.747 -3.994 1.00 0.00 N ATOM 0 H LYS A 30 64.278 18.198 -8.388 1.00 0.00 H new ATOM 0 HA LYS A 30 64.563 17.563 -5.691 1.00 0.00 H new ATOM 0 HB2 LYS A 30 66.084 19.095 -6.858 1.00 0.00 H new ATOM 0 HB3 LYS A 30 64.792 20.241 -7.155 1.00 0.00 H new ATOM 0 HG2 LYS A 30 64.588 20.769 -4.786 1.00 0.00 H new ATOM 0 HG3 LYS A 30 65.603 19.415 -4.328 1.00 0.00 H new ATOM 0 HD2 LYS A 30 67.590 20.455 -5.180 1.00 0.00 H new ATOM 0 HD3 LYS A 30 66.685 21.591 -6.161 1.00 0.00 H new ATOM 0 HE2 LYS A 30 65.909 22.807 -4.191 1.00 0.00 H new ATOM 0 HE3 LYS A 30 66.499 21.560 -3.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 68.030 23.430 -3.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 68.770 22.038 -3.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 68.198 23.247 -4.889 1.00 0.00 H new ATOM 917 N LYS A 31 62.045 19.639 -6.176 1.00 0.00 N ATOM 918 CA LYS A 31 60.842 20.233 -5.512 1.00 0.00 C ATOM 919 C LYS A 31 59.830 19.155 -5.092 1.00 0.00 C ATOM 920 O LYS A 31 59.233 19.235 -4.036 1.00 0.00 O ATOM 921 CB LYS A 31 60.154 21.184 -6.491 1.00 0.00 C ATOM 922 CG LYS A 31 58.924 21.804 -5.822 1.00 0.00 C ATOM 923 CD LYS A 31 58.358 22.911 -6.715 1.00 0.00 C ATOM 924 CE LYS A 31 57.791 22.316 -8.011 1.00 0.00 C ATOM 925 NZ LYS A 31 58.897 22.097 -8.984 1.00 0.00 N ATOM 0 H LYS A 31 62.117 19.826 -7.176 1.00 0.00 H new ATOM 0 HA LYS A 31 61.178 20.758 -4.618 1.00 0.00 H new ATOM 0 HB2 LYS A 31 60.846 21.967 -6.801 1.00 0.00 H new ATOM 0 HB3 LYS A 31 59.859 20.645 -7.391 1.00 0.00 H new ATOM 0 HG2 LYS A 31 58.167 21.039 -5.649 1.00 0.00 H new ATOM 0 HG3 LYS A 31 59.194 22.211 -4.847 1.00 0.00 H new ATOM 0 HD2 LYS A 31 57.575 23.452 -6.183 1.00 0.00 H new ATOM 0 HD3 LYS A 31 59.140 23.633 -6.950 1.00 0.00 H new ATOM 0 HE2 LYS A 31 57.286 21.373 -7.800 1.00 0.00 H new ATOM 0 HE3 LYS A 31 57.046 22.988 -8.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 58.646 22.527 -9.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 59.769 22.535 -8.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 59.050 21.076 -9.112 1.00 0.00 H new ATOM 939 N GLU A 32 59.639 18.145 -5.895 1.00 0.00 N ATOM 940 CA GLU A 32 58.665 17.088 -5.504 1.00 0.00 C ATOM 941 C GLU A 32 59.252 16.299 -4.329 1.00 0.00 C ATOM 942 O GLU A 32 58.557 15.882 -3.427 1.00 0.00 O ATOM 943 CB GLU A 32 58.391 16.148 -6.682 1.00 0.00 C ATOM 944 CG GLU A 32 57.592 16.889 -7.760 1.00 0.00 C ATOM 945 CD GLU A 32 57.647 16.104 -9.073 1.00 0.00 C ATOM 946 OE1 GLU A 32 57.120 15.006 -9.110 1.00 0.00 O ATOM 947 OE2 GLU A 32 58.220 16.616 -10.021 1.00 0.00 O ATOM 0 H GLU A 32 60.107 18.006 -6.791 1.00 0.00 H new ATOM 0 HA GLU A 32 57.721 17.549 -5.213 1.00 0.00 H new ATOM 0 HB2 GLU A 32 59.332 15.786 -7.097 1.00 0.00 H new ATOM 0 HB3 GLU A 32 57.836 15.274 -6.341 1.00 0.00 H new ATOM 0 HG2 GLU A 32 56.557 17.010 -7.440 1.00 0.00 H new ATOM 0 HG3 GLU A 32 58.000 17.889 -7.906 1.00 0.00 H new ATOM 954 N LEU A 33 60.537 16.073 -4.375 1.00 0.00 N ATOM 955 CA LEU A 33 61.240 15.285 -3.317 1.00 0.00 C ATOM 956 C LEU A 33 61.116 15.912 -1.916 1.00 0.00 C ATOM 957 O LEU A 33 60.808 15.235 -0.956 1.00 0.00 O ATOM 958 CB LEU A 33 62.726 15.234 -3.709 1.00 0.00 C ATOM 959 CG LEU A 33 63.578 14.612 -2.594 1.00 0.00 C ATOM 960 CD1 LEU A 33 63.052 13.216 -2.274 1.00 0.00 C ATOM 961 CD2 LEU A 33 65.026 14.513 -3.078 1.00 0.00 C ATOM 0 H LEU A 33 61.146 16.410 -5.121 1.00 0.00 H new ATOM 0 HA LEU A 33 60.784 14.297 -3.259 1.00 0.00 H new ATOM 0 HB2 LEU A 33 62.843 14.654 -4.625 1.00 0.00 H new ATOM 0 HB3 LEU A 33 63.082 16.242 -3.922 1.00 0.00 H new ATOM 0 HG LEU A 33 63.528 15.230 -1.698 1.00 0.00 H new ATOM 0 HD11 LEU A 33 63.656 12.772 -1.482 1.00 0.00 H new ATOM 0 HD12 LEU A 33 62.015 13.284 -1.945 1.00 0.00 H new ATOM 0 HD13 LEU A 33 63.109 12.592 -3.166 1.00 0.00 H new ATOM 0 HD21 LEU A 33 65.642 14.072 -2.294 1.00 0.00 H new ATOM 0 HD22 LEU A 33 65.070 13.887 -3.969 1.00 0.00 H new ATOM 0 HD23 LEU A 33 65.399 15.509 -3.316 1.00 0.00 H new ATOM 973 N LYS A 34 61.414 17.173 -1.774 1.00 0.00 N ATOM 974 CA LYS A 34 61.378 17.796 -0.411 1.00 0.00 C ATOM 975 C LYS A 34 59.953 17.919 0.141 1.00 0.00 C ATOM 976 O LYS A 34 59.739 17.778 1.325 1.00 0.00 O ATOM 977 CB LYS A 34 62.048 19.172 -0.447 1.00 0.00 C ATOM 978 CG LYS A 34 61.419 20.046 -1.538 1.00 0.00 C ATOM 979 CD LYS A 34 62.385 21.177 -1.895 1.00 0.00 C ATOM 980 CE LYS A 34 62.635 22.048 -0.662 1.00 0.00 C ATOM 981 NZ LYS A 34 63.304 23.314 -1.073 1.00 0.00 N ATOM 0 H LYS A 34 61.680 17.800 -2.534 1.00 0.00 H new ATOM 0 HA LYS A 34 61.926 17.135 0.260 1.00 0.00 H new ATOM 0 HB2 LYS A 34 61.944 19.659 0.523 1.00 0.00 H new ATOM 0 HB3 LYS A 34 63.116 19.059 -0.634 1.00 0.00 H new ATOM 0 HG2 LYS A 34 61.201 19.445 -2.421 1.00 0.00 H new ATOM 0 HG3 LYS A 34 60.471 20.457 -1.190 1.00 0.00 H new ATOM 0 HD2 LYS A 34 63.326 20.764 -2.258 1.00 0.00 H new ATOM 0 HD3 LYS A 34 61.971 21.782 -2.702 1.00 0.00 H new ATOM 0 HE2 LYS A 34 61.692 22.269 -0.163 1.00 0.00 H new ATOM 0 HE3 LYS A 34 63.257 21.512 0.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 63.473 23.905 -0.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 64.212 23.094 -1.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 62.695 23.828 -1.741 1.00 0.00 H new ATOM 995 N ASP A 35 58.977 18.175 -0.675 1.00 0.00 N ATOM 996 CA ASP A 35 57.590 18.288 -0.141 1.00 0.00 C ATOM 997 C ASP A 35 57.108 16.896 0.263 1.00 0.00 C ATOM 998 O ASP A 35 56.377 16.727 1.219 1.00 0.00 O ATOM 999 CB ASP A 35 56.669 18.870 -1.215 1.00 0.00 C ATOM 1000 CG ASP A 35 55.314 19.218 -0.596 1.00 0.00 C ATOM 1001 OD1 ASP A 35 55.049 18.755 0.501 1.00 0.00 O ATOM 1002 OD2 ASP A 35 54.564 19.943 -1.230 1.00 0.00 O ATOM 0 H ASP A 35 59.073 18.311 -1.681 1.00 0.00 H new ATOM 0 HA ASP A 35 57.576 18.949 0.726 1.00 0.00 H new ATOM 0 HB2 ASP A 35 57.120 19.761 -1.651 1.00 0.00 H new ATOM 0 HB3 ASP A 35 56.537 18.151 -2.024 1.00 0.00 H new ATOM 1007 N LEU A 36 57.499 15.909 -0.481 1.00 0.00 N ATOM 1008 CA LEU A 36 57.068 14.515 -0.195 1.00 0.00 C ATOM 1009 C LEU A 36 57.635 13.995 1.139 1.00 0.00 C ATOM 1010 O LEU A 36 56.970 13.285 1.863 1.00 0.00 O ATOM 1011 CB LEU A 36 57.550 13.621 -1.344 1.00 0.00 C ATOM 1012 CG LEU A 36 57.135 12.162 -1.109 1.00 0.00 C ATOM 1013 CD1 LEU A 36 55.604 12.059 -1.005 1.00 0.00 C ATOM 1014 CD2 LEU A 36 57.632 11.317 -2.287 1.00 0.00 C ATOM 0 H LEU A 36 58.111 16.008 -1.291 1.00 0.00 H new ATOM 0 HA LEU A 36 55.981 14.496 -0.111 1.00 0.00 H new ATOM 0 HB2 LEU A 36 57.133 13.975 -2.286 1.00 0.00 H new ATOM 0 HB3 LEU A 36 58.635 13.686 -1.431 1.00 0.00 H new ATOM 0 HG LEU A 36 57.572 11.800 -0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 36 55.320 11.020 -0.838 1.00 0.00 H new ATOM 0 HD12 LEU A 36 55.254 12.669 -0.172 1.00 0.00 H new ATOM 0 HD13 LEU A 36 55.152 12.415 -1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 36 57.345 10.277 -2.135 1.00 0.00 H new ATOM 0 HD22 LEU A 36 57.187 11.685 -3.212 1.00 0.00 H new ATOM 0 HD23 LEU A 36 58.718 11.388 -2.353 1.00 0.00 H new ATOM 1026 N LEU A 37 58.867 14.295 1.454 1.00 0.00 N ATOM 1027 CA LEU A 37 59.467 13.763 2.725 1.00 0.00 C ATOM 1028 C LEU A 37 59.148 14.632 3.953 1.00 0.00 C ATOM 1029 O LEU A 37 58.917 14.126 5.033 1.00 0.00 O ATOM 1030 CB LEU A 37 60.986 13.676 2.561 1.00 0.00 C ATOM 1031 CG LEU A 37 61.336 12.721 1.409 1.00 0.00 C ATOM 1032 CD1 LEU A 37 62.856 12.690 1.226 1.00 0.00 C ATOM 1033 CD2 LEU A 37 60.812 11.301 1.716 1.00 0.00 C ATOM 0 H LEU A 37 59.485 14.882 0.894 1.00 0.00 H new ATOM 0 HA LEU A 37 59.028 12.781 2.901 1.00 0.00 H new ATOM 0 HB2 LEU A 37 61.396 14.666 2.361 1.00 0.00 H new ATOM 0 HB3 LEU A 37 61.441 13.324 3.487 1.00 0.00 H new ATOM 0 HG LEU A 37 60.865 13.073 0.491 1.00 0.00 H new ATOM 0 HD11 LEU A 37 63.110 12.014 0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 37 63.215 13.692 0.992 1.00 0.00 H new ATOM 0 HD13 LEU A 37 63.326 12.342 2.146 1.00 0.00 H new ATOM 0 HD21 LEU A 37 61.066 10.634 0.893 1.00 0.00 H new ATOM 0 HD22 LEU A 37 61.270 10.935 2.635 1.00 0.00 H new ATOM 0 HD23 LEU A 37 59.729 11.331 1.838 1.00 0.00 H new ATOM 1045 N GLN A 38 59.168 15.924 3.814 1.00 0.00 N ATOM 1046 CA GLN A 38 58.908 16.810 4.979 1.00 0.00 C ATOM 1047 C GLN A 38 57.492 16.609 5.483 1.00 0.00 C ATOM 1048 O GLN A 38 57.223 16.645 6.665 1.00 0.00 O ATOM 1049 CB GLN A 38 59.084 18.271 4.540 1.00 0.00 C ATOM 1050 CG GLN A 38 58.002 18.661 3.514 1.00 0.00 C ATOM 1051 CD GLN A 38 56.749 19.185 4.229 1.00 0.00 C ATOM 1052 OE1 GLN A 38 56.623 19.066 5.432 1.00 0.00 O ATOM 1053 NE2 GLN A 38 55.818 19.773 3.529 1.00 0.00 N ATOM 0 H GLN A 38 59.355 16.409 2.936 1.00 0.00 H new ATOM 0 HA GLN A 38 59.607 16.568 5.779 1.00 0.00 H new ATOM 0 HB2 GLN A 38 59.024 18.927 5.408 1.00 0.00 H new ATOM 0 HB3 GLN A 38 60.073 18.409 4.104 1.00 0.00 H new ATOM 0 HG2 GLN A 38 58.390 19.425 2.840 1.00 0.00 H new ATOM 0 HG3 GLN A 38 57.744 17.797 2.902 1.00 0.00 H new ATOM 0 HE21 GLN A 38 55.925 19.872 2.519 1.00 0.00 H new ATOM 0 HE22 GLN A 38 54.983 20.133 3.991 1.00 0.00 H new ATOM 1062 N THR A 39 56.580 16.437 4.579 1.00 0.00 N ATOM 1063 CA THR A 39 55.165 16.277 4.975 1.00 0.00 C ATOM 1064 C THR A 39 54.916 14.911 5.618 1.00 0.00 C ATOM 1065 O THR A 39 54.309 14.813 6.667 1.00 0.00 O ATOM 1066 CB THR A 39 54.272 16.441 3.745 1.00 0.00 C ATOM 1067 OG1 THR A 39 54.463 17.735 3.195 1.00 0.00 O ATOM 1068 CG2 THR A 39 52.808 16.264 4.146 1.00 0.00 C ATOM 0 H THR A 39 56.756 16.400 3.575 1.00 0.00 H new ATOM 0 HA THR A 39 54.927 17.043 5.713 1.00 0.00 H new ATOM 0 HB THR A 39 54.534 15.688 3.002 1.00 0.00 H new ATOM 0 HG1 THR A 39 54.978 17.665 2.364 1.00 0.00 H new ATOM 0 HG21 THR A 39 52.173 16.381 3.268 1.00 0.00 H new ATOM 0 HG22 THR A 39 52.664 15.269 4.567 1.00 0.00 H new ATOM 0 HG23 THR A 39 52.541 17.015 4.889 1.00 0.00 H new ATOM 1076 N GLU A 40 55.353 13.859 4.993 1.00 0.00 N ATOM 1077 CA GLU A 40 55.112 12.502 5.558 1.00 0.00 C ATOM 1078 C GLU A 40 56.149 12.155 6.636 1.00 0.00 C ATOM 1079 O GLU A 40 55.806 11.759 7.732 1.00 0.00 O ATOM 1080 CB GLU A 40 55.199 11.486 4.419 1.00 0.00 C ATOM 1081 CG GLU A 40 53.896 11.497 3.602 1.00 0.00 C ATOM 1082 CD GLU A 40 53.744 12.843 2.892 1.00 0.00 C ATOM 1083 OE1 GLU A 40 54.755 13.432 2.565 1.00 0.00 O ATOM 1084 OE2 GLU A 40 52.618 13.258 2.679 1.00 0.00 O ATOM 0 H GLU A 40 55.868 13.877 4.113 1.00 0.00 H new ATOM 0 HA GLU A 40 54.127 12.479 6.023 1.00 0.00 H new ATOM 0 HB2 GLU A 40 56.045 11.723 3.773 1.00 0.00 H new ATOM 0 HB3 GLU A 40 55.376 10.489 4.823 1.00 0.00 H new ATOM 0 HG2 GLU A 40 53.907 10.689 2.871 1.00 0.00 H new ATOM 0 HG3 GLU A 40 53.043 11.322 4.258 1.00 0.00 H new ATOM 1091 N LEU A 41 57.410 12.290 6.327 1.00 0.00 N ATOM 1092 CA LEU A 41 58.480 11.959 7.326 1.00 0.00 C ATOM 1093 C LEU A 41 59.030 13.265 7.917 1.00 0.00 C ATOM 1094 O LEU A 41 60.075 13.748 7.531 1.00 0.00 O ATOM 1095 CB LEU A 41 59.600 11.184 6.608 1.00 0.00 C ATOM 1096 CG LEU A 41 59.214 9.687 6.459 1.00 0.00 C ATOM 1097 CD1 LEU A 41 59.940 9.083 5.251 1.00 0.00 C ATOM 1098 CD2 LEU A 41 59.623 8.910 7.721 1.00 0.00 C ATOM 0 H LEU A 41 57.752 12.616 5.423 1.00 0.00 H new ATOM 0 HA LEU A 41 58.078 11.346 8.133 1.00 0.00 H new ATOM 0 HB2 LEU A 41 59.779 11.619 5.625 1.00 0.00 H new ATOM 0 HB3 LEU A 41 60.530 11.272 7.170 1.00 0.00 H new ATOM 0 HG LEU A 41 58.135 9.617 6.318 1.00 0.00 H new ATOM 0 HD11 LEU A 41 59.667 8.033 5.150 1.00 0.00 H new ATOM 0 HD12 LEU A 41 59.653 9.621 4.348 1.00 0.00 H new ATOM 0 HD13 LEU A 41 61.017 9.165 5.396 1.00 0.00 H new ATOM 0 HD21 LEU A 41 59.348 7.861 7.608 1.00 0.00 H new ATOM 0 HD22 LEU A 41 60.701 8.990 7.864 1.00 0.00 H new ATOM 0 HD23 LEU A 41 59.110 9.328 8.588 1.00 0.00 H new ATOM 1110 N SER A 42 58.301 13.852 8.829 1.00 0.00 N ATOM 1111 CA SER A 42 58.725 15.149 9.438 1.00 0.00 C ATOM 1112 C SER A 42 59.669 14.968 10.639 1.00 0.00 C ATOM 1113 O SER A 42 60.361 15.895 11.008 1.00 0.00 O ATOM 1114 CB SER A 42 57.480 15.888 9.926 1.00 0.00 C ATOM 1115 OG SER A 42 56.579 16.069 8.843 1.00 0.00 O ATOM 0 H SER A 42 57.418 13.484 9.183 1.00 0.00 H new ATOM 0 HA SER A 42 59.263 15.705 8.670 1.00 0.00 H new ATOM 0 HB2 SER A 42 56.998 15.322 10.723 1.00 0.00 H new ATOM 0 HB3 SER A 42 57.759 16.855 10.345 1.00 0.00 H new ATOM 0 HG SER A 42 57.069 16.399 8.061 1.00 0.00 H new ATOM 1121 N SER A 43 59.679 13.820 11.291 1.00 0.00 N ATOM 1122 CA SER A 43 60.560 13.645 12.507 1.00 0.00 C ATOM 1123 C SER A 43 61.626 12.554 12.310 1.00 0.00 C ATOM 1124 O SER A 43 62.372 12.264 13.223 1.00 0.00 O ATOM 1125 CB SER A 43 59.681 13.265 13.700 1.00 0.00 C ATOM 1126 OG SER A 43 60.464 13.287 14.886 1.00 0.00 O ATOM 0 H SER A 43 59.122 13.004 11.039 1.00 0.00 H new ATOM 0 HA SER A 43 61.080 14.588 12.678 1.00 0.00 H new ATOM 0 HB2 SER A 43 58.847 13.961 13.788 1.00 0.00 H new ATOM 0 HB3 SER A 43 59.254 12.273 13.551 1.00 0.00 H new ATOM 0 HG SER A 43 61.356 12.929 14.696 1.00 0.00 H new ATOM 1132 N PHE A 44 61.709 11.941 11.154 1.00 0.00 N ATOM 1133 CA PHE A 44 62.740 10.865 10.937 1.00 0.00 C ATOM 1134 C PHE A 44 63.666 11.268 9.792 1.00 0.00 C ATOM 1135 O PHE A 44 64.874 11.164 9.884 1.00 0.00 O ATOM 1136 CB PHE A 44 62.027 9.558 10.591 1.00 0.00 C ATOM 1137 CG PHE A 44 61.177 9.137 11.766 1.00 0.00 C ATOM 1138 CD1 PHE A 44 61.749 8.415 12.819 1.00 0.00 C ATOM 1139 CD2 PHE A 44 59.819 9.478 11.807 1.00 0.00 C ATOM 1140 CE1 PHE A 44 60.964 8.030 13.913 1.00 0.00 C ATOM 1141 CE2 PHE A 44 59.033 9.094 12.902 1.00 0.00 C ATOM 1142 CZ PHE A 44 59.607 8.370 13.955 1.00 0.00 C ATOM 0 H PHE A 44 61.111 12.135 10.350 1.00 0.00 H new ATOM 0 HA PHE A 44 63.332 10.731 11.842 1.00 0.00 H new ATOM 0 HB2 PHE A 44 61.406 9.691 9.705 1.00 0.00 H new ATOM 0 HB3 PHE A 44 62.756 8.782 10.356 1.00 0.00 H new ATOM 0 HD1 PHE A 44 62.797 8.154 12.788 1.00 0.00 H new ATOM 0 HD2 PHE A 44 59.378 10.037 10.995 1.00 0.00 H new ATOM 0 HE1 PHE A 44 61.406 7.471 14.724 1.00 0.00 H new ATOM 0 HE2 PHE A 44 57.986 9.356 12.934 1.00 0.00 H new ATOM 0 HZ PHE A 44 59.002 8.074 14.799 1.00 0.00 H new ATOM 1152 N LEU A 45 63.100 11.742 8.720 1.00 0.00 N ATOM 1153 CA LEU A 45 63.907 12.185 7.544 1.00 0.00 C ATOM 1154 C LEU A 45 63.796 13.718 7.477 1.00 0.00 C ATOM 1155 O LEU A 45 62.735 14.270 7.687 1.00 0.00 O ATOM 1156 CB LEU A 45 63.310 11.521 6.285 1.00 0.00 C ATOM 1157 CG LEU A 45 64.407 10.997 5.339 1.00 0.00 C ATOM 1158 CD1 LEU A 45 63.735 10.346 4.130 1.00 0.00 C ATOM 1159 CD2 LEU A 45 65.309 12.158 4.886 1.00 0.00 C ATOM 0 H LEU A 45 62.092 11.844 8.604 1.00 0.00 H new ATOM 0 HA LEU A 45 64.957 11.902 7.619 1.00 0.00 H new ATOM 0 HB2 LEU A 45 62.662 10.696 6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 45 62.687 12.241 5.755 1.00 0.00 H new ATOM 0 HG LEU A 45 65.027 10.264 5.855 1.00 0.00 H new ATOM 0 HD11 LEU A 45 64.498 9.969 3.449 1.00 0.00 H new ATOM 0 HD12 LEU A 45 63.107 9.520 4.464 1.00 0.00 H new ATOM 0 HD13 LEU A 45 63.121 11.084 3.614 1.00 0.00 H new ATOM 0 HD21 LEU A 45 66.082 11.779 4.217 1.00 0.00 H new ATOM 0 HD22 LEU A 45 64.709 12.902 4.362 1.00 0.00 H new ATOM 0 HD23 LEU A 45 65.776 12.617 5.757 1.00 0.00 H new ATOM 1171 N ASP A 46 64.874 14.412 7.215 1.00 0.00 N ATOM 1172 CA ASP A 46 64.830 15.908 7.167 1.00 0.00 C ATOM 1173 C ASP A 46 65.315 16.407 5.814 1.00 0.00 C ATOM 1174 O ASP A 46 66.048 15.745 5.107 1.00 0.00 O ATOM 1175 CB ASP A 46 65.739 16.470 8.263 1.00 0.00 C ATOM 1176 CG ASP A 46 67.201 16.136 7.947 1.00 0.00 C ATOM 1177 OD1 ASP A 46 67.424 15.303 7.084 1.00 0.00 O ATOM 1178 OD2 ASP A 46 68.070 16.721 8.572 1.00 0.00 O ATOM 0 H ASP A 46 65.791 14.005 7.031 1.00 0.00 H new ATOM 0 HA ASP A 46 63.803 16.239 7.321 1.00 0.00 H new ATOM 0 HB2 ASP A 46 65.611 17.550 8.336 1.00 0.00 H new ATOM 0 HB3 ASP A 46 65.461 16.050 9.230 1.00 0.00 H new ATOM 1183 N VAL A 47 64.908 17.596 5.478 1.00 0.00 N ATOM 1184 CA VAL A 47 65.310 18.231 4.198 1.00 0.00 C ATOM 1185 C VAL A 47 65.178 19.742 4.379 1.00 0.00 C ATOM 1186 O VAL A 47 65.947 20.517 3.865 1.00 0.00 O ATOM 1187 CB VAL A 47 64.373 17.791 3.061 1.00 0.00 C ATOM 1188 CG1 VAL A 47 64.410 16.272 2.903 1.00 0.00 C ATOM 1189 CG2 VAL A 47 62.942 18.231 3.379 1.00 0.00 C ATOM 0 H VAL A 47 64.295 18.170 6.056 1.00 0.00 H new ATOM 0 HA VAL A 47 66.329 17.941 3.943 1.00 0.00 H new ATOM 0 HB VAL A 47 64.705 18.254 2.132 1.00 0.00 H new ATOM 0 HG11 VAL A 47 63.742 15.974 2.095 1.00 0.00 H new ATOM 0 HG12 VAL A 47 65.426 15.955 2.669 1.00 0.00 H new ATOM 0 HG13 VAL A 47 64.088 15.802 3.832 1.00 0.00 H new ATOM 0 HG21 VAL A 47 62.278 17.919 2.573 1.00 0.00 H new ATOM 0 HG22 VAL A 47 62.619 17.772 4.313 1.00 0.00 H new ATOM 0 HG23 VAL A 47 62.908 19.316 3.477 1.00 0.00 H new ATOM 1199 N GLN A 48 64.186 20.168 5.108 1.00 0.00 N ATOM 1200 CA GLN A 48 63.988 21.633 5.309 1.00 0.00 C ATOM 1201 C GLN A 48 64.786 22.131 6.516 1.00 0.00 C ATOM 1202 O GLN A 48 65.201 23.273 6.559 1.00 0.00 O ATOM 1203 CB GLN A 48 62.503 21.906 5.526 1.00 0.00 C ATOM 1204 CG GLN A 48 62.034 21.248 6.824 1.00 0.00 C ATOM 1205 CD GLN A 48 60.509 21.337 6.912 1.00 0.00 C ATOM 1206 OE1 GLN A 48 59.821 21.142 5.929 1.00 0.00 O ATOM 1207 NE2 GLN A 48 59.947 21.632 8.053 1.00 0.00 N ATOM 0 H GLN A 48 63.504 19.569 5.573 1.00 0.00 H new ATOM 0 HA GLN A 48 64.342 22.163 4.425 1.00 0.00 H new ATOM 0 HB2 GLN A 48 62.325 22.981 5.568 1.00 0.00 H new ATOM 0 HB3 GLN A 48 61.927 21.520 4.685 1.00 0.00 H new ATOM 0 HG2 GLN A 48 62.351 20.206 6.852 1.00 0.00 H new ATOM 0 HG3 GLN A 48 62.489 21.743 7.682 1.00 0.00 H new ATOM 0 HE21 GLN A 48 60.524 21.796 8.878 1.00 0.00 H new ATOM 0 HE22 GLN A 48 58.931 21.699 8.119 1.00 0.00 H new ATOM 1216 N LYS A 49 65.009 21.302 7.497 1.00 0.00 N ATOM 1217 CA LYS A 49 65.783 21.770 8.681 1.00 0.00 C ATOM 1218 C LYS A 49 67.177 22.180 8.230 1.00 0.00 C ATOM 1219 O LYS A 49 67.736 23.155 8.691 1.00 0.00 O ATOM 1220 CB LYS A 49 65.923 20.635 9.693 1.00 0.00 C ATOM 1221 CG LYS A 49 64.567 20.347 10.328 1.00 0.00 C ATOM 1222 CD LYS A 49 64.740 19.402 11.522 1.00 0.00 C ATOM 1223 CE LYS A 49 64.982 17.970 11.039 1.00 0.00 C ATOM 1224 NZ LYS A 49 64.899 17.039 12.200 1.00 0.00 N ATOM 0 H LYS A 49 64.694 20.333 7.532 1.00 0.00 H new ATOM 0 HA LYS A 49 65.262 22.611 9.138 1.00 0.00 H new ATOM 0 HB2 LYS A 49 66.303 19.740 9.201 1.00 0.00 H new ATOM 0 HB3 LYS A 49 66.646 20.907 10.462 1.00 0.00 H new ATOM 0 HG2 LYS A 49 64.103 21.278 10.654 1.00 0.00 H new ATOM 0 HG3 LYS A 49 63.899 19.899 9.592 1.00 0.00 H new ATOM 0 HD2 LYS A 49 65.578 19.732 12.136 1.00 0.00 H new ATOM 0 HD3 LYS A 49 63.851 19.435 12.152 1.00 0.00 H new ATOM 0 HE2 LYS A 49 64.242 17.698 10.286 1.00 0.00 H new ATOM 0 HE3 LYS A 49 65.961 17.894 10.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 65.063 16.064 11.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 65.621 17.296 12.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 63.955 17.106 12.632 1.00 0.00 H new ATOM 1238 N ASP A 50 67.738 21.418 7.332 1.00 0.00 N ATOM 1239 CA ASP A 50 69.116 21.708 6.821 1.00 0.00 C ATOM 1240 C ASP A 50 69.099 21.857 5.297 1.00 0.00 C ATOM 1241 O ASP A 50 68.878 20.908 4.574 1.00 0.00 O ATOM 1242 CB ASP A 50 70.032 20.547 7.207 1.00 0.00 C ATOM 1243 CG ASP A 50 70.259 20.561 8.719 1.00 0.00 C ATOM 1244 OD1 ASP A 50 70.260 21.641 9.286 1.00 0.00 O ATOM 1245 OD2 ASP A 50 70.432 19.493 9.283 1.00 0.00 O ATOM 0 H ASP A 50 67.297 20.594 6.923 1.00 0.00 H new ATOM 0 HA ASP A 50 69.477 22.639 7.258 1.00 0.00 H new ATOM 0 HB2 ASP A 50 69.585 19.600 6.904 1.00 0.00 H new ATOM 0 HB3 ASP A 50 70.985 20.631 6.684 1.00 0.00 H new ATOM 1250 N ALA A 51 69.361 23.034 4.801 1.00 0.00 N ATOM 1251 CA ALA A 51 69.391 23.232 3.324 1.00 0.00 C ATOM 1252 C ALA A 51 70.580 22.467 2.754 1.00 0.00 C ATOM 1253 O ALA A 51 70.522 21.929 1.666 1.00 0.00 O ATOM 1254 CB ALA A 51 69.532 24.722 3.005 1.00 0.00 C ATOM 0 H ALA A 51 69.556 23.868 5.355 1.00 0.00 H new ATOM 0 HA ALA A 51 68.466 22.864 2.880 1.00 0.00 H new ATOM 0 HB1 ALA A 51 69.554 24.862 1.924 1.00 0.00 H new ATOM 0 HB2 ALA A 51 68.686 25.266 3.425 1.00 0.00 H new ATOM 0 HB3 ALA A 51 70.458 25.101 3.439 1.00 0.00 H new ATOM 1260 N ASP A 52 71.657 22.402 3.485 1.00 0.00 N ATOM 1261 CA ASP A 52 72.840 21.655 2.986 1.00 0.00 C ATOM 1262 C ASP A 52 72.435 20.198 2.777 1.00 0.00 C ATOM 1263 O ASP A 52 72.863 19.550 1.853 1.00 0.00 O ATOM 1264 CB ASP A 52 73.982 21.743 4.001 1.00 0.00 C ATOM 1265 CG ASP A 52 73.503 21.243 5.362 1.00 0.00 C ATOM 1266 OD1 ASP A 52 72.777 21.974 6.015 1.00 0.00 O ATOM 1267 OD2 ASP A 52 73.877 20.143 5.734 1.00 0.00 O ATOM 0 H ASP A 52 71.768 22.833 4.403 1.00 0.00 H new ATOM 0 HA ASP A 52 73.184 22.085 2.045 1.00 0.00 H new ATOM 0 HB2 ASP A 52 74.829 21.147 3.662 1.00 0.00 H new ATOM 0 HB3 ASP A 52 74.329 22.773 4.083 1.00 0.00 H new ATOM 1272 N ALA A 53 71.603 19.678 3.628 1.00 0.00 N ATOM 1273 CA ALA A 53 71.156 18.267 3.480 1.00 0.00 C ATOM 1274 C ALA A 53 70.449 18.070 2.139 1.00 0.00 C ATOM 1275 O ALA A 53 70.578 17.045 1.502 1.00 0.00 O ATOM 1276 CB ALA A 53 70.174 17.941 4.612 1.00 0.00 C ATOM 0 H ALA A 53 71.209 20.173 4.428 1.00 0.00 H new ATOM 0 HA ALA A 53 72.024 17.610 3.523 1.00 0.00 H new ATOM 0 HB1 ALA A 53 69.838 16.909 4.516 1.00 0.00 H new ATOM 0 HB2 ALA A 53 70.670 18.073 5.573 1.00 0.00 H new ATOM 0 HB3 ALA A 53 69.315 18.609 4.552 1.00 0.00 H new ATOM 1282 N VAL A 54 69.673 19.025 1.731 1.00 0.00 N ATOM 1283 CA VAL A 54 68.917 18.890 0.458 1.00 0.00 C ATOM 1284 C VAL A 54 69.832 18.938 -0.753 1.00 0.00 C ATOM 1285 O VAL A 54 69.817 18.063 -1.580 1.00 0.00 O ATOM 1286 CB VAL A 54 67.947 20.054 0.338 1.00 0.00 C ATOM 1287 CG1 VAL A 54 67.060 19.852 -0.889 1.00 0.00 C ATOM 1288 CG2 VAL A 54 67.100 20.141 1.600 1.00 0.00 C ATOM 0 H VAL A 54 69.526 19.904 2.228 1.00 0.00 H new ATOM 0 HA VAL A 54 68.405 17.928 0.480 1.00 0.00 H new ATOM 0 HB VAL A 54 68.500 20.986 0.222 1.00 0.00 H new ATOM 0 HG11 VAL A 54 66.364 20.686 -0.976 1.00 0.00 H new ATOM 0 HG12 VAL A 54 67.681 19.803 -1.783 1.00 0.00 H new ATOM 0 HG13 VAL A 54 66.501 18.922 -0.785 1.00 0.00 H new ATOM 0 HG21 VAL A 54 66.404 20.976 1.514 1.00 0.00 H new ATOM 0 HG22 VAL A 54 66.541 19.214 1.728 1.00 0.00 H new ATOM 0 HG23 VAL A 54 67.748 20.296 2.463 1.00 0.00 H new ATOM 1298 N ASP A 55 70.575 19.981 -0.914 1.00 0.00 N ATOM 1299 CA ASP A 55 71.430 20.093 -2.130 1.00 0.00 C ATOM 1300 C ASP A 55 72.433 18.945 -2.219 1.00 0.00 C ATOM 1301 O ASP A 55 72.681 18.409 -3.278 1.00 0.00 O ATOM 1302 CB ASP A 55 72.183 21.426 -2.071 1.00 0.00 C ATOM 1303 CG ASP A 55 73.062 21.604 -3.314 1.00 0.00 C ATOM 1304 OD1 ASP A 55 73.372 20.612 -3.952 1.00 0.00 O ATOM 1305 OD2 ASP A 55 73.414 22.735 -3.605 1.00 0.00 O ATOM 0 H ASP A 55 70.634 20.764 -0.263 1.00 0.00 H new ATOM 0 HA ASP A 55 70.792 20.045 -3.013 1.00 0.00 H new ATOM 0 HB2 ASP A 55 71.472 22.249 -2.001 1.00 0.00 H new ATOM 0 HB3 ASP A 55 72.801 21.462 -1.174 1.00 0.00 H new ATOM 1310 N LYS A 56 73.042 18.591 -1.133 1.00 0.00 N ATOM 1311 CA LYS A 56 74.067 17.513 -1.174 1.00 0.00 C ATOM 1312 C LYS A 56 73.431 16.137 -1.431 1.00 0.00 C ATOM 1313 O LYS A 56 74.012 15.299 -2.087 1.00 0.00 O ATOM 1314 CB LYS A 56 74.834 17.503 0.161 1.00 0.00 C ATOM 1315 CG LYS A 56 76.019 18.479 0.110 1.00 0.00 C ATOM 1316 CD LYS A 56 75.506 19.913 -0.019 1.00 0.00 C ATOM 1317 CE LYS A 56 76.681 20.884 0.078 1.00 0.00 C ATOM 1318 NZ LYS A 56 77.608 20.650 -1.063 1.00 0.00 N ATOM 0 H LYS A 56 72.877 19.000 -0.213 1.00 0.00 H new ATOM 0 HA LYS A 56 74.752 17.714 -1.998 1.00 0.00 H new ATOM 0 HB2 LYS A 56 74.163 17.779 0.974 1.00 0.00 H new ATOM 0 HB3 LYS A 56 75.194 16.496 0.373 1.00 0.00 H new ATOM 0 HG2 LYS A 56 76.623 18.379 1.012 1.00 0.00 H new ATOM 0 HG3 LYS A 56 76.665 18.237 -0.734 1.00 0.00 H new ATOM 0 HD2 LYS A 56 74.991 20.042 -0.971 1.00 0.00 H new ATOM 0 HD3 LYS A 56 74.781 20.123 0.767 1.00 0.00 H new ATOM 0 HE2 LYS A 56 76.320 21.912 0.063 1.00 0.00 H new ATOM 0 HE3 LYS A 56 77.206 20.744 1.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 78.250 21.462 -1.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 78.164 19.788 -0.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 77.059 20.536 -1.939 1.00 0.00 H new ATOM 1332 N ILE A 57 72.276 15.874 -0.882 1.00 0.00 N ATOM 1333 CA ILE A 57 71.658 14.529 -1.059 1.00 0.00 C ATOM 1334 C ILE A 57 70.950 14.432 -2.410 1.00 0.00 C ATOM 1335 O ILE A 57 71.180 13.525 -3.182 1.00 0.00 O ATOM 1336 CB ILE A 57 70.655 14.316 0.080 1.00 0.00 C ATOM 1337 CG1 ILE A 57 71.416 14.142 1.396 1.00 0.00 C ATOM 1338 CG2 ILE A 57 69.789 13.086 -0.183 1.00 0.00 C ATOM 1339 CD1 ILE A 57 70.439 14.194 2.575 1.00 0.00 C ATOM 0 H ILE A 57 71.735 16.531 -0.320 1.00 0.00 H new ATOM 0 HA ILE A 57 72.430 13.760 -1.035 1.00 0.00 H new ATOM 0 HB ILE A 57 70.002 15.187 0.142 1.00 0.00 H new ATOM 0 HG12 ILE A 57 71.948 13.191 1.395 1.00 0.00 H new ATOM 0 HG13 ILE A 57 72.166 14.927 1.499 1.00 0.00 H new ATOM 0 HG21 ILE A 57 69.085 12.955 0.638 1.00 0.00 H new ATOM 0 HG22 ILE A 57 69.239 13.221 -1.114 1.00 0.00 H new ATOM 0 HG23 ILE A 57 70.424 12.204 -0.261 1.00 0.00 H new ATOM 0 HD11 ILE A 57 70.988 14.069 3.508 1.00 0.00 H new ATOM 0 HD12 ILE A 57 69.927 15.156 2.581 1.00 0.00 H new ATOM 0 HD13 ILE A 57 69.706 13.393 2.476 1.00 0.00 H new ATOM 1351 N MET A 58 70.074 15.345 -2.674 1.00 0.00 N ATOM 1352 CA MET A 58 69.307 15.317 -3.942 1.00 0.00 C ATOM 1353 C MET A 58 70.233 15.392 -5.159 1.00 0.00 C ATOM 1354 O MET A 58 70.102 14.628 -6.095 1.00 0.00 O ATOM 1355 CB MET A 58 68.331 16.504 -3.946 1.00 0.00 C ATOM 1356 CG MET A 58 67.779 16.765 -5.356 1.00 0.00 C ATOM 1357 SD MET A 58 67.262 15.214 -6.129 1.00 0.00 S ATOM 1358 CE MET A 58 67.024 15.884 -7.795 1.00 0.00 C ATOM 0 H MET A 58 69.851 16.125 -2.056 1.00 0.00 H new ATOM 0 HA MET A 58 68.761 14.376 -4.007 1.00 0.00 H new ATOM 0 HB2 MET A 58 67.507 16.303 -3.262 1.00 0.00 H new ATOM 0 HB3 MET A 58 68.838 17.397 -3.580 1.00 0.00 H new ATOM 0 HG2 MET A 58 66.933 17.451 -5.301 1.00 0.00 H new ATOM 0 HG3 MET A 58 68.541 17.247 -5.968 1.00 0.00 H new ATOM 0 HE1 MET A 58 67.066 15.073 -8.523 1.00 0.00 H new ATOM 0 HE2 MET A 58 66.053 16.375 -7.854 1.00 0.00 H new ATOM 0 HE3 MET A 58 67.810 16.607 -8.012 1.00 0.00 H new ATOM 1368 N LYS A 59 71.144 16.318 -5.176 1.00 0.00 N ATOM 1369 CA LYS A 59 72.036 16.444 -6.359 1.00 0.00 C ATOM 1370 C LYS A 59 72.925 15.202 -6.494 1.00 0.00 C ATOM 1371 O LYS A 59 73.165 14.723 -7.584 1.00 0.00 O ATOM 1372 CB LYS A 59 72.887 17.711 -6.239 1.00 0.00 C ATOM 1373 CG LYS A 59 73.814 17.857 -7.453 1.00 0.00 C ATOM 1374 CD LYS A 59 72.986 17.946 -8.744 1.00 0.00 C ATOM 1375 CE LYS A 59 73.821 18.590 -9.848 1.00 0.00 C ATOM 1376 NZ LYS A 59 74.098 20.009 -9.487 1.00 0.00 N ATOM 0 H LYS A 59 71.311 16.991 -4.427 1.00 0.00 H new ATOM 0 HA LYS A 59 71.424 16.521 -7.257 1.00 0.00 H new ATOM 0 HB2 LYS A 59 72.239 18.584 -6.162 1.00 0.00 H new ATOM 0 HB3 LYS A 59 73.480 17.672 -5.325 1.00 0.00 H new ATOM 0 HG2 LYS A 59 74.430 18.750 -7.345 1.00 0.00 H new ATOM 0 HG3 LYS A 59 74.493 17.006 -7.506 1.00 0.00 H new ATOM 0 HD2 LYS A 59 72.665 16.950 -9.051 1.00 0.00 H new ATOM 0 HD3 LYS A 59 72.084 18.532 -8.569 1.00 0.00 H new ATOM 0 HE2 LYS A 59 74.756 18.046 -9.978 1.00 0.00 H new ATOM 0 HE3 LYS A 59 73.289 18.541 -10.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 74.172 20.580 -10.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 73.324 20.375 -8.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 74.992 20.065 -8.958 1.00 0.00 H new ATOM 1390 N GLU A 60 73.424 14.676 -5.407 1.00 0.00 N ATOM 1391 CA GLU A 60 74.297 13.468 -5.500 1.00 0.00 C ATOM 1392 C GLU A 60 73.432 12.212 -5.496 1.00 0.00 C ATOM 1393 O GLU A 60 73.880 11.147 -5.875 1.00 0.00 O ATOM 1394 CB GLU A 60 75.260 13.421 -4.311 1.00 0.00 C ATOM 1395 CG GLU A 60 76.268 14.566 -4.422 1.00 0.00 C ATOM 1396 CD GLU A 60 77.230 14.516 -3.232 1.00 0.00 C ATOM 1397 OE1 GLU A 60 77.015 13.695 -2.357 1.00 0.00 O ATOM 1398 OE2 GLU A 60 78.166 15.297 -3.220 1.00 0.00 O ATOM 0 H GLU A 60 73.266 15.028 -4.463 1.00 0.00 H new ATOM 0 HA GLU A 60 74.871 13.518 -6.425 1.00 0.00 H new ATOM 0 HB2 GLU A 60 74.704 13.501 -3.377 1.00 0.00 H new ATOM 0 HB3 GLU A 60 75.782 12.464 -4.290 1.00 0.00 H new ATOM 0 HG2 GLU A 60 76.824 14.486 -5.356 1.00 0.00 H new ATOM 0 HG3 GLU A 60 75.747 15.523 -4.442 1.00 0.00 H new ATOM 1405 N LEU A 61 72.184 12.329 -5.080 1.00 0.00 N ATOM 1406 CA LEU A 61 71.308 11.110 -5.073 1.00 0.00 C ATOM 1407 C LEU A 61 70.758 10.965 -6.484 1.00 0.00 C ATOM 1408 O LEU A 61 70.456 9.880 -6.940 1.00 0.00 O ATOM 1409 CB LEU A 61 70.214 11.195 -4.015 1.00 0.00 C ATOM 1410 CG LEU A 61 69.299 9.975 -4.109 1.00 0.00 C ATOM 1411 CD1 LEU A 61 70.111 8.692 -3.891 1.00 0.00 C ATOM 1412 CD2 LEU A 61 68.227 10.096 -3.030 1.00 0.00 C ATOM 0 H LEU A 61 71.747 13.191 -4.754 1.00 0.00 H new ATOM 0 HA LEU A 61 71.878 10.222 -4.799 1.00 0.00 H new ATOM 0 HB2 LEU A 61 70.661 11.249 -3.022 1.00 0.00 H new ATOM 0 HB3 LEU A 61 69.633 12.107 -4.153 1.00 0.00 H new ATOM 0 HG LEU A 61 68.838 9.930 -5.096 1.00 0.00 H new ATOM 0 HD11 LEU A 61 69.451 7.827 -3.960 1.00 0.00 H new ATOM 0 HD12 LEU A 61 70.886 8.618 -4.654 1.00 0.00 H new ATOM 0 HD13 LEU A 61 70.574 8.718 -2.904 1.00 0.00 H new ATOM 0 HD21 LEU A 61 67.562 9.234 -3.080 1.00 0.00 H new ATOM 0 HD22 LEU A 61 68.701 10.133 -2.049 1.00 0.00 H new ATOM 0 HD23 LEU A 61 67.651 11.008 -3.190 1.00 0.00 H new ATOM 1424 N ASP A 62 70.741 12.048 -7.229 1.00 0.00 N ATOM 1425 CA ASP A 62 70.347 11.955 -8.662 1.00 0.00 C ATOM 1426 C ASP A 62 71.660 11.645 -9.363 1.00 0.00 C ATOM 1427 O ASP A 62 72.078 12.255 -10.314 1.00 0.00 O ATOM 1428 CB ASP A 62 69.737 13.256 -9.175 1.00 0.00 C ATOM 1429 CG ASP A 62 69.303 13.056 -10.627 1.00 0.00 C ATOM 1430 OD1 ASP A 62 69.942 12.277 -11.313 1.00 0.00 O ATOM 1431 OD2 ASP A 62 68.342 13.683 -11.027 1.00 0.00 O ATOM 0 H ASP A 62 70.982 12.984 -6.903 1.00 0.00 H new ATOM 0 HA ASP A 62 69.577 11.203 -8.836 1.00 0.00 H new ATOM 0 HB2 ASP A 62 68.882 13.540 -8.561 1.00 0.00 H new ATOM 0 HB3 ASP A 62 70.463 14.066 -9.106 1.00 0.00 H new ATOM 1436 N GLU A 63 72.299 10.697 -8.771 1.00 0.00 N ATOM 1437 CA GLU A 63 73.632 10.221 -9.204 1.00 0.00 C ATOM 1438 C GLU A 63 73.720 10.186 -10.735 1.00 0.00 C ATOM 1439 O GLU A 63 74.799 10.180 -11.293 1.00 0.00 O ATOM 1440 CB GLU A 63 73.841 8.835 -8.629 1.00 0.00 C ATOM 1441 CG GLU A 63 75.253 8.341 -8.947 1.00 0.00 C ATOM 1442 CD GLU A 63 75.449 6.948 -8.348 1.00 0.00 C ATOM 1443 OE1 GLU A 63 74.558 6.496 -7.648 1.00 0.00 O ATOM 1444 OE2 GLU A 63 76.485 6.355 -8.603 1.00 0.00 O ATOM 0 H GLU A 63 71.933 10.202 -7.958 1.00 0.00 H new ATOM 0 HA GLU A 63 74.407 10.898 -8.846 1.00 0.00 H new ATOM 0 HB2 GLU A 63 73.688 8.854 -7.550 1.00 0.00 H new ATOM 0 HB3 GLU A 63 73.105 8.146 -9.043 1.00 0.00 H new ATOM 0 HG2 GLU A 63 75.405 8.310 -10.026 1.00 0.00 H new ATOM 0 HG3 GLU A 63 75.992 9.031 -8.541 1.00 0.00 H new ATOM 1451 N ASN A 64 72.609 10.187 -11.427 1.00 0.00 N ATOM 1452 CA ASN A 64 72.667 10.181 -12.923 1.00 0.00 C ATOM 1453 C ASN A 64 72.773 11.628 -13.402 1.00 0.00 C ATOM 1454 O ASN A 64 72.861 11.910 -14.581 1.00 0.00 O ATOM 1455 CB ASN A 64 71.414 9.516 -13.497 1.00 0.00 C ATOM 1456 CG ASN A 64 71.522 7.999 -13.320 1.00 0.00 C ATOM 1457 OD1 ASN A 64 72.610 7.462 -13.259 1.00 0.00 O ATOM 1458 ND2 ASN A 64 70.435 7.280 -13.235 1.00 0.00 N ATOM 0 H ASN A 64 71.671 10.192 -11.026 1.00 0.00 H new ATOM 0 HA ASN A 64 73.533 9.614 -13.264 1.00 0.00 H new ATOM 0 HB2 ASN A 64 70.525 9.891 -12.990 1.00 0.00 H new ATOM 0 HB3 ASN A 64 71.308 9.764 -14.553 1.00 0.00 H new ATOM 0 HD21 ASN A 64 70.500 6.269 -13.118 1.00 0.00 H new ATOM 0 HD22 ASN A 64 69.521 7.730 -13.286 1.00 0.00 H new ATOM 1465 N GLY A 65 72.807 12.535 -12.471 1.00 0.00 N ATOM 1466 CA GLY A 65 72.956 13.985 -12.803 1.00 0.00 C ATOM 1467 C GLY A 65 71.815 14.488 -13.697 1.00 0.00 C ATOM 1468 O GLY A 65 72.029 15.307 -14.568 1.00 0.00 O ATOM 0 H GLY A 65 72.737 12.334 -11.474 1.00 0.00 H new ATOM 0 HA2 GLY A 65 72.979 14.568 -11.882 1.00 0.00 H new ATOM 0 HA3 GLY A 65 73.909 14.146 -13.306 1.00 0.00 H new ATOM 1472 N ASP A 66 70.609 14.026 -13.490 1.00 0.00 N ATOM 1473 CA ASP A 66 69.460 14.504 -14.339 1.00 0.00 C ATOM 1474 C ASP A 66 68.588 15.500 -13.558 1.00 0.00 C ATOM 1475 O ASP A 66 67.716 16.134 -14.121 1.00 0.00 O ATOM 1476 CB ASP A 66 68.613 13.312 -14.789 1.00 0.00 C ATOM 1477 CG ASP A 66 68.201 12.487 -13.574 1.00 0.00 C ATOM 1478 OD1 ASP A 66 67.212 12.837 -12.961 1.00 0.00 O ATOM 1479 OD2 ASP A 66 68.883 11.520 -13.278 1.00 0.00 O ATOM 0 H ASP A 66 70.364 13.341 -12.775 1.00 0.00 H new ATOM 0 HA ASP A 66 69.864 15.010 -15.216 1.00 0.00 H new ATOM 0 HB2 ASP A 66 67.728 13.662 -15.320 1.00 0.00 H new ATOM 0 HB3 ASP A 66 69.179 12.694 -15.486 1.00 0.00 H new ATOM 1484 N GLY A 67 68.817 15.669 -12.285 1.00 0.00 N ATOM 1485 CA GLY A 67 68.003 16.657 -11.504 1.00 0.00 C ATOM 1486 C GLY A 67 66.669 16.035 -11.070 1.00 0.00 C ATOM 1487 O GLY A 67 65.941 16.598 -10.258 1.00 0.00 O ATOM 0 H GLY A 67 69.528 15.171 -11.749 1.00 0.00 H new ATOM 0 HA2 GLY A 67 68.561 16.983 -10.626 1.00 0.00 H new ATOM 0 HA3 GLY A 67 67.817 17.543 -12.111 1.00 0.00 H new ATOM 1491 N GLU A 68 66.349 14.876 -11.597 1.00 0.00 N ATOM 1492 CA GLU A 68 65.095 14.188 -11.241 1.00 0.00 C ATOM 1493 C GLU A 68 65.460 12.882 -10.548 1.00 0.00 C ATOM 1494 O GLU A 68 66.456 12.260 -10.850 1.00 0.00 O ATOM 1495 CB GLU A 68 64.319 13.895 -12.519 1.00 0.00 C ATOM 1496 CG GLU A 68 63.744 15.198 -13.081 1.00 0.00 C ATOM 1497 CD GLU A 68 63.189 14.949 -14.485 1.00 0.00 C ATOM 1498 OE1 GLU A 68 63.463 13.893 -15.031 1.00 0.00 O ATOM 1499 OE2 GLU A 68 62.499 15.818 -14.991 1.00 0.00 O ATOM 0 H GLU A 68 66.927 14.378 -12.274 1.00 0.00 H new ATOM 0 HA GLU A 68 64.482 14.803 -10.582 1.00 0.00 H new ATOM 0 HB2 GLU A 68 64.973 13.427 -13.255 1.00 0.00 H new ATOM 0 HB3 GLU A 68 63.514 13.189 -12.314 1.00 0.00 H new ATOM 0 HG2 GLU A 68 62.955 15.571 -12.428 1.00 0.00 H new ATOM 0 HG3 GLU A 68 64.518 15.964 -13.115 1.00 0.00 H new ATOM 1506 N VAL A 69 64.682 12.480 -9.599 1.00 0.00 N ATOM 1507 CA VAL A 69 64.986 11.240 -8.843 1.00 0.00 C ATOM 1508 C VAL A 69 64.079 10.104 -9.299 1.00 0.00 C ATOM 1509 O VAL A 69 62.872 10.231 -9.365 1.00 0.00 O ATOM 1510 CB VAL A 69 64.741 11.544 -7.374 1.00 0.00 C ATOM 1511 CG1 VAL A 69 64.862 10.271 -6.530 1.00 0.00 C ATOM 1512 CG2 VAL A 69 65.776 12.569 -6.901 1.00 0.00 C ATOM 0 H VAL A 69 63.833 12.963 -9.306 1.00 0.00 H new ATOM 0 HA VAL A 69 66.017 10.929 -9.012 1.00 0.00 H new ATOM 0 HB VAL A 69 63.733 11.942 -7.257 1.00 0.00 H new ATOM 0 HG11 VAL A 69 64.683 10.511 -5.482 1.00 0.00 H new ATOM 0 HG12 VAL A 69 64.126 9.540 -6.866 1.00 0.00 H new ATOM 0 HG13 VAL A 69 65.863 9.855 -6.641 1.00 0.00 H new ATOM 0 HG21 VAL A 69 65.610 12.795 -5.848 1.00 0.00 H new ATOM 0 HG22 VAL A 69 66.778 12.160 -7.031 1.00 0.00 H new ATOM 0 HG23 VAL A 69 65.678 13.482 -7.488 1.00 0.00 H new ATOM 1522 N ASP A 70 64.662 8.980 -9.592 1.00 0.00 N ATOM 1523 CA ASP A 70 63.859 7.806 -10.012 1.00 0.00 C ATOM 1524 C ASP A 70 63.304 7.143 -8.754 1.00 0.00 C ATOM 1525 O ASP A 70 63.799 7.358 -7.665 1.00 0.00 O ATOM 1526 CB ASP A 70 64.745 6.819 -10.773 1.00 0.00 C ATOM 1527 CG ASP A 70 65.113 7.415 -12.134 1.00 0.00 C ATOM 1528 OD1 ASP A 70 64.399 8.295 -12.584 1.00 0.00 O ATOM 1529 OD2 ASP A 70 66.098 6.976 -12.704 1.00 0.00 O ATOM 0 H ASP A 70 65.669 8.824 -9.558 1.00 0.00 H new ATOM 0 HA ASP A 70 63.045 8.116 -10.667 1.00 0.00 H new ATOM 0 HB2 ASP A 70 65.648 6.606 -10.200 1.00 0.00 H new ATOM 0 HB3 ASP A 70 64.222 5.872 -10.907 1.00 0.00 H new ATOM 1534 N PHE A 71 62.279 6.358 -8.878 1.00 0.00 N ATOM 1535 CA PHE A 71 61.704 5.713 -7.670 1.00 0.00 C ATOM 1536 C PHE A 71 62.762 4.836 -6.989 1.00 0.00 C ATOM 1537 O PHE A 71 62.829 4.765 -5.781 1.00 0.00 O ATOM 1538 CB PHE A 71 60.500 4.852 -8.063 1.00 0.00 C ATOM 1539 CG PHE A 71 60.935 3.774 -9.031 1.00 0.00 C ATOM 1540 CD1 PHE A 71 61.416 2.552 -8.546 1.00 0.00 C ATOM 1541 CD2 PHE A 71 60.858 3.998 -10.412 1.00 0.00 C ATOM 1542 CE1 PHE A 71 61.820 1.555 -9.440 1.00 0.00 C ATOM 1543 CE2 PHE A 71 61.261 2.998 -11.306 1.00 0.00 C ATOM 1544 CZ PHE A 71 61.742 1.777 -10.820 1.00 0.00 C ATOM 0 H PHE A 71 61.815 6.134 -9.758 1.00 0.00 H new ATOM 0 HA PHE A 71 61.381 6.489 -6.976 1.00 0.00 H new ATOM 0 HB2 PHE A 71 60.059 4.400 -7.175 1.00 0.00 H new ATOM 0 HB3 PHE A 71 59.730 5.474 -8.519 1.00 0.00 H new ATOM 0 HD1 PHE A 71 61.475 2.379 -7.482 1.00 0.00 H new ATOM 0 HD2 PHE A 71 60.488 4.941 -10.787 1.00 0.00 H new ATOM 0 HE1 PHE A 71 62.192 0.613 -9.065 1.00 0.00 H new ATOM 0 HE2 PHE A 71 61.201 3.169 -12.371 1.00 0.00 H new ATOM 0 HZ PHE A 71 62.053 1.006 -11.509 1.00 0.00 H new ATOM 1554 N GLN A 72 63.570 4.150 -7.748 1.00 0.00 N ATOM 1555 CA GLN A 72 64.602 3.258 -7.130 1.00 0.00 C ATOM 1556 C GLN A 72 65.622 4.066 -6.307 1.00 0.00 C ATOM 1557 O GLN A 72 66.049 3.641 -5.253 1.00 0.00 O ATOM 1558 CB GLN A 72 65.329 2.498 -8.245 1.00 0.00 C ATOM 1559 CG GLN A 72 66.393 1.574 -7.645 1.00 0.00 C ATOM 1560 CD GLN A 72 67.042 0.759 -8.766 1.00 0.00 C ATOM 1561 OE1 GLN A 72 66.572 0.765 -9.886 1.00 0.00 O ATOM 1562 NE2 GLN A 72 68.115 0.062 -8.513 1.00 0.00 N ATOM 0 H GLN A 72 63.564 4.165 -8.768 1.00 0.00 H new ATOM 0 HA GLN A 72 64.103 2.562 -6.455 1.00 0.00 H new ATOM 0 HB2 GLN A 72 64.614 1.914 -8.824 1.00 0.00 H new ATOM 0 HB3 GLN A 72 65.795 3.204 -8.933 1.00 0.00 H new ATOM 0 HG2 GLN A 72 67.148 2.161 -7.122 1.00 0.00 H new ATOM 0 HG3 GLN A 72 65.941 0.908 -6.910 1.00 0.00 H new ATOM 0 HE21 GLN A 72 68.510 0.057 -7.573 1.00 0.00 H new ATOM 0 HE22 GLN A 72 68.559 -0.478 -9.256 1.00 0.00 H new ATOM 1571 N GLU A 73 66.038 5.207 -6.779 1.00 0.00 N ATOM 1572 CA GLU A 73 67.048 6.004 -6.015 1.00 0.00 C ATOM 1573 C GLU A 73 66.434 6.547 -4.721 1.00 0.00 C ATOM 1574 O GLU A 73 67.068 6.600 -3.685 1.00 0.00 O ATOM 1575 CB GLU A 73 67.505 7.189 -6.869 1.00 0.00 C ATOM 1576 CG GLU A 73 68.350 6.695 -8.043 1.00 0.00 C ATOM 1577 CD GLU A 73 68.772 7.893 -8.897 1.00 0.00 C ATOM 1578 OE1 GLU A 73 68.544 9.011 -8.465 1.00 0.00 O ATOM 1579 OE2 GLU A 73 69.317 7.674 -9.966 1.00 0.00 O ATOM 0 H GLU A 73 65.727 5.624 -7.656 1.00 0.00 H new ATOM 0 HA GLU A 73 67.891 5.357 -5.772 1.00 0.00 H new ATOM 0 HB2 GLU A 73 66.638 7.736 -7.240 1.00 0.00 H new ATOM 0 HB3 GLU A 73 68.084 7.884 -6.261 1.00 0.00 H new ATOM 0 HG2 GLU A 73 69.230 6.166 -7.676 1.00 0.00 H new ATOM 0 HG3 GLU A 73 67.780 5.987 -8.645 1.00 0.00 H new ATOM 1586 N PHE A 74 65.212 6.978 -4.793 1.00 0.00 N ATOM 1587 CA PHE A 74 64.521 7.563 -3.611 1.00 0.00 C ATOM 1588 C PHE A 74 64.337 6.548 -2.479 1.00 0.00 C ATOM 1589 O PHE A 74 64.667 6.811 -1.349 1.00 0.00 O ATOM 1590 CB PHE A 74 63.149 8.023 -4.098 1.00 0.00 C ATOM 1591 CG PHE A 74 62.248 8.380 -2.941 1.00 0.00 C ATOM 1592 CD1 PHE A 74 62.227 9.683 -2.449 1.00 0.00 C ATOM 1593 CD2 PHE A 74 61.421 7.401 -2.376 1.00 0.00 C ATOM 1594 CE1 PHE A 74 61.381 10.016 -1.388 1.00 0.00 C ATOM 1595 CE2 PHE A 74 60.575 7.730 -1.313 1.00 0.00 C ATOM 1596 CZ PHE A 74 60.554 9.039 -0.818 1.00 0.00 C ATOM 0 H PHE A 74 64.647 6.950 -5.641 1.00 0.00 H new ATOM 0 HA PHE A 74 65.121 8.379 -3.207 1.00 0.00 H new ATOM 0 HB2 PHE A 74 63.264 8.887 -4.752 1.00 0.00 H new ATOM 0 HB3 PHE A 74 62.688 7.233 -4.691 1.00 0.00 H new ATOM 0 HD1 PHE A 74 62.865 10.436 -2.888 1.00 0.00 H new ATOM 0 HD2 PHE A 74 61.437 6.392 -2.761 1.00 0.00 H new ATOM 0 HE1 PHE A 74 61.365 11.027 -1.007 1.00 0.00 H new ATOM 0 HE2 PHE A 74 59.939 6.976 -0.874 1.00 0.00 H new ATOM 0 HZ PHE A 74 59.901 9.296 0.003 1.00 0.00 H new ATOM 1606 N VAL A 75 63.768 5.423 -2.781 1.00 0.00 N ATOM 1607 CA VAL A 75 63.493 4.398 -1.731 1.00 0.00 C ATOM 1608 C VAL A 75 64.780 3.929 -1.041 1.00 0.00 C ATOM 1609 O VAL A 75 64.777 3.591 0.126 1.00 0.00 O ATOM 1610 CB VAL A 75 62.774 3.204 -2.375 1.00 0.00 C ATOM 1611 CG1 VAL A 75 63.727 2.434 -3.284 1.00 0.00 C ATOM 1612 CG2 VAL A 75 62.246 2.263 -1.288 1.00 0.00 C ATOM 0 H VAL A 75 63.475 5.160 -3.722 1.00 0.00 H new ATOM 0 HA VAL A 75 62.862 4.849 -0.966 1.00 0.00 H new ATOM 0 HB VAL A 75 61.942 3.584 -2.968 1.00 0.00 H new ATOM 0 HG11 VAL A 75 63.201 1.591 -3.732 1.00 0.00 H new ATOM 0 HG12 VAL A 75 64.092 3.094 -4.071 1.00 0.00 H new ATOM 0 HG13 VAL A 75 64.570 2.066 -2.699 1.00 0.00 H new ATOM 0 HG21 VAL A 75 61.737 1.419 -1.753 1.00 0.00 H new ATOM 0 HG22 VAL A 75 63.079 1.898 -0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 75 61.546 2.801 -0.649 1.00 0.00 H new ATOM 1622 N VAL A 76 65.865 3.867 -1.754 1.00 0.00 N ATOM 1623 CA VAL A 76 67.130 3.371 -1.134 1.00 0.00 C ATOM 1624 C VAL A 76 67.700 4.362 -0.102 1.00 0.00 C ATOM 1625 O VAL A 76 67.925 4.010 1.038 1.00 0.00 O ATOM 1626 CB VAL A 76 68.154 3.136 -2.252 1.00 0.00 C ATOM 1627 CG1 VAL A 76 69.530 2.812 -1.662 1.00 0.00 C ATOM 1628 CG2 VAL A 76 67.689 1.958 -3.106 1.00 0.00 C ATOM 0 H VAL A 76 65.936 4.136 -2.735 1.00 0.00 H new ATOM 0 HA VAL A 76 66.915 2.445 -0.601 1.00 0.00 H new ATOM 0 HB VAL A 76 68.234 4.040 -2.856 1.00 0.00 H new ATOM 0 HG11 VAL A 76 70.243 2.648 -2.470 1.00 0.00 H new ATOM 0 HG12 VAL A 76 69.866 3.645 -1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 76 69.461 1.912 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 76 68.409 1.781 -3.905 1.00 0.00 H new ATOM 0 HG22 VAL A 76 67.610 1.066 -2.484 1.00 0.00 H new ATOM 0 HG23 VAL A 76 66.715 2.185 -3.539 1.00 0.00 H new ATOM 1638 N LEU A 77 68.002 5.570 -0.498 1.00 0.00 N ATOM 1639 CA LEU A 77 68.634 6.529 0.466 1.00 0.00 C ATOM 1640 C LEU A 77 67.679 6.967 1.582 1.00 0.00 C ATOM 1641 O LEU A 77 68.080 7.133 2.718 1.00 0.00 O ATOM 1642 CB LEU A 77 69.127 7.771 -0.291 1.00 0.00 C ATOM 1643 CG LEU A 77 69.862 8.745 0.678 1.00 0.00 C ATOM 1644 CD1 LEU A 77 71.072 9.374 -0.023 1.00 0.00 C ATOM 1645 CD2 LEU A 77 68.922 9.879 1.121 1.00 0.00 C ATOM 0 H LEU A 77 67.842 5.935 -1.437 1.00 0.00 H new ATOM 0 HA LEU A 77 69.467 6.005 0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 77 69.800 7.471 -1.094 1.00 0.00 H new ATOM 0 HB3 LEU A 77 68.283 8.280 -0.756 1.00 0.00 H new ATOM 0 HG LEU A 77 70.185 8.171 1.547 1.00 0.00 H new ATOM 0 HD11 LEU A 77 71.578 10.053 0.664 1.00 0.00 H new ATOM 0 HD12 LEU A 77 71.762 8.589 -0.332 1.00 0.00 H new ATOM 0 HD13 LEU A 77 70.737 9.928 -0.900 1.00 0.00 H new ATOM 0 HD21 LEU A 77 69.453 10.549 1.797 1.00 0.00 H new ATOM 0 HD22 LEU A 77 68.587 10.437 0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 77 68.058 9.456 1.634 1.00 0.00 H new ATOM 1657 N VAL A 78 66.447 7.201 1.273 1.00 0.00 N ATOM 1658 CA VAL A 78 65.486 7.686 2.309 1.00 0.00 C ATOM 1659 C VAL A 78 65.262 6.631 3.398 1.00 0.00 C ATOM 1660 O VAL A 78 65.141 6.942 4.566 1.00 0.00 O ATOM 1661 CB VAL A 78 64.153 7.980 1.624 1.00 0.00 C ATOM 1662 CG1 VAL A 78 64.365 8.998 0.495 1.00 0.00 C ATOM 1663 CG2 VAL A 78 63.584 6.666 1.061 1.00 0.00 C ATOM 0 H VAL A 78 66.051 7.079 0.341 1.00 0.00 H new ATOM 0 HA VAL A 78 65.895 8.580 2.779 1.00 0.00 H new ATOM 0 HB VAL A 78 63.449 8.401 2.341 1.00 0.00 H new ATOM 0 HG11 VAL A 78 63.412 9.205 0.008 1.00 0.00 H new ATOM 0 HG12 VAL A 78 64.770 9.922 0.909 1.00 0.00 H new ATOM 0 HG13 VAL A 78 65.064 8.591 -0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 78 62.631 6.863 0.569 1.00 0.00 H new ATOM 0 HG22 VAL A 78 64.285 6.246 0.340 1.00 0.00 H new ATOM 0 HG23 VAL A 78 63.432 5.957 1.875 1.00 0.00 H new ATOM 1673 N ALA A 79 65.189 5.394 3.017 1.00 0.00 N ATOM 1674 CA ALA A 79 64.952 4.310 4.015 1.00 0.00 C ATOM 1675 C ALA A 79 66.241 4.031 4.797 1.00 0.00 C ATOM 1676 O ALA A 79 66.212 3.546 5.909 1.00 0.00 O ATOM 1677 CB ALA A 79 64.474 3.038 3.311 1.00 0.00 C ATOM 0 H ALA A 79 65.283 5.079 2.052 1.00 0.00 H new ATOM 0 HA ALA A 79 64.178 4.633 4.712 1.00 0.00 H new ATOM 0 HB1 ALA A 79 64.305 2.255 4.050 1.00 0.00 H new ATOM 0 HB2 ALA A 79 63.544 3.243 2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 79 65.232 2.709 2.600 1.00 0.00 H new ATOM 1683 N ALA A 80 67.372 4.325 4.227 1.00 0.00 N ATOM 1684 CA ALA A 80 68.649 4.070 4.952 1.00 0.00 C ATOM 1685 C ALA A 80 68.788 5.051 6.128 1.00 0.00 C ATOM 1686 O ALA A 80 69.445 4.765 7.104 1.00 0.00 O ATOM 1687 CB ALA A 80 69.827 4.248 3.986 1.00 0.00 C ATOM 0 H ALA A 80 67.471 4.729 3.296 1.00 0.00 H new ATOM 0 HA ALA A 80 68.647 3.051 5.339 1.00 0.00 H new ATOM 0 HB1 ALA A 80 70.762 4.062 4.514 1.00 0.00 H new ATOM 0 HB2 ALA A 80 69.730 3.543 3.160 1.00 0.00 H new ATOM 0 HB3 ALA A 80 69.827 5.266 3.596 1.00 0.00 H new ATOM 1693 N LEU A 81 68.198 6.216 6.029 1.00 0.00 N ATOM 1694 CA LEU A 81 68.313 7.217 7.140 1.00 0.00 C ATOM 1695 C LEU A 81 67.197 6.995 8.171 1.00 0.00 C ATOM 1696 O LEU A 81 67.394 7.181 9.351 1.00 0.00 O ATOM 1697 CB LEU A 81 68.212 8.631 6.559 1.00 0.00 C ATOM 1698 CG LEU A 81 69.237 8.806 5.431 1.00 0.00 C ATOM 1699 CD1 LEU A 81 69.047 10.180 4.782 1.00 0.00 C ATOM 1700 CD2 LEU A 81 70.661 8.702 5.994 1.00 0.00 C ATOM 0 H LEU A 81 67.642 6.519 5.229 1.00 0.00 H new ATOM 0 HA LEU A 81 69.276 7.094 7.637 1.00 0.00 H new ATOM 0 HB2 LEU A 81 67.206 8.806 6.178 1.00 0.00 H new ATOM 0 HB3 LEU A 81 68.390 9.369 7.341 1.00 0.00 H new ATOM 0 HG LEU A 81 69.088 8.022 4.688 1.00 0.00 H new ATOM 0 HD11 LEU A 81 69.774 10.307 3.980 1.00 0.00 H new ATOM 0 HD12 LEU A 81 68.039 10.253 4.373 1.00 0.00 H new ATOM 0 HD13 LEU A 81 69.192 10.959 5.530 1.00 0.00 H new ATOM 0 HD21 LEU A 81 71.382 8.827 5.186 1.00 0.00 H new ATOM 0 HD22 LEU A 81 70.815 9.480 6.741 1.00 0.00 H new ATOM 0 HD23 LEU A 81 70.799 7.724 6.455 1.00 0.00 H new ATOM 1712 N THR A 82 66.029 6.624 7.741 1.00 0.00 N ATOM 1713 CA THR A 82 64.928 6.415 8.730 1.00 0.00 C ATOM 1714 C THR A 82 65.265 5.217 9.642 1.00 0.00 C ATOM 1715 O THR A 82 65.181 5.307 10.857 1.00 0.00 O ATOM 1716 CB THR A 82 63.585 6.200 8.013 1.00 0.00 C ATOM 1717 OG1 THR A 82 62.526 6.401 8.936 1.00 0.00 O ATOM 1718 CG2 THR A 82 63.498 4.786 7.444 1.00 0.00 C ATOM 0 H THR A 82 65.785 6.457 6.765 1.00 0.00 H new ATOM 0 HA THR A 82 64.834 7.308 9.348 1.00 0.00 H new ATOM 0 HB THR A 82 63.507 6.912 7.191 1.00 0.00 H new ATOM 0 HG1 THR A 82 62.004 5.576 9.020 1.00 0.00 H new ATOM 0 HG21 THR A 82 62.540 4.655 6.941 1.00 0.00 H new ATOM 0 HG22 THR A 82 64.307 4.631 6.730 1.00 0.00 H new ATOM 0 HG23 THR A 82 63.585 4.062 8.254 1.00 0.00 H new ATOM 1726 N VAL A 83 65.665 4.103 9.078 1.00 0.00 N ATOM 1727 CA VAL A 83 66.012 2.923 9.928 1.00 0.00 C ATOM 1728 C VAL A 83 67.305 3.190 10.681 1.00 0.00 C ATOM 1729 O VAL A 83 67.456 2.840 11.835 1.00 0.00 O ATOM 1730 CB VAL A 83 66.243 1.696 9.053 1.00 0.00 C ATOM 1731 CG1 VAL A 83 66.510 0.484 9.943 1.00 0.00 C ATOM 1732 CG2 VAL A 83 65.017 1.434 8.196 1.00 0.00 C ATOM 0 H VAL A 83 65.765 3.961 8.073 1.00 0.00 H new ATOM 0 HA VAL A 83 65.188 2.752 10.620 1.00 0.00 H new ATOM 0 HB VAL A 83 67.101 1.873 8.405 1.00 0.00 H new ATOM 0 HG11 VAL A 83 66.676 -0.395 9.320 1.00 0.00 H new ATOM 0 HG12 VAL A 83 67.394 0.668 10.553 1.00 0.00 H new ATOM 0 HG13 VAL A 83 65.651 0.313 10.592 1.00 0.00 H new ATOM 0 HG21 VAL A 83 65.189 0.556 7.573 1.00 0.00 H new ATOM 0 HG22 VAL A 83 64.154 1.260 8.839 1.00 0.00 H new ATOM 0 HG23 VAL A 83 64.826 2.298 7.560 1.00 0.00 H new ATOM 1742 N ALA A 84 68.255 3.774 10.016 1.00 0.00 N ATOM 1743 CA ALA A 84 69.562 4.031 10.661 1.00 0.00 C ATOM 1744 C ALA A 84 69.392 4.974 11.850 1.00 0.00 C ATOM 1745 O ALA A 84 70.121 4.901 12.818 1.00 0.00 O ATOM 1746 CB ALA A 84 70.525 4.655 9.653 1.00 0.00 C ATOM 0 H ALA A 84 68.180 4.086 9.048 1.00 0.00 H new ATOM 0 HA ALA A 84 69.967 3.083 11.014 1.00 0.00 H new ATOM 0 HB1 ALA A 84 71.485 4.842 10.134 1.00 0.00 H new ATOM 0 HB2 ALA A 84 70.666 3.973 8.814 1.00 0.00 H new ATOM 0 HB3 ALA A 84 70.112 5.596 9.290 1.00 0.00 H new ATOM 1752 N CYS A 85 68.438 5.857 11.789 1.00 0.00 N ATOM 1753 CA CYS A 85 68.221 6.803 12.915 1.00 0.00 C ATOM 1754 C CYS A 85 67.817 6.018 14.162 1.00 0.00 C ATOM 1755 O CYS A 85 68.247 6.308 15.261 1.00 0.00 O ATOM 1756 CB CYS A 85 67.107 7.783 12.535 1.00 0.00 C ATOM 1757 SG CYS A 85 67.738 8.987 11.342 1.00 0.00 S ATOM 0 H CYS A 85 67.796 5.965 11.004 1.00 0.00 H new ATOM 0 HA CYS A 85 69.138 7.356 13.120 1.00 0.00 H new ATOM 0 HB2 CYS A 85 66.263 7.242 12.108 1.00 0.00 H new ATOM 0 HB3 CYS A 85 66.741 8.295 13.425 1.00 0.00 H new ATOM 0 HG CYS A 85 67.737 8.461 10.153 1.00 0.00 H new ATOM 1763 N ASN A 86 66.994 5.018 13.994 1.00 0.00 N ATOM 1764 CA ASN A 86 66.556 4.201 15.164 1.00 0.00 C ATOM 1765 C ASN A 86 67.731 3.367 15.676 1.00 0.00 C ATOM 1766 O ASN A 86 67.819 3.040 16.843 1.00 0.00 O ATOM 1767 CB ASN A 86 65.435 3.259 14.726 1.00 0.00 C ATOM 1768 CG ASN A 86 64.253 4.080 14.216 1.00 0.00 C ATOM 1769 OD1 ASN A 86 63.545 3.631 13.218 1.00 0.00 O flip ATOM 1770 ND2 ASN A 86 63.974 5.148 14.727 1.00 0.00 N flip ATOM 0 H ASN A 86 66.605 4.731 13.096 1.00 0.00 H new ATOM 0 HA ASN A 86 66.203 4.862 15.955 1.00 0.00 H new ATOM 0 HB2 ASN A 86 65.792 2.590 13.943 1.00 0.00 H new ATOM 0 HB3 ASN A 86 65.123 2.633 15.562 1.00 0.00 H new ATOM 0 HD21 ASN A 86 64.528 5.500 15.508 1.00 0.00 H new ATOM 0 HD22 ASN A 86 63.186 5.692 14.374 1.00 0.00 H new ATOM 1777 N ASN A 87 68.617 3.000 14.797 1.00 0.00 N ATOM 1778 CA ASN A 87 69.782 2.159 15.189 1.00 0.00 C ATOM 1779 C ASN A 87 70.638 2.864 16.246 1.00 0.00 C ATOM 1780 O ASN A 87 71.133 2.239 17.163 1.00 0.00 O ATOM 1781 CB ASN A 87 70.630 1.886 13.947 1.00 0.00 C ATOM 1782 CG ASN A 87 71.834 1.022 14.323 1.00 0.00 C ATOM 1783 OD1 ASN A 87 71.843 0.391 15.361 1.00 0.00 O ATOM 1784 ND2 ASN A 87 72.855 0.963 13.513 1.00 0.00 N ATOM 0 H ASN A 87 68.584 3.250 13.809 1.00 0.00 H new ATOM 0 HA ASN A 87 69.416 1.225 15.615 1.00 0.00 H new ATOM 0 HB2 ASN A 87 70.030 1.381 13.190 1.00 0.00 H new ATOM 0 HB3 ASN A 87 70.967 2.827 13.512 1.00 0.00 H new ATOM 0 HD21 ASN A 87 73.662 0.387 13.751 1.00 0.00 H new ATOM 0 HD22 ASN A 87 72.846 1.493 12.642 1.00 0.00 H new ATOM 1905 N SER B 2 49.101 10.457 5.699 1.00 0.00 N ATOM 1906 CA SER B 2 49.332 9.632 6.926 1.00 0.00 C ATOM 1907 C SER B 2 49.617 8.188 6.505 1.00 0.00 C ATOM 1908 O SER B 2 49.933 7.343 7.318 1.00 0.00 O ATOM 1909 CB SER B 2 48.085 9.675 7.813 1.00 0.00 C ATOM 1910 OG SER B 2 46.981 9.138 7.098 1.00 0.00 O ATOM 0 HA SER B 2 50.181 10.026 7.485 1.00 0.00 H new ATOM 0 HB2 SER B 2 48.254 9.104 8.726 1.00 0.00 H new ATOM 0 HB3 SER B 2 47.874 10.701 8.114 1.00 0.00 H new ATOM 0 HG SER B 2 47.034 9.414 6.159 1.00 0.00 H new ATOM 1916 N GLU B 3 49.510 7.902 5.235 1.00 0.00 N ATOM 1917 CA GLU B 3 49.778 6.514 4.756 1.00 0.00 C ATOM 1918 C GLU B 3 51.268 6.204 4.890 1.00 0.00 C ATOM 1919 O GLU B 3 51.655 5.180 5.402 1.00 0.00 O ATOM 1920 CB GLU B 3 49.379 6.397 3.280 1.00 0.00 C ATOM 1921 CG GLU B 3 47.860 6.519 3.141 1.00 0.00 C ATOM 1922 CD GLU B 3 47.182 5.316 3.801 1.00 0.00 C ATOM 1923 OE1 GLU B 3 47.525 4.200 3.446 1.00 0.00 O ATOM 1924 OE2 GLU B 3 46.336 5.533 4.653 1.00 0.00 O ATOM 0 H GLU B 3 49.249 8.569 4.509 1.00 0.00 H new ATOM 0 HA GLU B 3 49.199 5.811 5.355 1.00 0.00 H new ATOM 0 HB2 GLU B 3 49.870 7.177 2.698 1.00 0.00 H new ATOM 0 HB3 GLU B 3 49.714 5.441 2.878 1.00 0.00 H new ATOM 0 HG2 GLU B 3 47.516 7.443 3.606 1.00 0.00 H new ATOM 0 HG3 GLU B 3 47.585 6.571 2.088 1.00 0.00 H new ATOM 1931 N LEU B 4 52.105 7.053 4.382 1.00 0.00 N ATOM 1932 CA LEU B 4 53.570 6.778 4.431 1.00 0.00 C ATOM 1933 C LEU B 4 54.023 6.635 5.891 1.00 0.00 C ATOM 1934 O LEU B 4 54.813 5.773 6.226 1.00 0.00 O ATOM 1935 CB LEU B 4 54.306 7.916 3.722 1.00 0.00 C ATOM 1936 CG LEU B 4 55.839 7.717 3.735 1.00 0.00 C ATOM 1937 CD1 LEU B 4 56.202 6.278 3.366 1.00 0.00 C ATOM 1938 CD2 LEU B 4 56.470 8.648 2.696 1.00 0.00 C ATOM 0 H LEU B 4 51.843 7.930 3.932 1.00 0.00 H new ATOM 0 HA LEU B 4 53.801 5.842 3.922 1.00 0.00 H new ATOM 0 HB2 LEU B 4 53.959 7.984 2.691 1.00 0.00 H new ATOM 0 HB3 LEU B 4 54.060 8.862 4.205 1.00 0.00 H new ATOM 0 HG LEU B 4 56.208 7.937 4.737 1.00 0.00 H new ATOM 0 HD11 LEU B 4 57.286 6.161 3.381 1.00 0.00 H new ATOM 0 HD12 LEU B 4 55.753 5.593 4.085 1.00 0.00 H new ATOM 0 HD13 LEU B 4 55.827 6.053 2.368 1.00 0.00 H new ATOM 0 HD21 LEU B 4 57.552 8.515 2.698 1.00 0.00 H new ATOM 0 HD22 LEU B 4 56.077 8.410 1.708 1.00 0.00 H new ATOM 0 HD23 LEU B 4 56.231 9.683 2.942 1.00 0.00 H new ATOM 1950 N GLU B 5 53.501 7.447 6.765 1.00 0.00 N ATOM 1951 CA GLU B 5 53.863 7.344 8.209 1.00 0.00 C ATOM 1952 C GLU B 5 53.649 5.906 8.674 1.00 0.00 C ATOM 1953 O GLU B 5 54.498 5.289 9.299 1.00 0.00 O ATOM 1954 CB GLU B 5 52.905 8.251 8.992 1.00 0.00 C ATOM 1955 CG GLU B 5 53.253 8.214 10.482 1.00 0.00 C ATOM 1956 CD GLU B 5 52.339 9.178 11.242 1.00 0.00 C ATOM 1957 OE1 GLU B 5 51.631 9.929 10.591 1.00 0.00 O ATOM 1958 OE2 GLU B 5 52.363 9.150 12.461 1.00 0.00 O ATOM 0 H GLU B 5 52.833 8.185 6.541 1.00 0.00 H new ATOM 0 HA GLU B 5 54.902 7.635 8.366 1.00 0.00 H new ATOM 0 HB2 GLU B 5 52.972 9.273 8.619 1.00 0.00 H new ATOM 0 HB3 GLU B 5 51.876 7.924 8.842 1.00 0.00 H new ATOM 0 HG2 GLU B 5 53.135 7.202 10.869 1.00 0.00 H new ATOM 0 HG3 GLU B 5 54.297 8.492 10.630 1.00 0.00 H new ATOM 1965 N THR B 6 52.508 5.372 8.368 1.00 0.00 N ATOM 1966 CA THR B 6 52.197 3.986 8.775 1.00 0.00 C ATOM 1967 C THR B 6 53.147 3.008 8.100 1.00 0.00 C ATOM 1968 O THR B 6 53.447 1.978 8.641 1.00 0.00 O ATOM 1969 CB THR B 6 50.769 3.642 8.360 1.00 0.00 C ATOM 1970 OG1 THR B 6 50.603 3.880 6.974 1.00 0.00 O ATOM 1971 CG2 THR B 6 49.781 4.496 9.150 1.00 0.00 C ATOM 0 H THR B 6 51.769 5.844 7.847 1.00 0.00 H new ATOM 0 HA THR B 6 52.307 3.910 9.857 1.00 0.00 H new ATOM 0 HB THR B 6 50.580 2.589 8.569 1.00 0.00 H new ATOM 0 HG1 THR B 6 51.350 4.421 6.643 1.00 0.00 H new ATOM 0 HG21 THR B 6 48.763 4.246 8.850 1.00 0.00 H new ATOM 0 HG22 THR B 6 49.903 4.302 10.216 1.00 0.00 H new ATOM 0 HG23 THR B 6 49.970 5.551 8.949 1.00 0.00 H new ATOM 1979 N ALA B 7 53.579 3.302 6.906 1.00 0.00 N ATOM 1980 CA ALA B 7 54.464 2.347 6.174 1.00 0.00 C ATOM 1981 C ALA B 7 55.648 1.947 7.059 1.00 0.00 C ATOM 1982 O ALA B 7 55.955 0.793 7.222 1.00 0.00 O ATOM 1983 CB ALA B 7 54.974 3.011 4.897 1.00 0.00 C ATOM 0 H ALA B 7 53.359 4.162 6.403 1.00 0.00 H new ATOM 0 HA ALA B 7 53.897 1.452 5.919 1.00 0.00 H new ATOM 0 HB1 ALA B 7 55.621 2.317 4.359 1.00 0.00 H new ATOM 0 HB2 ALA B 7 54.128 3.282 4.265 1.00 0.00 H new ATOM 0 HB3 ALA B 7 55.538 3.908 5.153 1.00 0.00 H new ATOM 1989 N MET B 8 56.323 2.908 7.630 1.00 0.00 N ATOM 1990 CA MET B 8 57.480 2.578 8.498 1.00 0.00 C ATOM 1991 C MET B 8 56.996 1.708 9.662 1.00 0.00 C ATOM 1992 O MET B 8 57.655 0.772 10.066 1.00 0.00 O ATOM 1993 CB MET B 8 58.079 3.878 9.037 1.00 0.00 C ATOM 1994 CG MET B 8 59.350 3.577 9.829 1.00 0.00 C ATOM 1995 SD MET B 8 60.039 5.129 10.448 1.00 0.00 S ATOM 1996 CE MET B 8 61.409 4.412 11.382 1.00 0.00 C ATOM 0 H MET B 8 56.121 3.903 7.531 1.00 0.00 H new ATOM 0 HA MET B 8 58.237 2.036 7.931 1.00 0.00 H new ATOM 0 HB2 MET B 8 58.306 4.553 8.212 1.00 0.00 H new ATOM 0 HB3 MET B 8 57.355 4.385 9.674 1.00 0.00 H new ATOM 0 HG2 MET B 8 59.127 2.907 10.659 1.00 0.00 H new ATOM 0 HG3 MET B 8 60.077 3.069 9.196 1.00 0.00 H new ATOM 0 HE1 MET B 8 61.992 5.209 11.843 1.00 0.00 H new ATOM 0 HE2 MET B 8 61.016 3.755 12.158 1.00 0.00 H new ATOM 0 HE3 MET B 8 62.047 3.839 10.710 1.00 0.00 H new ATOM 2006 N GLU B 9 55.851 2.016 10.206 1.00 0.00 N ATOM 2007 CA GLU B 9 55.323 1.211 11.358 1.00 0.00 C ATOM 2008 C GLU B 9 55.119 -0.273 10.978 1.00 0.00 C ATOM 2009 O GLU B 9 55.398 -1.163 11.757 1.00 0.00 O ATOM 2010 CB GLU B 9 53.975 1.800 11.787 1.00 0.00 C ATOM 2011 CG GLU B 9 53.469 1.091 13.047 1.00 0.00 C ATOM 2012 CD GLU B 9 52.126 1.694 13.461 1.00 0.00 C ATOM 2013 OE1 GLU B 9 51.734 2.682 12.862 1.00 0.00 O ATOM 2014 OE2 GLU B 9 51.515 1.164 14.374 1.00 0.00 O ATOM 0 H GLU B 9 55.255 2.788 9.907 1.00 0.00 H new ATOM 0 HA GLU B 9 56.052 1.255 12.167 1.00 0.00 H new ATOM 0 HB2 GLU B 9 54.080 2.868 11.978 1.00 0.00 H new ATOM 0 HB3 GLU B 9 53.248 1.690 10.982 1.00 0.00 H new ATOM 0 HG2 GLU B 9 53.358 0.023 12.858 1.00 0.00 H new ATOM 0 HG3 GLU B 9 54.193 1.198 13.854 1.00 0.00 H new ATOM 2021 N THR B 10 54.599 -0.542 9.812 1.00 0.00 N ATOM 2022 CA THR B 10 54.338 -1.966 9.420 1.00 0.00 C ATOM 2023 C THR B 10 55.639 -2.702 9.121 1.00 0.00 C ATOM 2024 O THR B 10 55.819 -3.837 9.504 1.00 0.00 O ATOM 2025 CB THR B 10 53.455 -2.047 8.171 1.00 0.00 C ATOM 2026 OG1 THR B 10 53.637 -3.320 7.581 1.00 0.00 O ATOM 2027 CG2 THR B 10 53.846 -0.990 7.152 1.00 0.00 C ATOM 0 H THR B 10 54.343 0.155 9.113 1.00 0.00 H new ATOM 0 HA THR B 10 53.830 -2.432 10.265 1.00 0.00 H new ATOM 0 HB THR B 10 52.418 -1.884 8.464 1.00 0.00 H new ATOM 0 HG1 THR B 10 53.322 -3.298 6.653 1.00 0.00 H new ATOM 0 HG21 THR B 10 53.202 -1.073 6.277 1.00 0.00 H new ATOM 0 HG22 THR B 10 53.733 0.000 7.593 1.00 0.00 H new ATOM 0 HG23 THR B 10 54.884 -1.138 6.854 1.00 0.00 H new ATOM 2035 N LEU B 11 56.530 -2.072 8.413 1.00 0.00 N ATOM 2036 CA LEU B 11 57.806 -2.741 8.050 1.00 0.00 C ATOM 2037 C LEU B 11 58.523 -3.223 9.309 1.00 0.00 C ATOM 2038 O LEU B 11 59.091 -4.287 9.327 1.00 0.00 O ATOM 2039 CB LEU B 11 58.733 -1.725 7.363 1.00 0.00 C ATOM 2040 CG LEU B 11 58.160 -1.270 6.011 1.00 0.00 C ATOM 2041 CD1 LEU B 11 58.985 -0.079 5.495 1.00 0.00 C ATOM 2042 CD2 LEU B 11 58.216 -2.427 4.979 1.00 0.00 C ATOM 0 H LEU B 11 56.429 -1.117 8.068 1.00 0.00 H new ATOM 0 HA LEU B 11 57.580 -3.581 7.393 1.00 0.00 H new ATOM 0 HB2 LEU B 11 58.871 -0.860 8.011 1.00 0.00 H new ATOM 0 HB3 LEU B 11 59.716 -2.171 7.212 1.00 0.00 H new ATOM 0 HG LEU B 11 57.119 -0.976 6.145 1.00 0.00 H new ATOM 0 HD11 LEU B 11 58.586 0.251 4.536 1.00 0.00 H new ATOM 0 HD12 LEU B 11 58.930 0.740 6.212 1.00 0.00 H new ATOM 0 HD13 LEU B 11 60.024 -0.383 5.371 1.00 0.00 H new ATOM 0 HD21 LEU B 11 57.806 -2.087 4.028 1.00 0.00 H new ATOM 0 HD22 LEU B 11 59.251 -2.739 4.837 1.00 0.00 H new ATOM 0 HD23 LEU B 11 57.630 -3.270 5.345 1.00 0.00 H new ATOM 2054 N ILE B 12 58.522 -2.434 10.342 1.00 0.00 N ATOM 2055 CA ILE B 12 59.236 -2.822 11.597 1.00 0.00 C ATOM 2056 C ILE B 12 58.416 -3.835 12.414 1.00 0.00 C ATOM 2057 O ILE B 12 58.972 -4.645 13.128 1.00 0.00 O ATOM 2058 CB ILE B 12 59.525 -1.562 12.412 1.00 0.00 C ATOM 2059 CG1 ILE B 12 60.241 -0.545 11.513 1.00 0.00 C ATOM 2060 CG2 ILE B 12 60.421 -1.910 13.605 1.00 0.00 C ATOM 2061 CD1 ILE B 12 60.456 0.756 12.280 1.00 0.00 C ATOM 0 H ILE B 12 58.055 -1.528 10.376 1.00 0.00 H new ATOM 0 HA ILE B 12 60.176 -3.309 11.339 1.00 0.00 H new ATOM 0 HB ILE B 12 58.590 -1.140 12.781 1.00 0.00 H new ATOM 0 HG12 ILE B 12 61.199 -0.947 11.184 1.00 0.00 H new ATOM 0 HG13 ILE B 12 59.649 -0.357 10.617 1.00 0.00 H new ATOM 0 HG21 ILE B 12 60.624 -1.008 14.183 1.00 0.00 H new ATOM 0 HG22 ILE B 12 59.917 -2.641 14.238 1.00 0.00 H new ATOM 0 HG23 ILE B 12 61.360 -2.329 13.244 1.00 0.00 H new ATOM 0 HD11 ILE B 12 60.965 1.476 11.639 1.00 0.00 H new ATOM 0 HD12 ILE B 12 59.492 1.161 12.587 1.00 0.00 H new ATOM 0 HD13 ILE B 12 61.066 0.562 13.162 1.00 0.00 H new ATOM 2073 N ASN B 13 57.125 -3.805 12.337 1.00 0.00 N ATOM 2074 CA ASN B 13 56.327 -4.785 13.129 1.00 0.00 C ATOM 2075 C ASN B 13 56.695 -6.210 12.701 1.00 0.00 C ATOM 2076 O ASN B 13 56.792 -7.115 13.507 1.00 0.00 O ATOM 2077 CB ASN B 13 54.836 -4.547 12.893 1.00 0.00 C ATOM 2078 CG ASN B 13 54.026 -5.574 13.686 1.00 0.00 C ATOM 2079 OD1 ASN B 13 53.355 -6.407 13.112 1.00 0.00 O ATOM 2080 ND2 ASN B 13 54.064 -5.557 14.990 1.00 0.00 N ATOM 0 H ASN B 13 56.584 -3.154 11.768 1.00 0.00 H new ATOM 0 HA ASN B 13 56.547 -4.657 14.189 1.00 0.00 H new ATOM 0 HB2 ASN B 13 54.564 -3.537 13.201 1.00 0.00 H new ATOM 0 HB3 ASN B 13 54.607 -4.629 11.830 1.00 0.00 H new ATOM 0 HD21 ASN B 13 53.531 -6.243 15.525 1.00 0.00 H new ATOM 0 HD22 ASN B 13 54.627 -4.858 15.475 1.00 0.00 H new ATOM 2087 N VAL B 14 56.879 -6.406 11.427 1.00 0.00 N ATOM 2088 CA VAL B 14 57.216 -7.770 10.918 1.00 0.00 C ATOM 2089 C VAL B 14 58.726 -8.041 11.001 1.00 0.00 C ATOM 2090 O VAL B 14 59.156 -9.161 11.190 1.00 0.00 O ATOM 2091 CB VAL B 14 56.762 -7.899 9.468 1.00 0.00 C ATOM 2092 CG1 VAL B 14 55.234 -7.948 9.411 1.00 0.00 C ATOM 2093 CG2 VAL B 14 57.271 -6.713 8.642 1.00 0.00 C ATOM 0 H VAL B 14 56.811 -5.682 10.712 1.00 0.00 H new ATOM 0 HA VAL B 14 56.701 -8.501 11.542 1.00 0.00 H new ATOM 0 HB VAL B 14 57.172 -8.819 9.051 1.00 0.00 H new ATOM 0 HG11 VAL B 14 54.911 -8.040 8.374 1.00 0.00 H new ATOM 0 HG12 VAL B 14 54.876 -8.806 9.980 1.00 0.00 H new ATOM 0 HG13 VAL B 14 54.824 -7.033 9.838 1.00 0.00 H new ATOM 0 HG21 VAL B 14 56.939 -6.820 7.609 1.00 0.00 H new ATOM 0 HG22 VAL B 14 56.877 -5.785 9.056 1.00 0.00 H new ATOM 0 HG23 VAL B 14 58.360 -6.690 8.672 1.00 0.00 H new ATOM 2103 N PHE B 15 59.530 -7.032 10.820 1.00 0.00 N ATOM 2104 CA PHE B 15 61.009 -7.222 10.845 1.00 0.00 C ATOM 2105 C PHE B 15 61.455 -7.777 12.197 1.00 0.00 C ATOM 2106 O PHE B 15 62.141 -8.773 12.282 1.00 0.00 O ATOM 2107 CB PHE B 15 61.683 -5.844 10.611 1.00 0.00 C ATOM 2108 CG PHE B 15 62.777 -5.961 9.573 1.00 0.00 C ATOM 2109 CD1 PHE B 15 63.732 -6.976 9.682 1.00 0.00 C ATOM 2110 CD2 PHE B 15 62.823 -5.068 8.494 1.00 0.00 C ATOM 2111 CE1 PHE B 15 64.733 -7.097 8.716 1.00 0.00 C ATOM 2112 CE2 PHE B 15 63.822 -5.195 7.528 1.00 0.00 C ATOM 2113 CZ PHE B 15 64.775 -6.208 7.641 1.00 0.00 C ATOM 0 H PHE B 15 59.224 -6.073 10.654 1.00 0.00 H new ATOM 0 HA PHE B 15 61.297 -7.929 10.067 1.00 0.00 H new ATOM 0 HB2 PHE B 15 60.938 -5.119 10.283 1.00 0.00 H new ATOM 0 HB3 PHE B 15 62.100 -5.472 11.547 1.00 0.00 H new ATOM 0 HD1 PHE B 15 63.696 -7.666 10.512 1.00 0.00 H new ATOM 0 HD2 PHE B 15 62.086 -4.283 8.410 1.00 0.00 H new ATOM 0 HE1 PHE B 15 65.474 -7.878 8.801 1.00 0.00 H new ATOM 0 HE2 PHE B 15 63.858 -4.510 6.694 1.00 0.00 H new ATOM 0 HZ PHE B 15 65.548 -6.304 6.893 1.00 0.00 H new ATOM 2123 N HIS B 16 61.092 -7.105 13.246 1.00 0.00 N ATOM 2124 CA HIS B 16 61.508 -7.539 14.604 1.00 0.00 C ATOM 2125 C HIS B 16 60.730 -8.773 15.056 1.00 0.00 C ATOM 2126 O HIS B 16 61.167 -9.489 15.935 1.00 0.00 O ATOM 2127 CB HIS B 16 61.259 -6.397 15.591 1.00 0.00 C ATOM 2128 CG HIS B 16 62.204 -5.253 15.313 1.00 0.00 C ATOM 2129 ND1 HIS B 16 61.851 -3.936 15.568 1.00 0.00 N ATOM 2130 CD2 HIS B 16 63.488 -5.206 14.815 1.00 0.00 C ATOM 2131 CE1 HIS B 16 62.898 -3.160 15.230 1.00 0.00 C ATOM 2132 NE2 HIS B 16 63.917 -3.885 14.768 1.00 0.00 N ATOM 0 H HIS B 16 60.517 -6.263 13.222 1.00 0.00 H new ATOM 0 HA HIS B 16 62.567 -7.796 14.574 1.00 0.00 H new ATOM 0 HB2 HIS B 16 60.227 -6.054 15.509 1.00 0.00 H new ATOM 0 HB3 HIS B 16 61.397 -6.752 16.612 1.00 0.00 H new ATOM 0 HD2 HIS B 16 64.070 -6.062 14.509 1.00 0.00 H new ATOM 0 HE1 HIS B 16 62.911 -2.084 15.322 1.00 0.00 H new ATOM 0 HE2 HIS B 16 64.822 -3.542 14.447 1.00 0.00 H new ATOM 2141 N ALA B 17 59.573 -9.029 14.508 1.00 0.00 N ATOM 2142 CA ALA B 17 58.803 -10.211 14.981 1.00 0.00 C ATOM 2143 C ALA B 17 59.396 -11.518 14.441 1.00 0.00 C ATOM 2144 O ALA B 17 59.773 -12.389 15.200 1.00 0.00 O ATOM 2145 CB ALA B 17 57.351 -10.083 14.518 1.00 0.00 C ATOM 0 H ALA B 17 59.135 -8.482 13.767 1.00 0.00 H new ATOM 0 HA ALA B 17 58.854 -10.240 16.069 1.00 0.00 H new ATOM 0 HB1 ALA B 17 56.782 -10.947 14.862 1.00 0.00 H new ATOM 0 HB2 ALA B 17 56.916 -9.173 14.932 1.00 0.00 H new ATOM 0 HB3 ALA B 17 57.319 -10.037 13.429 1.00 0.00 H new ATOM 2151 N HIS B 18 59.423 -11.704 13.151 1.00 0.00 N ATOM 2152 CA HIS B 18 59.922 -13.001 12.607 1.00 0.00 C ATOM 2153 C HIS B 18 61.433 -13.165 12.804 1.00 0.00 C ATOM 2154 O HIS B 18 61.915 -14.243 13.082 1.00 0.00 O ATOM 2155 CB HIS B 18 59.606 -13.060 11.112 1.00 0.00 C ATOM 2156 CG HIS B 18 58.121 -13.207 10.925 1.00 0.00 C ATOM 2157 ND1 HIS B 18 57.268 -12.112 10.933 1.00 0.00 N ATOM 2158 CD2 HIS B 18 57.322 -14.306 10.740 1.00 0.00 C ATOM 2159 CE1 HIS B 18 56.016 -12.573 10.759 1.00 0.00 C ATOM 2160 NE2 HIS B 18 55.996 -13.901 10.636 1.00 0.00 N ATOM 0 H HIS B 18 59.124 -11.022 12.454 1.00 0.00 H new ATOM 0 HA HIS B 18 59.426 -13.807 13.147 1.00 0.00 H new ATOM 0 HB2 HIS B 18 59.959 -12.155 10.618 1.00 0.00 H new ATOM 0 HB3 HIS B 18 60.127 -13.899 10.651 1.00 0.00 H new ATOM 0 HD2 HIS B 18 57.669 -15.327 10.684 1.00 0.00 H new ATOM 0 HE1 HIS B 18 55.137 -11.946 10.723 1.00 0.00 H new ATOM 0 HE2 HIS B 18 55.179 -14.495 10.495 1.00 0.00 H new ATOM 2169 N SER B 19 62.187 -12.117 12.620 1.00 0.00 N ATOM 2170 CA SER B 19 63.671 -12.220 12.748 1.00 0.00 C ATOM 2171 C SER B 19 64.081 -12.729 14.125 1.00 0.00 C ATOM 2172 O SER B 19 65.183 -13.210 14.304 1.00 0.00 O ATOM 2173 CB SER B 19 64.288 -10.842 12.544 1.00 0.00 C ATOM 2174 OG SER B 19 64.116 -10.442 11.192 1.00 0.00 O ATOM 0 H SER B 19 61.839 -11.188 12.385 1.00 0.00 H new ATOM 0 HA SER B 19 64.023 -12.925 11.995 1.00 0.00 H new ATOM 0 HB2 SER B 19 63.818 -10.119 13.211 1.00 0.00 H new ATOM 0 HB3 SER B 19 65.348 -10.866 12.795 1.00 0.00 H new ATOM 0 HG SER B 19 63.418 -9.756 11.140 1.00 0.00 H new ATOM 2180 N GLY B 20 63.223 -12.620 15.099 1.00 0.00 N ATOM 2181 CA GLY B 20 63.575 -13.087 16.480 1.00 0.00 C ATOM 2182 C GLY B 20 62.694 -14.268 16.874 1.00 0.00 C ATOM 2183 O GLY B 20 62.546 -14.570 18.040 1.00 0.00 O ATOM 0 H GLY B 20 62.287 -12.226 15.004 1.00 0.00 H new ATOM 0 HA2 GLY B 20 64.625 -13.378 16.517 1.00 0.00 H new ATOM 0 HA3 GLY B 20 63.444 -12.272 17.192 1.00 0.00 H new ATOM 2187 N LYS B 21 62.108 -14.954 15.927 1.00 0.00 N ATOM 2188 CA LYS B 21 61.256 -16.115 16.311 1.00 0.00 C ATOM 2189 C LYS B 21 62.168 -17.252 16.775 1.00 0.00 C ATOM 2190 O LYS B 21 61.956 -17.855 17.807 1.00 0.00 O ATOM 2191 CB LYS B 21 60.403 -16.564 15.115 1.00 0.00 C ATOM 2192 CG LYS B 21 59.362 -17.609 15.565 1.00 0.00 C ATOM 2193 CD LYS B 21 58.100 -16.913 16.122 1.00 0.00 C ATOM 2194 CE LYS B 21 57.121 -16.604 14.984 1.00 0.00 C ATOM 2195 NZ LYS B 21 56.626 -17.881 14.394 1.00 0.00 N ATOM 0 H LYS B 21 62.180 -14.766 14.927 1.00 0.00 H new ATOM 0 HA LYS B 21 60.581 -15.832 17.119 1.00 0.00 H new ATOM 0 HB2 LYS B 21 59.899 -15.704 14.676 1.00 0.00 H new ATOM 0 HB3 LYS B 21 61.043 -16.988 14.341 1.00 0.00 H new ATOM 0 HG2 LYS B 21 59.091 -18.246 14.723 1.00 0.00 H new ATOM 0 HG3 LYS B 21 59.794 -18.256 16.328 1.00 0.00 H new ATOM 0 HD2 LYS B 21 57.619 -17.553 16.862 1.00 0.00 H new ATOM 0 HD3 LYS B 21 58.379 -15.991 16.632 1.00 0.00 H new ATOM 0 HE2 LYS B 21 56.284 -16.016 15.360 1.00 0.00 H new ATOM 0 HE3 LYS B 21 57.614 -16.004 14.219 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 55.657 -17.748 14.041 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 57.245 -18.163 13.607 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 56.630 -18.624 15.121 1.00 0.00 H new ATOM 2265 N TYR B 26 67.948 -10.027 16.934 1.00 0.00 N ATOM 2266 CA TYR B 26 67.613 -9.203 15.735 1.00 0.00 C ATOM 2267 C TYR B 26 68.688 -9.336 14.649 1.00 0.00 C ATOM 2268 O TYR B 26 69.338 -8.382 14.267 1.00 0.00 O ATOM 2269 CB TYR B 26 67.435 -7.734 16.127 1.00 0.00 C ATOM 2270 CG TYR B 26 66.371 -7.614 17.199 1.00 0.00 C ATOM 2271 CD1 TYR B 26 65.043 -7.949 16.908 1.00 0.00 C ATOM 2272 CD2 TYR B 26 66.712 -7.162 18.482 1.00 0.00 C ATOM 2273 CE1 TYR B 26 64.057 -7.834 17.898 1.00 0.00 C ATOM 2274 CE2 TYR B 26 65.726 -7.047 19.469 1.00 0.00 C ATOM 2275 CZ TYR B 26 64.399 -7.383 19.178 1.00 0.00 C ATOM 2276 OH TYR B 26 63.428 -7.267 20.153 1.00 0.00 O ATOM 0 HA TYR B 26 66.673 -9.576 15.327 1.00 0.00 H new ATOM 0 HB2 TYR B 26 68.379 -7.328 16.492 1.00 0.00 H new ATOM 0 HB3 TYR B 26 67.152 -7.147 15.253 1.00 0.00 H new ATOM 0 HD1 TYR B 26 64.778 -8.296 15.920 1.00 0.00 H new ATOM 0 HD2 TYR B 26 67.736 -6.903 18.709 1.00 0.00 H new ATOM 0 HE1 TYR B 26 63.033 -8.094 17.673 1.00 0.00 H new ATOM 0 HE2 TYR B 26 65.990 -6.698 20.457 1.00 0.00 H new ATOM 0 HH TYR B 26 63.835 -6.942 20.983 1.00 0.00 H new ATOM 2286 N LYS B 27 68.817 -10.520 14.111 1.00 0.00 N ATOM 2287 CA LYS B 27 69.771 -10.778 12.994 1.00 0.00 C ATOM 2288 C LYS B 27 69.034 -11.709 12.032 1.00 0.00 C ATOM 2289 O LYS B 27 68.330 -12.596 12.469 1.00 0.00 O ATOM 2290 CB LYS B 27 71.034 -11.464 13.524 1.00 0.00 C ATOM 2291 CG LYS B 27 72.099 -11.550 12.418 1.00 0.00 C ATOM 2292 CD LYS B 27 72.524 -10.128 11.981 1.00 0.00 C ATOM 2293 CE LYS B 27 73.994 -10.120 11.555 1.00 0.00 C ATOM 2294 NZ LYS B 27 74.402 -8.727 11.217 1.00 0.00 N ATOM 0 H LYS B 27 68.287 -11.339 14.408 1.00 0.00 H new ATOM 0 HA LYS B 27 70.082 -9.854 12.507 1.00 0.00 H new ATOM 0 HB2 LYS B 27 71.428 -10.908 14.375 1.00 0.00 H new ATOM 0 HB3 LYS B 27 70.790 -12.464 13.882 1.00 0.00 H new ATOM 0 HG2 LYS B 27 72.966 -12.103 12.779 1.00 0.00 H new ATOM 0 HG3 LYS B 27 71.704 -12.099 11.563 1.00 0.00 H new ATOM 0 HD2 LYS B 27 71.897 -9.792 11.155 1.00 0.00 H new ATOM 0 HD3 LYS B 27 72.373 -9.427 12.802 1.00 0.00 H new ATOM 0 HE2 LYS B 27 74.619 -10.509 12.358 1.00 0.00 H new ATOM 0 HE3 LYS B 27 74.138 -10.772 10.694 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 75.439 -8.653 11.242 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 74.060 -8.487 10.265 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 73.992 -8.068 11.909 1.00 0.00 H new ATOM 2308 N LEU B 28 69.152 -11.527 10.734 1.00 0.00 N ATOM 2309 CA LEU B 28 68.407 -12.427 9.796 1.00 0.00 C ATOM 2310 C LEU B 28 69.330 -13.522 9.289 1.00 0.00 C ATOM 2311 O LEU B 28 70.528 -13.361 9.198 1.00 0.00 O ATOM 2312 CB LEU B 28 67.875 -11.618 8.600 1.00 0.00 C ATOM 2313 CG LEU B 28 66.609 -10.833 8.992 1.00 0.00 C ATOM 2314 CD1 LEU B 28 65.399 -11.777 9.172 1.00 0.00 C ATOM 2315 CD2 LEU B 28 66.859 -10.090 10.300 1.00 0.00 C ATOM 0 H LEU B 28 69.722 -10.806 10.292 1.00 0.00 H new ATOM 0 HA LEU B 28 67.569 -12.875 10.331 1.00 0.00 H new ATOM 0 HB2 LEU B 28 68.643 -10.928 8.251 1.00 0.00 H new ATOM 0 HB3 LEU B 28 67.650 -12.290 7.772 1.00 0.00 H new ATOM 0 HG LEU B 28 66.383 -10.129 8.191 1.00 0.00 H new ATOM 0 HD11 LEU B 28 64.521 -11.194 9.448 1.00 0.00 H new ATOM 0 HD12 LEU B 28 65.206 -12.303 8.237 1.00 0.00 H new ATOM 0 HD13 LEU B 28 65.616 -12.501 9.958 1.00 0.00 H new ATOM 0 HD21 LEU B 28 65.964 -9.534 10.579 1.00 0.00 H new ATOM 0 HD22 LEU B 28 67.101 -10.807 11.085 1.00 0.00 H new ATOM 0 HD23 LEU B 28 67.691 -9.398 10.172 1.00 0.00 H new ATOM 2327 N SER B 29 68.756 -14.632 8.955 1.00 0.00 N ATOM 2328 CA SER B 29 69.528 -15.781 8.424 1.00 0.00 C ATOM 2329 C SER B 29 68.821 -16.239 7.158 1.00 0.00 C ATOM 2330 O SER B 29 67.677 -15.898 6.931 1.00 0.00 O ATOM 2331 CB SER B 29 69.538 -16.914 9.451 1.00 0.00 C ATOM 2332 OG SER B 29 68.200 -17.317 9.719 1.00 0.00 O ATOM 0 H SER B 29 67.752 -14.798 9.029 1.00 0.00 H new ATOM 0 HA SER B 29 70.560 -15.499 8.216 1.00 0.00 H new ATOM 0 HB2 SER B 29 70.115 -17.758 9.073 1.00 0.00 H new ATOM 0 HB3 SER B 29 70.021 -16.583 10.370 1.00 0.00 H new ATOM 0 HG SER B 29 67.875 -16.859 10.522 1.00 0.00 H new ATOM 2338 N LYS B 30 69.464 -17.010 6.335 1.00 0.00 N ATOM 2339 CA LYS B 30 68.776 -17.481 5.094 1.00 0.00 C ATOM 2340 C LYS B 30 67.376 -18.014 5.447 1.00 0.00 C ATOM 2341 O LYS B 30 66.418 -17.797 4.734 1.00 0.00 O ATOM 2342 CB LYS B 30 69.604 -18.610 4.477 1.00 0.00 C ATOM 2343 CG LYS B 30 68.828 -19.246 3.320 1.00 0.00 C ATOM 2344 CD LYS B 30 69.749 -20.178 2.530 1.00 0.00 C ATOM 2345 CE LYS B 30 68.904 -21.131 1.682 1.00 0.00 C ATOM 2346 NZ LYS B 30 69.785 -21.861 0.728 1.00 0.00 N ATOM 0 H LYS B 30 70.423 -17.335 6.459 1.00 0.00 H new ATOM 0 HA LYS B 30 68.678 -16.655 4.389 1.00 0.00 H new ATOM 0 HB2 LYS B 30 70.557 -18.221 4.118 1.00 0.00 H new ATOM 0 HB3 LYS B 30 69.831 -19.362 5.232 1.00 0.00 H new ATOM 0 HG2 LYS B 30 67.975 -19.804 3.705 1.00 0.00 H new ATOM 0 HG3 LYS B 30 68.432 -18.470 2.665 1.00 0.00 H new ATOM 0 HD2 LYS B 30 70.412 -19.595 1.890 1.00 0.00 H new ATOM 0 HD3 LYS B 30 70.382 -20.745 3.212 1.00 0.00 H new ATOM 0 HE2 LYS B 30 68.380 -21.839 2.324 1.00 0.00 H new ATOM 0 HE3 LYS B 30 68.143 -20.572 1.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 69.211 -22.509 0.151 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 70.265 -21.179 0.107 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 70.495 -22.406 1.258 1.00 0.00 H new ATOM 2360 N LYS B 31 67.263 -18.718 6.539 1.00 0.00 N ATOM 2361 CA LYS B 31 65.943 -19.287 6.957 1.00 0.00 C ATOM 2362 C LYS B 31 64.964 -18.194 7.417 1.00 0.00 C ATOM 2363 O LYS B 31 63.783 -18.258 7.131 1.00 0.00 O ATOM 2364 CB LYS B 31 66.166 -20.268 8.106 1.00 0.00 C ATOM 2365 CG LYS B 31 64.826 -20.859 8.547 1.00 0.00 C ATOM 2366 CD LYS B 31 65.073 -21.962 9.575 1.00 0.00 C ATOM 2367 CE LYS B 31 65.616 -21.366 10.883 1.00 0.00 C ATOM 2368 NZ LYS B 31 67.090 -21.185 10.768 1.00 0.00 N ATOM 0 H LYS B 31 68.037 -18.928 7.170 1.00 0.00 H new ATOM 0 HA LYS B 31 65.506 -19.788 6.094 1.00 0.00 H new ATOM 0 HB2 LYS B 31 66.840 -21.065 7.791 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.643 -19.759 8.944 1.00 0.00 H new ATOM 0 HG2 LYS B 31 64.196 -20.080 8.977 1.00 0.00 H new ATOM 0 HG3 LYS B 31 64.292 -21.262 7.686 1.00 0.00 H new ATOM 0 HD2 LYS B 31 64.145 -22.499 9.771 1.00 0.00 H new ATOM 0 HD3 LYS B 31 65.783 -22.687 9.176 1.00 0.00 H new ATOM 0 HE2 LYS B 31 65.136 -20.409 11.087 1.00 0.00 H new ATOM 0 HE3 LYS B 31 65.383 -22.024 11.720 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 67.556 -21.588 11.606 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 67.434 -21.670 9.914 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 67.311 -20.171 10.703 1.00 0.00 H new ATOM 2382 N GLU B 32 65.431 -17.190 8.101 1.00 0.00 N ATOM 2383 CA GLU B 32 64.489 -16.118 8.537 1.00 0.00 C ATOM 2384 C GLU B 32 64.048 -15.327 7.301 1.00 0.00 C ATOM 2385 O GLU B 32 62.919 -14.901 7.181 1.00 0.00 O ATOM 2386 CB GLU B 32 65.165 -15.188 9.544 1.00 0.00 C ATOM 2387 CG GLU B 32 65.383 -15.931 10.867 1.00 0.00 C ATOM 2388 CD GLU B 32 66.389 -15.163 11.728 1.00 0.00 C ATOM 2389 OE1 GLU B 32 66.070 -14.060 12.138 1.00 0.00 O ATOM 2390 OE2 GLU B 32 67.462 -15.693 11.963 1.00 0.00 O ATOM 0 H GLU B 32 66.405 -17.063 8.375 1.00 0.00 H new ATOM 0 HA GLU B 32 63.622 -16.566 9.022 1.00 0.00 H new ATOM 0 HB2 GLU B 32 66.120 -14.841 9.149 1.00 0.00 H new ATOM 0 HB3 GLU B 32 64.548 -14.305 9.709 1.00 0.00 H new ATOM 0 HG2 GLU B 32 64.437 -16.033 11.399 1.00 0.00 H new ATOM 0 HG3 GLU B 32 65.750 -16.939 10.673 1.00 0.00 H new ATOM 2397 N LEU B 33 64.971 -15.107 6.402 1.00 0.00 N ATOM 2398 CA LEU B 33 64.700 -14.314 5.162 1.00 0.00 C ATOM 2399 C LEU B 33 63.593 -14.932 4.287 1.00 0.00 C ATOM 2400 O LEU B 33 62.691 -14.245 3.850 1.00 0.00 O ATOM 2401 CB LEU B 33 66.014 -14.274 4.362 1.00 0.00 C ATOM 2402 CG LEU B 33 65.802 -13.672 2.968 1.00 0.00 C ATOM 2403 CD1 LEU B 33 65.211 -12.271 3.103 1.00 0.00 C ATOM 2404 CD2 LEU B 33 67.155 -13.596 2.251 1.00 0.00 C ATOM 0 H LEU B 33 65.928 -15.453 6.476 1.00 0.00 H new ATOM 0 HA LEU B 33 64.353 -13.321 5.447 1.00 0.00 H new ATOM 0 HB2 LEU B 33 66.755 -13.687 4.905 1.00 0.00 H new ATOM 0 HB3 LEU B 33 66.415 -15.283 4.267 1.00 0.00 H new ATOM 0 HG LEU B 33 65.116 -14.294 2.394 1.00 0.00 H new ATOM 0 HD11 LEU B 33 65.060 -11.843 2.112 1.00 0.00 H new ATOM 0 HD12 LEU B 33 64.255 -12.328 3.623 1.00 0.00 H new ATOM 0 HD13 LEU B 33 65.896 -11.640 3.670 1.00 0.00 H new ATOM 0 HD21 LEU B 33 67.017 -13.169 1.258 1.00 0.00 H new ATOM 0 HD22 LEU B 33 67.836 -12.967 2.825 1.00 0.00 H new ATOM 0 HD23 LEU B 33 67.575 -14.598 2.160 1.00 0.00 H new ATOM 2416 N LYS B 34 63.681 -16.193 3.970 1.00 0.00 N ATOM 2417 CA LYS B 34 62.659 -16.803 3.058 1.00 0.00 C ATOM 2418 C LYS B 34 61.275 -16.906 3.709 1.00 0.00 C ATOM 2419 O LYS B 34 60.272 -16.748 3.047 1.00 0.00 O ATOM 2420 CB LYS B 34 63.126 -18.186 2.598 1.00 0.00 C ATOM 2421 CG LYS B 34 63.467 -19.065 3.805 1.00 0.00 C ATOM 2422 CD LYS B 34 64.373 -20.211 3.354 1.00 0.00 C ATOM 2423 CE LYS B 34 63.638 -21.064 2.320 1.00 0.00 C ATOM 2424 NZ LYS B 34 64.369 -22.347 2.123 1.00 0.00 N ATOM 0 H LYS B 34 64.409 -16.828 4.297 1.00 0.00 H new ATOM 0 HA LYS B 34 62.561 -16.141 2.198 1.00 0.00 H new ATOM 0 HB2 LYS B 34 62.346 -18.661 2.004 1.00 0.00 H new ATOM 0 HB3 LYS B 34 64.000 -18.086 1.955 1.00 0.00 H new ATOM 0 HG2 LYS B 34 63.965 -18.472 4.572 1.00 0.00 H new ATOM 0 HG3 LYS B 34 62.555 -19.461 4.251 1.00 0.00 H new ATOM 0 HD2 LYS B 34 65.294 -19.814 2.926 1.00 0.00 H new ATOM 0 HD3 LYS B 34 64.657 -20.823 4.210 1.00 0.00 H new ATOM 0 HE2 LYS B 34 62.619 -21.261 2.654 1.00 0.00 H new ATOM 0 HE3 LYS B 34 63.565 -20.526 1.375 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 63.869 -22.927 1.420 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 65.333 -22.149 1.786 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 64.416 -22.862 3.025 1.00 0.00 H new ATOM 2438 N ASP B 35 61.189 -17.166 4.978 1.00 0.00 N ATOM 2439 CA ASP B 35 59.844 -17.257 5.614 1.00 0.00 C ATOM 2440 C ASP B 35 59.236 -15.858 5.687 1.00 0.00 C ATOM 2441 O ASP B 35 58.041 -15.673 5.564 1.00 0.00 O ATOM 2442 CB ASP B 35 59.977 -17.836 7.024 1.00 0.00 C ATOM 2443 CG ASP B 35 58.590 -18.162 7.579 1.00 0.00 C ATOM 2444 OD1 ASP B 35 57.620 -17.680 7.017 1.00 0.00 O ATOM 2445 OD2 ASP B 35 58.520 -18.886 8.559 1.00 0.00 O ATOM 0 H ASP B 35 61.982 -17.319 5.602 1.00 0.00 H new ATOM 0 HA ASP B 35 59.200 -17.909 5.023 1.00 0.00 H new ATOM 0 HB2 ASP B 35 60.591 -18.736 7.002 1.00 0.00 H new ATOM 0 HB3 ASP B 35 60.481 -17.122 7.675 1.00 0.00 H new ATOM 2450 N LEU B 36 60.059 -14.881 5.911 1.00 0.00 N ATOM 2451 CA LEU B 36 59.575 -13.480 6.030 1.00 0.00 C ATOM 2452 C LEU B 36 59.006 -12.949 4.702 1.00 0.00 C ATOM 2453 O LEU B 36 58.032 -12.226 4.687 1.00 0.00 O ATOM 2454 CB LEU B 36 60.752 -12.601 6.473 1.00 0.00 C ATOM 2455 CG LEU B 36 60.317 -11.134 6.616 1.00 0.00 C ATOM 2456 CD1 LEU B 36 59.182 -11.013 7.648 1.00 0.00 C ATOM 2457 CD2 LEU B 36 61.528 -10.311 7.075 1.00 0.00 C ATOM 0 H LEU B 36 61.067 -14.994 6.019 1.00 0.00 H new ATOM 0 HA LEU B 36 58.767 -13.453 6.761 1.00 0.00 H new ATOM 0 HB2 LEU B 36 61.144 -12.963 7.424 1.00 0.00 H new ATOM 0 HB3 LEU B 36 61.561 -12.676 5.746 1.00 0.00 H new ATOM 0 HG LEU B 36 59.951 -10.763 5.658 1.00 0.00 H new ATOM 0 HD11 LEU B 36 58.883 -9.969 7.740 1.00 0.00 H new ATOM 0 HD12 LEU B 36 58.329 -11.607 7.322 1.00 0.00 H new ATOM 0 HD13 LEU B 36 59.529 -11.377 8.615 1.00 0.00 H new ATOM 0 HD21 LEU B 36 61.238 -9.266 7.182 1.00 0.00 H new ATOM 0 HD22 LEU B 36 61.883 -10.689 8.034 1.00 0.00 H new ATOM 0 HD23 LEU B 36 62.325 -10.393 6.336 1.00 0.00 H new ATOM 2469 N LEU B 37 59.623 -13.257 3.592 1.00 0.00 N ATOM 2470 CA LEU B 37 59.122 -12.719 2.281 1.00 0.00 C ATOM 2471 C LEU B 37 57.999 -13.571 1.670 1.00 0.00 C ATOM 2472 O LEU B 37 57.062 -13.051 1.099 1.00 0.00 O ATOM 2473 CB LEU B 37 60.291 -12.652 1.294 1.00 0.00 C ATOM 2474 CG LEU B 37 61.375 -11.706 1.831 1.00 0.00 C ATOM 2475 CD1 LEU B 37 62.566 -11.697 0.864 1.00 0.00 C ATOM 2476 CD2 LEU B 37 60.804 -10.279 1.979 1.00 0.00 C ATOM 0 H LEU B 37 60.448 -13.854 3.530 1.00 0.00 H new ATOM 0 HA LEU B 37 58.706 -11.730 2.474 1.00 0.00 H new ATOM 0 HB2 LEU B 37 60.708 -13.648 1.142 1.00 0.00 H new ATOM 0 HB3 LEU B 37 59.939 -12.302 0.323 1.00 0.00 H new ATOM 0 HG LEU B 37 61.706 -12.054 2.810 1.00 0.00 H new ATOM 0 HD11 LEU B 37 63.337 -11.026 1.243 1.00 0.00 H new ATOM 0 HD12 LEU B 37 62.972 -12.705 0.778 1.00 0.00 H new ATOM 0 HD13 LEU B 37 62.236 -11.354 -0.116 1.00 0.00 H new ATOM 0 HD21 LEU B 37 61.579 -9.615 2.360 1.00 0.00 H new ATOM 0 HD22 LEU B 37 60.465 -9.920 1.007 1.00 0.00 H new ATOM 0 HD23 LEU B 37 59.964 -10.293 2.674 1.00 0.00 H new ATOM 2488 N GLN B 38 58.098 -14.863 1.748 1.00 0.00 N ATOM 2489 CA GLN B 38 57.062 -15.735 1.135 1.00 0.00 C ATOM 2490 C GLN B 38 55.723 -15.517 1.815 1.00 0.00 C ATOM 2491 O GLN B 38 54.680 -15.545 1.197 1.00 0.00 O ATOM 2492 CB GLN B 38 57.480 -17.201 1.310 1.00 0.00 C ATOM 2493 CG GLN B 38 57.470 -17.592 2.801 1.00 0.00 C ATOM 2494 CD GLN B 38 56.081 -18.092 3.218 1.00 0.00 C ATOM 2495 OE1 GLN B 38 55.123 -17.957 2.484 1.00 0.00 O ATOM 2496 NE2 GLN B 38 55.935 -18.680 4.374 1.00 0.00 N ATOM 0 H GLN B 38 58.858 -15.359 2.214 1.00 0.00 H new ATOM 0 HA GLN B 38 56.968 -15.491 0.077 1.00 0.00 H new ATOM 0 HB2 GLN B 38 56.801 -17.848 0.754 1.00 0.00 H new ATOM 0 HB3 GLN B 38 58.476 -17.353 0.895 1.00 0.00 H new ATOM 0 HG2 GLN B 38 58.212 -18.369 2.984 1.00 0.00 H new ATOM 0 HG3 GLN B 38 57.751 -16.733 3.410 1.00 0.00 H new ATOM 0 HE21 GLN B 38 56.738 -18.795 4.993 1.00 0.00 H new ATOM 0 HE22 GLN B 38 55.018 -19.025 4.659 1.00 0.00 H new ATOM 2505 N THR B 39 55.754 -15.341 3.098 1.00 0.00 N ATOM 2506 CA THR B 39 54.494 -15.167 3.851 1.00 0.00 C ATOM 2507 C THR B 39 53.875 -13.793 3.586 1.00 0.00 C ATOM 2508 O THR B 39 52.700 -13.679 3.295 1.00 0.00 O ATOM 2509 CB THR B 39 54.763 -15.336 5.345 1.00 0.00 C ATOM 2510 OG1 THR B 39 55.283 -16.637 5.586 1.00 0.00 O ATOM 2511 CG2 THR B 39 53.459 -15.150 6.121 1.00 0.00 C ATOM 0 H THR B 39 56.604 -15.310 3.661 1.00 0.00 H new ATOM 0 HA THR B 39 53.787 -15.926 3.516 1.00 0.00 H new ATOM 0 HB THR B 39 55.487 -14.591 5.674 1.00 0.00 H new ATOM 0 HG1 THR B 39 56.241 -16.575 5.785 1.00 0.00 H new ATOM 0 HG21 THR B 39 53.650 -15.270 7.187 1.00 0.00 H new ATOM 0 HG22 THR B 39 53.063 -14.152 5.934 1.00 0.00 H new ATOM 0 HG23 THR B 39 52.733 -15.895 5.796 1.00 0.00 H new ATOM 2519 N GLU B 40 54.642 -12.750 3.706 1.00 0.00 N ATOM 2520 CA GLU B 40 54.087 -11.383 3.486 1.00 0.00 C ATOM 2521 C GLU B 40 54.031 -11.038 1.992 1.00 0.00 C ATOM 2522 O GLU B 40 53.007 -10.630 1.483 1.00 0.00 O ATOM 2523 CB GLU B 40 54.982 -10.378 4.215 1.00 0.00 C ATOM 2524 CG GLU B 40 54.665 -10.389 5.720 1.00 0.00 C ATOM 2525 CD GLU B 40 55.058 -11.740 6.318 1.00 0.00 C ATOM 2526 OE1 GLU B 40 55.988 -12.339 5.812 1.00 0.00 O ATOM 2527 OE2 GLU B 40 54.425 -12.148 7.278 1.00 0.00 O ATOM 0 H GLU B 40 55.632 -12.782 3.947 1.00 0.00 H new ATOM 0 HA GLU B 40 53.069 -11.344 3.873 1.00 0.00 H new ATOM 0 HB2 GLU B 40 56.031 -10.628 4.054 1.00 0.00 H new ATOM 0 HB3 GLU B 40 54.827 -9.378 3.809 1.00 0.00 H new ATOM 0 HG2 GLU B 40 55.206 -9.587 6.222 1.00 0.00 H new ATOM 0 HG3 GLU B 40 53.603 -10.205 5.879 1.00 0.00 H new ATOM 2534 N LEU B 41 55.122 -11.189 1.289 1.00 0.00 N ATOM 2535 CA LEU B 41 55.137 -10.857 -0.175 1.00 0.00 C ATOM 2536 C LEU B 41 55.066 -12.160 -0.981 1.00 0.00 C ATOM 2537 O LEU B 41 56.059 -12.657 -1.477 1.00 0.00 O ATOM 2538 CB LEU B 41 56.435 -10.100 -0.493 1.00 0.00 C ATOM 2539 CG LEU B 41 56.295 -8.600 -0.120 1.00 0.00 C ATOM 2540 CD1 LEU B 41 57.683 -8.011 0.155 1.00 0.00 C ATOM 2541 CD2 LEU B 41 55.647 -7.826 -1.282 1.00 0.00 C ATOM 0 H LEU B 41 56.008 -11.529 1.662 1.00 0.00 H new ATOM 0 HA LEU B 41 54.284 -10.232 -0.438 1.00 0.00 H new ATOM 0 HB2 LEU B 41 57.265 -10.542 0.058 1.00 0.00 H new ATOM 0 HB3 LEU B 41 56.669 -10.197 -1.553 1.00 0.00 H new ATOM 0 HG LEU B 41 55.669 -8.514 0.768 1.00 0.00 H new ATOM 0 HD11 LEU B 41 57.586 -6.957 0.417 1.00 0.00 H new ATOM 0 HD12 LEU B 41 58.149 -8.549 0.980 1.00 0.00 H new ATOM 0 HD13 LEU B 41 58.302 -8.107 -0.737 1.00 0.00 H new ATOM 0 HD21 LEU B 41 55.553 -6.774 -1.011 1.00 0.00 H new ATOM 0 HD22 LEU B 41 56.270 -7.917 -2.172 1.00 0.00 H new ATOM 0 HD23 LEU B 41 54.659 -8.238 -1.487 1.00 0.00 H new ATOM 2553 N SER B 42 53.896 -12.727 -1.078 1.00 0.00 N ATOM 2554 CA SER B 42 53.722 -14.022 -1.804 1.00 0.00 C ATOM 2555 C SER B 42 53.503 -13.842 -3.315 1.00 0.00 C ATOM 2556 O SER B 42 53.698 -14.776 -4.066 1.00 0.00 O ATOM 2557 CB SER B 42 52.498 -14.739 -1.238 1.00 0.00 C ATOM 2558 OG SER B 42 52.669 -14.943 0.156 1.00 0.00 O ATOM 0 H SER B 42 53.039 -12.344 -0.680 1.00 0.00 H new ATOM 0 HA SER B 42 54.640 -14.592 -1.664 1.00 0.00 H new ATOM 0 HB2 SER B 42 51.600 -14.149 -1.422 1.00 0.00 H new ATOM 0 HB3 SER B 42 52.359 -15.696 -1.742 1.00 0.00 H new ATOM 0 HG SER B 42 53.625 -14.934 0.373 1.00 0.00 H new ATOM 2564 N SER B 43 53.061 -12.688 -3.775 1.00 0.00 N ATOM 2565 CA SER B 43 52.790 -12.518 -5.252 1.00 0.00 C ATOM 2566 C SER B 43 53.676 -11.436 -5.889 1.00 0.00 C ATOM 2567 O SER B 43 53.533 -11.142 -7.058 1.00 0.00 O ATOM 2568 CB SER B 43 51.320 -12.132 -5.441 1.00 0.00 C ATOM 2569 OG SER B 43 51.009 -12.125 -6.828 1.00 0.00 O ATOM 0 H SER B 43 52.877 -11.864 -3.202 1.00 0.00 H new ATOM 0 HA SER B 43 53.019 -13.463 -5.744 1.00 0.00 H new ATOM 0 HB2 SER B 43 50.677 -12.838 -4.916 1.00 0.00 H new ATOM 0 HB3 SER B 43 51.132 -11.149 -5.010 1.00 0.00 H new ATOM 0 HG SER B 43 51.782 -11.800 -7.335 1.00 0.00 H new ATOM 2575 N PHE B 44 54.583 -10.838 -5.152 1.00 0.00 N ATOM 2576 CA PHE B 44 55.466 -9.773 -5.751 1.00 0.00 C ATOM 2577 C PHE B 44 56.929 -10.194 -5.631 1.00 0.00 C ATOM 2578 O PHE B 44 57.698 -10.094 -6.568 1.00 0.00 O ATOM 2579 CB PHE B 44 55.245 -8.462 -4.997 1.00 0.00 C ATOM 2580 CG PHE B 44 53.814 -8.021 -5.189 1.00 0.00 C ATOM 2581 CD1 PHE B 44 53.453 -7.306 -6.336 1.00 0.00 C ATOM 2582 CD2 PHE B 44 52.846 -8.334 -4.225 1.00 0.00 C ATOM 2583 CE1 PHE B 44 52.127 -6.900 -6.521 1.00 0.00 C ATOM 2584 CE2 PHE B 44 51.518 -7.928 -4.412 1.00 0.00 C ATOM 2585 CZ PHE B 44 51.159 -7.212 -5.560 1.00 0.00 C ATOM 0 H PHE B 44 54.753 -11.037 -4.166 1.00 0.00 H new ATOM 0 HA PHE B 44 55.219 -9.638 -6.804 1.00 0.00 H new ATOM 0 HB2 PHE B 44 55.459 -8.597 -3.937 1.00 0.00 H new ATOM 0 HB3 PHE B 44 55.928 -7.696 -5.365 1.00 0.00 H new ATOM 0 HD1 PHE B 44 54.199 -7.067 -7.080 1.00 0.00 H new ATOM 0 HD2 PHE B 44 53.123 -8.887 -3.340 1.00 0.00 H new ATOM 0 HE1 PHE B 44 51.850 -6.346 -7.406 1.00 0.00 H new ATOM 0 HE2 PHE B 44 50.771 -8.168 -3.670 1.00 0.00 H new ATOM 0 HZ PHE B 44 50.135 -6.900 -5.704 1.00 0.00 H new ATOM 2595 N LEU B 45 57.309 -10.677 -4.484 1.00 0.00 N ATOM 2596 CA LEU B 45 58.712 -11.137 -4.258 1.00 0.00 C ATOM 2597 C LEU B 45 58.663 -12.670 -4.133 1.00 0.00 C ATOM 2598 O LEU B 45 57.769 -13.212 -3.512 1.00 0.00 O ATOM 2599 CB LEU B 45 59.224 -10.481 -2.957 1.00 0.00 C ATOM 2600 CG LEU B 45 60.666 -9.958 -3.106 1.00 0.00 C ATOM 2601 CD1 LEU B 45 61.097 -9.318 -1.787 1.00 0.00 C ATOM 2602 CD2 LEU B 45 61.610 -11.117 -3.472 1.00 0.00 C ATOM 0 H LEU B 45 56.696 -10.776 -3.675 1.00 0.00 H new ATOM 0 HA LEU B 45 59.384 -10.860 -5.070 1.00 0.00 H new ATOM 0 HB2 LEU B 45 58.566 -9.657 -2.682 1.00 0.00 H new ATOM 0 HB3 LEU B 45 59.183 -11.206 -2.144 1.00 0.00 H new ATOM 0 HG LEU B 45 60.710 -9.215 -3.902 1.00 0.00 H new ATOM 0 HD11 LEU B 45 62.117 -8.944 -1.880 1.00 0.00 H new ATOM 0 HD12 LEU B 45 60.428 -8.492 -1.548 1.00 0.00 H new ATOM 0 HD13 LEU B 45 61.055 -10.061 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU B 45 62.627 -10.739 -3.575 1.00 0.00 H new ATOM 0 HD22 LEU B 45 61.582 -11.872 -2.686 1.00 0.00 H new ATOM 0 HD23 LEU B 45 61.291 -11.562 -4.414 1.00 0.00 H new ATOM 2614 N ASP B 46 59.586 -13.378 -4.732 1.00 0.00 N ATOM 2615 CA ASP B 46 59.568 -14.875 -4.669 1.00 0.00 C ATOM 2616 C ASP B 46 60.877 -15.393 -4.091 1.00 0.00 C ATOM 2617 O ASP B 46 61.906 -14.751 -4.144 1.00 0.00 O ATOM 2618 CB ASP B 46 59.387 -15.430 -6.087 1.00 0.00 C ATOM 2619 CG ASP B 46 60.629 -15.122 -6.927 1.00 0.00 C ATOM 2620 OD1 ASP B 46 61.423 -14.303 -6.497 1.00 0.00 O ATOM 2621 OD2 ASP B 46 60.762 -15.710 -7.989 1.00 0.00 O ATOM 0 H ASP B 46 60.359 -12.982 -5.267 1.00 0.00 H new ATOM 0 HA ASP B 46 58.747 -15.198 -4.030 1.00 0.00 H new ATOM 0 HB2 ASP B 46 59.221 -16.507 -6.048 1.00 0.00 H new ATOM 0 HB3 ASP B 46 58.505 -14.988 -6.550 1.00 0.00 H new ATOM 2626 N VAL B 47 60.819 -16.578 -3.555 1.00 0.00 N ATOM 2627 CA VAL B 47 62.016 -17.230 -2.965 1.00 0.00 C ATOM 2628 C VAL B 47 61.776 -18.738 -2.995 1.00 0.00 C ATOM 2629 O VAL B 47 62.671 -19.525 -3.192 1.00 0.00 O ATOM 2630 CB VAL B 47 62.199 -16.793 -1.502 1.00 0.00 C ATOM 2631 CG1 VAL B 47 62.349 -15.278 -1.419 1.00 0.00 C ATOM 2632 CG2 VAL B 47 60.982 -17.223 -0.682 1.00 0.00 C ATOM 0 H VAL B 47 59.967 -17.136 -3.501 1.00 0.00 H new ATOM 0 HA VAL B 47 62.906 -16.951 -3.529 1.00 0.00 H new ATOM 0 HB VAL B 47 63.098 -17.265 -1.105 1.00 0.00 H new ATOM 0 HG11 VAL B 47 62.478 -14.982 -0.378 1.00 0.00 H new ATOM 0 HG12 VAL B 47 63.220 -14.966 -1.995 1.00 0.00 H new ATOM 0 HG13 VAL B 47 61.456 -14.801 -1.824 1.00 0.00 H new ATOM 0 HG21 VAL B 47 61.114 -16.912 0.355 1.00 0.00 H new ATOM 0 HG22 VAL B 47 60.085 -16.756 -1.090 1.00 0.00 H new ATOM 0 HG23 VAL B 47 60.879 -18.307 -0.726 1.00 0.00 H new ATOM 2642 N GLN B 48 60.557 -19.145 -2.783 1.00 0.00 N ATOM 2643 CA GLN B 48 60.252 -20.605 -2.776 1.00 0.00 C ATOM 2644 C GLN B 48 59.919 -21.100 -4.184 1.00 0.00 C ATOM 2645 O GLN B 48 60.156 -22.246 -4.512 1.00 0.00 O ATOM 2646 CB GLN B 48 59.069 -20.862 -1.850 1.00 0.00 C ATOM 2647 CG GLN B 48 57.812 -20.196 -2.410 1.00 0.00 C ATOM 2648 CD GLN B 48 56.698 -20.261 -1.361 1.00 0.00 C ATOM 2649 OE1 GLN B 48 56.946 -20.078 -0.186 1.00 0.00 O ATOM 2650 NE2 GLN B 48 55.476 -20.521 -1.735 1.00 0.00 N ATOM 0 H GLN B 48 59.759 -18.533 -2.614 1.00 0.00 H new ATOM 0 HA GLN B 48 61.130 -21.146 -2.423 1.00 0.00 H new ATOM 0 HB2 GLN B 48 58.906 -21.935 -1.744 1.00 0.00 H new ATOM 0 HB3 GLN B 48 59.284 -20.473 -0.855 1.00 0.00 H new ATOM 0 HG2 GLN B 48 58.021 -19.159 -2.672 1.00 0.00 H new ATOM 0 HG3 GLN B 48 57.497 -20.698 -3.325 1.00 0.00 H new ATOM 0 HE21 GLN B 48 55.266 -20.675 -2.721 1.00 0.00 H new ATOM 0 HE22 GLN B 48 54.730 -20.570 -1.041 1.00 0.00 H new ATOM 2659 N LYS B 49 59.375 -20.264 -5.024 1.00 0.00 N ATOM 2660 CA LYS B 49 59.042 -20.732 -6.397 1.00 0.00 C ATOM 2661 C LYS B 49 60.323 -21.159 -7.095 1.00 0.00 C ATOM 2662 O LYS B 49 60.362 -22.136 -7.817 1.00 0.00 O ATOM 2663 CB LYS B 49 58.417 -19.596 -7.205 1.00 0.00 C ATOM 2664 CG LYS B 49 57.038 -19.271 -6.642 1.00 0.00 C ATOM 2665 CD LYS B 49 56.297 -18.318 -7.588 1.00 0.00 C ATOM 2666 CE LYS B 49 56.839 -16.895 -7.446 1.00 0.00 C ATOM 2667 NZ LYS B 49 55.938 -15.956 -8.173 1.00 0.00 N ATOM 0 H LYS B 49 59.149 -19.290 -4.823 1.00 0.00 H new ATOM 0 HA LYS B 49 58.339 -21.562 -6.327 1.00 0.00 H new ATOM 0 HB2 LYS B 49 59.055 -18.713 -7.165 1.00 0.00 H new ATOM 0 HB3 LYS B 49 58.335 -19.883 -8.253 1.00 0.00 H new ATOM 0 HG2 LYS B 49 56.463 -20.188 -6.513 1.00 0.00 H new ATOM 0 HG3 LYS B 49 57.136 -18.815 -5.657 1.00 0.00 H new ATOM 0 HD2 LYS B 49 56.412 -18.656 -8.618 1.00 0.00 H new ATOM 0 HD3 LYS B 49 55.230 -18.331 -7.365 1.00 0.00 H new ATOM 0 HE2 LYS B 49 56.900 -16.619 -6.393 1.00 0.00 H new ATOM 0 HE3 LYS B 49 57.850 -16.835 -7.850 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 56.301 -14.986 -8.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 55.902 -16.218 -9.179 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 54.982 -16.008 -7.767 1.00 0.00 H new ATOM 2681 N ASP B 50 61.370 -20.409 -6.886 1.00 0.00 N ATOM 2682 CA ASP B 50 62.684 -20.718 -7.534 1.00 0.00 C ATOM 2683 C ASP B 50 63.775 -20.883 -6.471 1.00 0.00 C ATOM 2684 O ASP B 50 64.157 -19.940 -5.809 1.00 0.00 O ATOM 2685 CB ASP B 50 63.053 -19.561 -8.464 1.00 0.00 C ATOM 2686 CG ASP B 50 62.109 -19.560 -9.667 1.00 0.00 C ATOM 2687 OD1 ASP B 50 61.681 -20.634 -10.059 1.00 0.00 O ATOM 2688 OD2 ASP B 50 61.830 -18.487 -10.176 1.00 0.00 O ATOM 0 H ASP B 50 61.374 -19.584 -6.287 1.00 0.00 H new ATOM 0 HA ASP B 50 62.602 -21.647 -8.098 1.00 0.00 H new ATOM 0 HB2 ASP B 50 62.982 -18.613 -7.930 1.00 0.00 H new ATOM 0 HB3 ASP B 50 64.086 -19.662 -8.797 1.00 0.00 H new ATOM 2693 N ALA B 51 64.299 -22.068 -6.320 1.00 0.00 N ATOM 2694 CA ALA B 51 65.385 -22.279 -5.321 1.00 0.00 C ATOM 2695 C ALA B 51 66.630 -21.536 -5.791 1.00 0.00 C ATOM 2696 O ALA B 51 67.389 -21.013 -5.001 1.00 0.00 O ATOM 2697 CB ALA B 51 65.686 -23.775 -5.197 1.00 0.00 C ATOM 0 H ALA B 51 64.023 -22.898 -6.844 1.00 0.00 H new ATOM 0 HA ALA B 51 65.076 -21.901 -4.347 1.00 0.00 H new ATOM 0 HB1 ALA B 51 66.480 -23.927 -4.466 1.00 0.00 H new ATOM 0 HB2 ALA B 51 64.788 -24.301 -4.872 1.00 0.00 H new ATOM 0 HB3 ALA B 51 66.004 -24.164 -6.164 1.00 0.00 H new ATOM 2703 N ASP B 52 66.840 -21.471 -7.075 1.00 0.00 N ATOM 2704 CA ASP B 52 68.030 -20.745 -7.585 1.00 0.00 C ATOM 2705 C ASP B 52 67.928 -19.285 -7.151 1.00 0.00 C ATOM 2706 O ASP B 52 68.903 -18.650 -6.829 1.00 0.00 O ATOM 2707 CB ASP B 52 68.086 -20.835 -9.111 1.00 0.00 C ATOM 2708 CG ASP B 52 66.772 -20.325 -9.705 1.00 0.00 C ATOM 2709 OD1 ASP B 52 65.788 -21.038 -9.613 1.00 0.00 O ATOM 2710 OD2 ASP B 52 66.776 -19.233 -10.247 1.00 0.00 O ATOM 0 H ASP B 52 66.242 -21.887 -7.788 1.00 0.00 H new ATOM 0 HA ASP B 52 68.939 -21.191 -7.181 1.00 0.00 H new ATOM 0 HB2 ASP B 52 68.921 -20.245 -9.490 1.00 0.00 H new ATOM 0 HB3 ASP B 52 68.259 -21.866 -9.418 1.00 0.00 H new ATOM 2715 N ALA B 53 66.746 -18.748 -7.132 1.00 0.00 N ATOM 2716 CA ALA B 53 66.566 -17.334 -6.709 1.00 0.00 C ATOM 2717 C ALA B 53 67.027 -17.138 -5.267 1.00 0.00 C ATOM 2718 O ALA B 53 67.565 -16.108 -4.912 1.00 0.00 O ATOM 2719 CB ALA B 53 65.078 -16.978 -6.803 1.00 0.00 C ATOM 0 H ALA B 53 65.887 -19.232 -7.394 1.00 0.00 H new ATOM 0 HA ALA B 53 67.161 -16.693 -7.359 1.00 0.00 H new ATOM 0 HB1 ALA B 53 64.931 -15.943 -6.495 1.00 0.00 H new ATOM 0 HB2 ALA B 53 64.738 -17.103 -7.831 1.00 0.00 H new ATOM 0 HB3 ALA B 53 64.505 -17.635 -6.149 1.00 0.00 H new ATOM 2725 N VAL B 54 66.807 -18.105 -4.428 1.00 0.00 N ATOM 2726 CA VAL B 54 67.207 -17.970 -3.005 1.00 0.00 C ATOM 2727 C VAL B 54 68.711 -18.036 -2.834 1.00 0.00 C ATOM 2728 O VAL B 54 69.313 -17.169 -2.256 1.00 0.00 O ATOM 2729 CB VAL B 54 66.609 -19.126 -2.219 1.00 0.00 C ATOM 2730 CG1 VAL B 54 66.867 -18.922 -0.728 1.00 0.00 C ATOM 2731 CG2 VAL B 54 65.116 -19.193 -2.487 1.00 0.00 C ATOM 0 H VAL B 54 66.363 -18.991 -4.669 1.00 0.00 H new ATOM 0 HA VAL B 54 66.851 -17.003 -2.650 1.00 0.00 H new ATOM 0 HB VAL B 54 67.073 -20.062 -2.531 1.00 0.00 H new ATOM 0 HG11 VAL B 54 66.437 -19.752 -0.167 1.00 0.00 H new ATOM 0 HG12 VAL B 54 67.941 -18.879 -0.547 1.00 0.00 H new ATOM 0 HG13 VAL B 54 66.407 -17.988 -0.404 1.00 0.00 H new ATOM 0 HG21 VAL B 54 64.682 -20.021 -1.926 1.00 0.00 H new ATOM 0 HG22 VAL B 54 64.648 -18.259 -2.176 1.00 0.00 H new ATOM 0 HG23 VAL B 54 64.944 -19.348 -3.552 1.00 0.00 H new ATOM 2741 N ASP B 55 69.323 -19.089 -3.263 1.00 0.00 N ATOM 2742 CA ASP B 55 70.789 -19.224 -3.041 1.00 0.00 C ATOM 2743 C ASP B 55 71.562 -18.086 -3.707 1.00 0.00 C ATOM 2744 O ASP B 55 72.509 -17.566 -3.153 1.00 0.00 O ATOM 2745 CB ASP B 55 71.246 -20.568 -3.622 1.00 0.00 C ATOM 2746 CG ASP B 55 72.752 -20.762 -3.408 1.00 0.00 C ATOM 2747 OD1 ASP B 55 73.438 -19.779 -3.192 1.00 0.00 O ATOM 2748 OD2 ASP B 55 73.191 -21.898 -3.464 1.00 0.00 O ATOM 0 H ASP B 55 68.881 -19.864 -3.757 1.00 0.00 H new ATOM 0 HA ASP B 55 70.990 -19.178 -1.971 1.00 0.00 H new ATOM 0 HB2 ASP B 55 70.698 -21.381 -3.147 1.00 0.00 H new ATOM 0 HB3 ASP B 55 71.016 -20.608 -4.687 1.00 0.00 H new ATOM 2753 N LYS B 56 71.202 -17.726 -4.897 1.00 0.00 N ATOM 2754 CA LYS B 56 71.955 -16.656 -5.608 1.00 0.00 C ATOM 2755 C LYS B 56 71.720 -15.276 -4.974 1.00 0.00 C ATOM 2756 O LYS B 56 72.608 -14.447 -4.944 1.00 0.00 O ATOM 2757 CB LYS B 56 71.522 -16.642 -7.085 1.00 0.00 C ATOM 2758 CG LYS B 56 72.362 -17.633 -7.906 1.00 0.00 C ATOM 2759 CD LYS B 56 72.051 -19.067 -7.470 1.00 0.00 C ATOM 2760 CE LYS B 56 72.807 -20.048 -8.364 1.00 0.00 C ATOM 2761 NZ LYS B 56 74.273 -19.807 -8.240 1.00 0.00 N ATOM 0 H LYS B 56 70.418 -18.124 -5.414 1.00 0.00 H new ATOM 0 HA LYS B 56 73.021 -16.870 -5.529 1.00 0.00 H new ATOM 0 HB2 LYS B 56 70.466 -16.901 -7.162 1.00 0.00 H new ATOM 0 HB3 LYS B 56 71.634 -15.637 -7.493 1.00 0.00 H new ATOM 0 HG2 LYS B 56 72.148 -17.512 -8.968 1.00 0.00 H new ATOM 0 HG3 LYS B 56 73.423 -17.424 -7.769 1.00 0.00 H new ATOM 0 HD2 LYS B 56 72.339 -19.212 -6.429 1.00 0.00 H new ATOM 0 HD3 LYS B 56 70.979 -19.253 -7.533 1.00 0.00 H new ATOM 0 HE2 LYS B 56 72.571 -21.073 -8.078 1.00 0.00 H new ATOM 0 HE3 LYS B 56 72.494 -19.926 -9.401 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 74.792 -20.638 -8.589 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 74.536 -18.973 -8.802 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 74.514 -19.642 -7.242 1.00 0.00 H new ATOM 2775 N ILE B 57 70.531 -14.995 -4.515 1.00 0.00 N ATOM 2776 CA ILE B 57 70.256 -13.646 -3.948 1.00 0.00 C ATOM 2777 C ILE B 57 70.749 -13.556 -2.504 1.00 0.00 C ATOM 2778 O ILE B 57 71.481 -12.659 -2.137 1.00 0.00 O ATOM 2779 CB ILE B 57 68.742 -13.407 -4.008 1.00 0.00 C ATOM 2780 CG1 ILE B 57 68.315 -13.227 -5.469 1.00 0.00 C ATOM 2781 CG2 ILE B 57 68.357 -12.170 -3.202 1.00 0.00 C ATOM 2782 CD1 ILE B 57 66.785 -13.235 -5.571 1.00 0.00 C ATOM 0 H ILE B 57 69.741 -15.640 -4.508 1.00 0.00 H new ATOM 0 HA ILE B 57 70.783 -12.886 -4.525 1.00 0.00 H new ATOM 0 HB ILE B 57 68.233 -14.269 -3.577 1.00 0.00 H new ATOM 0 HG12 ILE B 57 68.709 -12.289 -5.859 1.00 0.00 H new ATOM 0 HG13 ILE B 57 68.733 -14.027 -6.080 1.00 0.00 H new ATOM 0 HG21 ILE B 57 67.279 -12.020 -3.259 1.00 0.00 H new ATOM 0 HG22 ILE B 57 68.650 -12.308 -2.161 1.00 0.00 H new ATOM 0 HG23 ILE B 57 68.867 -11.297 -3.609 1.00 0.00 H new ATOM 0 HD11 ILE B 57 66.489 -13.107 -6.612 1.00 0.00 H new ATOM 0 HD12 ILE B 57 66.401 -14.185 -5.199 1.00 0.00 H new ATOM 0 HD13 ILE B 57 66.376 -12.419 -4.974 1.00 0.00 H new ATOM 2794 N MET B 58 70.322 -14.463 -1.685 1.00 0.00 N ATOM 2795 CA MET B 58 70.715 -14.441 -0.254 1.00 0.00 C ATOM 2796 C MET B 58 72.234 -14.541 -0.088 1.00 0.00 C ATOM 2797 O MET B 58 72.832 -13.790 0.656 1.00 0.00 O ATOM 2798 CB MET B 58 70.023 -15.616 0.456 1.00 0.00 C ATOM 2799 CG MET B 58 70.664 -15.891 1.825 1.00 0.00 C ATOM 2800 SD MET B 58 70.900 -14.344 2.730 1.00 0.00 S ATOM 2801 CE MET B 58 71.914 -15.029 4.067 1.00 0.00 C ATOM 0 H MET B 58 69.707 -15.233 -1.948 1.00 0.00 H new ATOM 0 HA MET B 58 70.404 -13.494 0.188 1.00 0.00 H new ATOM 0 HB2 MET B 58 68.964 -15.394 0.585 1.00 0.00 H new ATOM 0 HB3 MET B 58 70.088 -16.509 -0.165 1.00 0.00 H new ATOM 0 HG2 MET B 58 70.030 -16.565 2.402 1.00 0.00 H new ATOM 0 HG3 MET B 58 71.623 -16.392 1.691 1.00 0.00 H new ATOM 0 HE1 MET B 58 72.316 -14.216 4.672 1.00 0.00 H new ATOM 0 HE2 MET B 58 71.301 -15.678 4.692 1.00 0.00 H new ATOM 0 HE3 MET B 58 72.736 -15.605 3.642 1.00 0.00 H new ATOM 2811 N LYS B 59 72.860 -15.472 -0.742 1.00 0.00 N ATOM 2812 CA LYS B 59 74.329 -15.619 -0.571 1.00 0.00 C ATOM 2813 C LYS B 59 75.057 -14.392 -1.126 1.00 0.00 C ATOM 2814 O LYS B 59 76.017 -13.923 -0.549 1.00 0.00 O ATOM 2815 CB LYS B 59 74.808 -16.895 -1.268 1.00 0.00 C ATOM 2816 CG LYS B 59 76.323 -17.065 -1.103 1.00 0.00 C ATOM 2817 CD LYS B 59 76.688 -17.157 0.386 1.00 0.00 C ATOM 2818 CE LYS B 59 78.056 -17.822 0.537 1.00 0.00 C ATOM 2819 NZ LYS B 59 77.972 -19.236 0.070 1.00 0.00 N ATOM 0 H LYS B 59 72.424 -16.134 -1.384 1.00 0.00 H new ATOM 0 HA LYS B 59 74.557 -15.695 0.492 1.00 0.00 H new ATOM 0 HB2 LYS B 59 74.292 -17.759 -0.850 1.00 0.00 H new ATOM 0 HB3 LYS B 59 74.555 -16.854 -2.327 1.00 0.00 H new ATOM 0 HG2 LYS B 59 76.654 -17.964 -1.622 1.00 0.00 H new ATOM 0 HG3 LYS B 59 76.843 -16.223 -1.561 1.00 0.00 H new ATOM 0 HD2 LYS B 59 76.705 -16.161 0.829 1.00 0.00 H new ATOM 0 HD3 LYS B 59 75.932 -17.731 0.922 1.00 0.00 H new ATOM 0 HE2 LYS B 59 78.803 -17.279 -0.043 1.00 0.00 H new ATOM 0 HE3 LYS B 59 78.376 -17.789 1.579 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 78.678 -19.810 0.573 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 77.021 -19.610 0.263 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 78.158 -19.276 -0.952 1.00 0.00 H new ATOM 2833 N GLU B 60 74.618 -13.861 -2.235 1.00 0.00 N ATOM 2834 CA GLU B 60 75.302 -12.663 -2.805 1.00 0.00 C ATOM 2835 C GLU B 60 74.720 -11.399 -2.181 1.00 0.00 C ATOM 2836 O GLU B 60 75.319 -10.341 -2.245 1.00 0.00 O ATOM 2837 CB GLU B 60 75.116 -12.611 -4.323 1.00 0.00 C ATOM 2838 CG GLU B 60 75.821 -13.804 -4.970 1.00 0.00 C ATOM 2839 CD GLU B 60 75.658 -13.724 -6.488 1.00 0.00 C ATOM 2840 OE1 GLU B 60 74.903 -12.877 -6.937 1.00 0.00 O ATOM 2841 OE2 GLU B 60 76.295 -14.504 -7.175 1.00 0.00 O ATOM 0 H GLU B 60 73.819 -14.202 -2.769 1.00 0.00 H new ATOM 0 HA GLU B 60 76.367 -12.730 -2.582 1.00 0.00 H new ATOM 0 HB2 GLU B 60 74.054 -12.626 -4.570 1.00 0.00 H new ATOM 0 HB3 GLU B 60 75.522 -11.679 -4.717 1.00 0.00 H new ATOM 0 HG2 GLU B 60 76.878 -13.803 -4.706 1.00 0.00 H new ATOM 0 HG3 GLU B 60 75.399 -14.737 -4.596 1.00 0.00 H new ATOM 2848 N LEU B 61 73.556 -11.498 -1.564 1.00 0.00 N ATOM 2849 CA LEU B 61 72.968 -10.268 -0.934 1.00 0.00 C ATOM 2850 C LEU B 61 73.614 -10.130 0.437 1.00 0.00 C ATOM 2851 O LEU B 61 73.747 -9.046 0.969 1.00 0.00 O ATOM 2852 CB LEU B 61 71.446 -10.328 -0.862 1.00 0.00 C ATOM 2853 CG LEU B 61 70.906 -9.094 -0.139 1.00 0.00 C ATOM 2854 CD1 LEU B 61 71.319 -7.820 -0.889 1.00 0.00 C ATOM 2855 CD2 LEU B 61 69.385 -9.191 -0.090 1.00 0.00 C ATOM 0 H LEU B 61 73.005 -12.351 -1.472 1.00 0.00 H new ATOM 0 HA LEU B 61 73.177 -9.387 -1.541 1.00 0.00 H new ATOM 0 HB2 LEU B 61 71.028 -10.382 -1.867 1.00 0.00 H new ATOM 0 HB3 LEU B 61 71.134 -11.232 -0.338 1.00 0.00 H new ATOM 0 HG LEU B 61 71.314 -9.050 0.871 1.00 0.00 H new ATOM 0 HD11 LEU B 61 70.929 -6.947 -0.365 1.00 0.00 H new ATOM 0 HD12 LEU B 61 72.406 -7.761 -0.934 1.00 0.00 H new ATOM 0 HD13 LEU B 61 70.915 -7.846 -1.901 1.00 0.00 H new ATOM 0 HD21 LEU B 61 68.981 -8.318 0.423 1.00 0.00 H new ATOM 0 HD22 LEU B 61 68.990 -9.230 -1.105 1.00 0.00 H new ATOM 0 HD23 LEU B 61 69.095 -10.094 0.447 1.00 0.00 H new ATOM 2867 N ASP B 62 74.128 -11.220 0.964 1.00 0.00 N ATOM 2868 CA ASP B 62 74.895 -11.137 2.240 1.00 0.00 C ATOM 2869 C ASP B 62 76.312 -10.855 1.771 1.00 0.00 C ATOM 2870 O ASP B 62 77.279 -11.481 2.120 1.00 0.00 O ATOM 2871 CB ASP B 62 74.820 -12.435 3.042 1.00 0.00 C ATOM 2872 CG ASP B 62 75.583 -12.247 4.351 1.00 0.00 C ATOM 2873 OD1 ASP B 62 76.530 -11.480 4.356 1.00 0.00 O ATOM 2874 OD2 ASP B 62 75.208 -12.870 5.324 1.00 0.00 O ATOM 0 H ASP B 62 74.047 -12.155 0.565 1.00 0.00 H new ATOM 0 HA ASP B 62 74.505 -10.376 2.916 1.00 0.00 H new ATOM 0 HB2 ASP B 62 73.781 -12.694 3.244 1.00 0.00 H new ATOM 0 HB3 ASP B 62 75.248 -13.258 2.470 1.00 0.00 H new ATOM 2879 N GLU B 63 76.335 -9.905 0.902 1.00 0.00 N ATOM 2880 CA GLU B 63 77.572 -9.448 0.230 1.00 0.00 C ATOM 2881 C GLU B 63 78.745 -9.427 1.218 1.00 0.00 C ATOM 2882 O GLU B 63 79.892 -9.438 0.819 1.00 0.00 O ATOM 2883 CB GLU B 63 77.316 -8.062 -0.325 1.00 0.00 C ATOM 2884 CG GLU B 63 78.544 -7.568 -1.095 1.00 0.00 C ATOM 2885 CD GLU B 63 78.264 -6.177 -1.667 1.00 0.00 C ATOM 2886 OE1 GLU B 63 77.150 -5.706 -1.507 1.00 0.00 O ATOM 2887 OE2 GLU B 63 79.168 -5.606 -2.255 1.00 0.00 O ATOM 0 H GLU B 63 75.500 -9.396 0.612 1.00 0.00 H new ATOM 0 HA GLU B 63 77.837 -10.131 -0.577 1.00 0.00 H new ATOM 0 HB2 GLU B 63 76.447 -8.080 -0.983 1.00 0.00 H new ATOM 0 HB3 GLU B 63 77.085 -7.373 0.488 1.00 0.00 H new ATOM 0 HG2 GLU B 63 79.410 -7.533 -0.435 1.00 0.00 H new ATOM 0 HG3 GLU B 63 78.785 -8.262 -1.900 1.00 0.00 H new ATOM 2894 N ASN B 64 78.483 -9.422 2.500 1.00 0.00 N ATOM 2895 CA ASN B 64 79.608 -9.428 3.488 1.00 0.00 C ATOM 2896 C ASN B 64 80.010 -10.880 3.745 1.00 0.00 C ATOM 2897 O ASN B 64 80.922 -11.175 4.493 1.00 0.00 O ATOM 2898 CB ASN B 64 79.163 -8.754 4.789 1.00 0.00 C ATOM 2899 CG ASN B 64 79.138 -7.237 4.590 1.00 0.00 C ATOM 2900 OD1 ASN B 64 79.854 -6.710 3.761 1.00 0.00 O ATOM 2901 ND2 ASN B 64 78.341 -6.503 5.320 1.00 0.00 N ATOM 0 H ASN B 64 77.547 -9.414 2.905 1.00 0.00 H new ATOM 0 HA ASN B 64 80.461 -8.874 3.096 1.00 0.00 H new ATOM 0 HB2 ASN B 64 78.174 -9.111 5.077 1.00 0.00 H new ATOM 0 HB3 ASN B 64 79.844 -9.015 5.599 1.00 0.00 H new ATOM 0 HD21 ASN B 64 78.321 -5.491 5.193 1.00 0.00 H new ATOM 0 HD22 ASN B 64 77.739 -6.942 6.017 1.00 0.00 H new ATOM 2908 N GLY B 65 79.345 -11.779 3.081 1.00 0.00 N ATOM 2909 CA GLY B 65 79.666 -13.235 3.202 1.00 0.00 C ATOM 2910 C GLY B 65 79.514 -13.741 4.643 1.00 0.00 C ATOM 2911 O GLY B 65 80.273 -14.581 5.084 1.00 0.00 O ATOM 0 H GLY B 65 78.576 -11.567 2.445 1.00 0.00 H new ATOM 0 HA2 GLY B 65 79.009 -13.806 2.546 1.00 0.00 H new ATOM 0 HA3 GLY B 65 80.687 -13.410 2.862 1.00 0.00 H new ATOM 2915 N ASP B 66 78.551 -13.251 5.379 1.00 0.00 N ATOM 2916 CA ASP B 66 78.367 -13.728 6.795 1.00 0.00 C ATOM 2917 C ASP B 66 77.188 -14.708 6.885 1.00 0.00 C ATOM 2918 O ASP B 66 76.983 -15.341 7.902 1.00 0.00 O ATOM 2919 CB ASP B 66 78.123 -12.531 7.717 1.00 0.00 C ATOM 2920 CG ASP B 66 76.968 -11.693 7.178 1.00 0.00 C ATOM 2921 OD1 ASP B 66 75.837 -12.030 7.474 1.00 0.00 O ATOM 2922 OD2 ASP B 66 77.235 -10.730 6.479 1.00 0.00 O ATOM 0 H ASP B 66 77.884 -12.545 5.069 1.00 0.00 H new ATOM 0 HA ASP B 66 79.273 -14.247 7.110 1.00 0.00 H new ATOM 0 HB2 ASP B 66 77.894 -12.877 8.725 1.00 0.00 H new ATOM 0 HB3 ASP B 66 79.025 -11.923 7.786 1.00 0.00 H new ATOM 2927 N GLY B 67 76.426 -14.865 5.839 1.00 0.00 N ATOM 2928 CA GLY B 67 75.287 -15.834 5.885 1.00 0.00 C ATOM 2929 C GLY B 67 74.066 -15.199 6.556 1.00 0.00 C ATOM 2930 O GLY B 67 72.967 -15.756 6.524 1.00 0.00 O ATOM 0 H GLY B 67 76.539 -14.368 4.956 1.00 0.00 H new ATOM 0 HA2 GLY B 67 75.030 -16.150 4.874 1.00 0.00 H new ATOM 0 HA3 GLY B 67 75.585 -16.728 6.432 1.00 0.00 H new ATOM 2934 N GLU B 68 74.237 -14.032 7.159 1.00 0.00 N ATOM 2935 CA GLU B 68 73.114 -13.346 7.826 1.00 0.00 C ATOM 2936 C GLU B 68 72.868 -12.029 7.095 1.00 0.00 C ATOM 2937 O GLU B 68 73.782 -11.403 6.597 1.00 0.00 O ATOM 2938 CB GLU B 68 73.505 -13.064 9.270 1.00 0.00 C ATOM 2939 CG GLU B 68 73.508 -14.367 10.073 1.00 0.00 C ATOM 2940 CD GLU B 68 74.149 -14.118 11.441 1.00 0.00 C ATOM 2941 OE1 GLU B 68 74.746 -13.069 11.612 1.00 0.00 O ATOM 2942 OE2 GLU B 68 74.030 -14.982 12.294 1.00 0.00 O ATOM 0 H GLU B 68 75.127 -13.536 7.206 1.00 0.00 H new ATOM 0 HA GLU B 68 72.213 -13.959 7.808 1.00 0.00 H new ATOM 0 HB2 GLU B 68 74.492 -12.603 9.305 1.00 0.00 H new ATOM 0 HB3 GLU B 68 72.806 -12.355 9.713 1.00 0.00 H new ATOM 0 HG2 GLU B 68 72.489 -14.733 10.198 1.00 0.00 H new ATOM 0 HG3 GLU B 68 74.060 -15.138 9.535 1.00 0.00 H new ATOM 2949 N VAL B 69 71.649 -11.630 6.987 1.00 0.00 N ATOM 2950 CA VAL B 69 71.328 -10.382 6.251 1.00 0.00 C ATOM 2951 C VAL B 69 71.060 -9.236 7.223 1.00 0.00 C ATOM 2952 O VAL B 69 70.282 -9.348 8.148 1.00 0.00 O ATOM 2953 CB VAL B 69 70.088 -10.660 5.420 1.00 0.00 C ATOM 2954 CG1 VAL B 69 69.579 -9.374 4.767 1.00 0.00 C ATOM 2955 CG2 VAL B 69 70.434 -11.678 4.329 1.00 0.00 C ATOM 0 H VAL B 69 70.844 -12.117 7.380 1.00 0.00 H new ATOM 0 HA VAL B 69 72.166 -10.087 5.619 1.00 0.00 H new ATOM 0 HB VAL B 69 69.308 -11.055 6.071 1.00 0.00 H new ATOM 0 HG11 VAL B 69 68.690 -9.593 4.176 1.00 0.00 H new ATOM 0 HG12 VAL B 69 69.330 -8.647 5.540 1.00 0.00 H new ATOM 0 HG13 VAL B 69 70.354 -8.964 4.119 1.00 0.00 H new ATOM 0 HG21 VAL B 69 69.548 -11.883 3.728 1.00 0.00 H new ATOM 0 HG22 VAL B 69 71.220 -11.274 3.691 1.00 0.00 H new ATOM 0 HG23 VAL B 69 70.781 -12.603 4.791 1.00 0.00 H new ATOM 2965 N ASP B 70 71.689 -8.120 6.995 1.00 0.00 N ATOM 2966 CA ASP B 70 71.462 -6.941 7.868 1.00 0.00 C ATOM 2967 C ASP B 70 70.178 -6.259 7.407 1.00 0.00 C ATOM 2968 O ASP B 70 69.724 -6.464 6.298 1.00 0.00 O ATOM 2969 CB ASP B 70 72.639 -5.973 7.748 1.00 0.00 C ATOM 2970 CG ASP B 70 73.869 -6.582 8.424 1.00 0.00 C ATOM 2971 OD1 ASP B 70 73.688 -7.460 9.252 1.00 0.00 O ATOM 2972 OD2 ASP B 70 74.967 -6.160 8.105 1.00 0.00 O ATOM 0 H ASP B 70 72.355 -7.974 6.236 1.00 0.00 H new ATOM 0 HA ASP B 70 71.375 -7.249 8.910 1.00 0.00 H new ATOM 0 HB2 ASP B 70 72.851 -5.769 6.698 1.00 0.00 H new ATOM 0 HB3 ASP B 70 72.389 -5.020 8.214 1.00 0.00 H new ATOM 2977 N PHE B 71 69.576 -5.464 8.237 1.00 0.00 N ATOM 2978 CA PHE B 71 68.315 -4.800 7.820 1.00 0.00 C ATOM 2979 C PHE B 71 68.564 -3.927 6.585 1.00 0.00 C ATOM 2980 O PHE B 71 67.735 -3.845 5.705 1.00 0.00 O ATOM 2981 CB PHE B 71 67.780 -3.929 8.958 1.00 0.00 C ATOM 2982 CG PHE B 71 68.796 -2.867 9.311 1.00 0.00 C ATOM 2983 CD1 PHE B 71 68.788 -1.639 8.639 1.00 0.00 C ATOM 2984 CD2 PHE B 71 69.747 -3.112 10.309 1.00 0.00 C ATOM 2985 CE1 PHE B 71 69.730 -0.655 8.966 1.00 0.00 C ATOM 2986 CE2 PHE B 71 70.689 -2.128 10.636 1.00 0.00 C ATOM 2987 CZ PHE B 71 70.680 -0.900 9.963 1.00 0.00 C ATOM 0 H PHE B 71 69.898 -5.245 9.180 1.00 0.00 H new ATOM 0 HA PHE B 71 67.580 -5.568 7.577 1.00 0.00 H new ATOM 0 HB2 PHE B 71 66.841 -3.462 8.660 1.00 0.00 H new ATOM 0 HB3 PHE B 71 67.567 -4.546 9.831 1.00 0.00 H new ATOM 0 HD1 PHE B 71 68.055 -1.450 7.868 1.00 0.00 H new ATOM 0 HD2 PHE B 71 69.754 -4.060 10.827 1.00 0.00 H new ATOM 0 HE1 PHE B 71 69.723 0.293 8.448 1.00 0.00 H new ATOM 0 HE2 PHE B 71 71.422 -2.316 11.407 1.00 0.00 H new ATOM 0 HZ PHE B 71 71.407 -0.142 10.214 1.00 0.00 H new ATOM 2997 N GLN B 72 69.682 -3.258 6.520 1.00 0.00 N ATOM 2998 CA GLN B 72 69.957 -2.371 5.346 1.00 0.00 C ATOM 2999 C GLN B 72 70.048 -3.179 4.038 1.00 0.00 C ATOM 3000 O GLN B 72 69.583 -2.748 3.003 1.00 0.00 O ATOM 3001 CB GLN B 72 71.275 -1.630 5.582 1.00 0.00 C ATOM 3002 CG GLN B 72 71.587 -0.711 4.396 1.00 0.00 C ATOM 3003 CD GLN B 72 72.855 0.090 4.699 1.00 0.00 C ATOM 3004 OE1 GLN B 72 73.342 0.079 5.812 1.00 0.00 O ATOM 3005 NE2 GLN B 72 73.417 0.787 3.749 1.00 0.00 N ATOM 0 H GLN B 72 70.418 -3.285 7.226 1.00 0.00 H new ATOM 0 HA GLN B 72 69.134 -1.664 5.246 1.00 0.00 H new ATOM 0 HB2 GLN B 72 71.211 -1.044 6.499 1.00 0.00 H new ATOM 0 HB3 GLN B 72 72.084 -2.347 5.718 1.00 0.00 H new ATOM 0 HG2 GLN B 72 71.723 -1.301 3.490 1.00 0.00 H new ATOM 0 HG3 GLN B 72 70.751 -0.036 4.214 1.00 0.00 H new ATOM 0 HE21 GLN B 72 73.009 0.797 2.814 1.00 0.00 H new ATOM 0 HE22 GLN B 72 74.264 1.322 3.942 1.00 0.00 H new ATOM 3014 N GLU B 73 70.659 -4.328 4.062 1.00 0.00 N ATOM 3015 CA GLU B 73 70.791 -5.129 2.805 1.00 0.00 C ATOM 3016 C GLU B 73 69.420 -5.649 2.358 1.00 0.00 C ATOM 3017 O GLU B 73 69.107 -5.698 1.184 1.00 0.00 O ATOM 3018 CB GLU B 73 71.710 -6.325 3.065 1.00 0.00 C ATOM 3019 CG GLU B 73 73.151 -5.854 3.261 1.00 0.00 C ATOM 3020 CD GLU B 73 74.043 -7.067 3.537 1.00 0.00 C ATOM 3021 OE1 GLU B 73 73.558 -8.177 3.392 1.00 0.00 O ATOM 3022 OE2 GLU B 73 75.193 -6.867 3.889 1.00 0.00 O ATOM 0 H GLU B 73 71.073 -4.751 4.893 1.00 0.00 H new ATOM 0 HA GLU B 73 71.207 -4.492 2.024 1.00 0.00 H new ATOM 0 HB2 GLU B 73 71.373 -6.865 3.950 1.00 0.00 H new ATOM 0 HB3 GLU B 73 71.658 -7.021 2.228 1.00 0.00 H new ATOM 0 HG2 GLU B 73 73.498 -5.327 2.372 1.00 0.00 H new ATOM 0 HG3 GLU B 73 73.207 -5.150 4.091 1.00 0.00 H new ATOM 3029 N PHE B 74 68.623 -6.070 3.292 1.00 0.00 N ATOM 3030 CA PHE B 74 67.280 -6.635 2.976 1.00 0.00 C ATOM 3031 C PHE B 74 66.348 -5.604 2.332 1.00 0.00 C ATOM 3032 O PHE B 74 65.748 -5.857 1.315 1.00 0.00 O ATOM 3033 CB PHE B 74 66.683 -7.098 4.303 1.00 0.00 C ATOM 3034 CG PHE B 74 65.218 -7.424 4.161 1.00 0.00 C ATOM 3035 CD1 PHE B 74 64.823 -8.718 3.825 1.00 0.00 C ATOM 3036 CD2 PHE B 74 64.258 -6.430 4.379 1.00 0.00 C ATOM 3037 CE1 PHE B 74 63.465 -9.025 3.706 1.00 0.00 C ATOM 3038 CE2 PHE B 74 62.900 -6.732 4.258 1.00 0.00 C ATOM 3039 CZ PHE B 74 62.502 -8.031 3.921 1.00 0.00 C ATOM 0 H PHE B 74 68.848 -6.047 4.287 1.00 0.00 H new ATOM 0 HA PHE B 74 67.387 -7.448 2.258 1.00 0.00 H new ATOM 0 HB2 PHE B 74 67.220 -7.977 4.659 1.00 0.00 H new ATOM 0 HB3 PHE B 74 66.813 -6.319 5.054 1.00 0.00 H new ATOM 0 HD1 PHE B 74 65.566 -9.483 3.657 1.00 0.00 H new ATOM 0 HD2 PHE B 74 64.567 -5.429 4.641 1.00 0.00 H new ATOM 0 HE1 PHE B 74 63.158 -10.028 3.448 1.00 0.00 H new ATOM 0 HE2 PHE B 74 62.158 -5.965 4.424 1.00 0.00 H new ATOM 0 HZ PHE B 74 61.452 -8.267 3.827 1.00 0.00 H new ATOM 3049 N VAL B 75 66.195 -4.475 2.950 1.00 0.00 N ATOM 3050 CA VAL B 75 65.262 -3.436 2.428 1.00 0.00 C ATOM 3051 C VAL B 75 65.656 -2.979 1.019 1.00 0.00 C ATOM 3052 O VAL B 75 64.814 -2.637 0.213 1.00 0.00 O ATOM 3053 CB VAL B 75 65.254 -2.245 3.393 1.00 0.00 C ATOM 3054 CG1 VAL B 75 66.579 -1.487 3.325 1.00 0.00 C ATOM 3055 CG2 VAL B 75 64.106 -1.300 3.036 1.00 0.00 C ATOM 0 H VAL B 75 66.682 -4.219 3.809 1.00 0.00 H new ATOM 0 HA VAL B 75 64.263 -3.866 2.359 1.00 0.00 H new ATOM 0 HB VAL B 75 65.118 -2.622 4.407 1.00 0.00 H new ATOM 0 HG11 VAL B 75 66.553 -0.646 4.017 1.00 0.00 H new ATOM 0 HG12 VAL B 75 67.395 -2.156 3.598 1.00 0.00 H new ATOM 0 HG13 VAL B 75 66.736 -1.118 2.311 1.00 0.00 H new ATOM 0 HG21 VAL B 75 64.103 -0.455 3.724 1.00 0.00 H new ATOM 0 HG22 VAL B 75 64.237 -0.938 2.016 1.00 0.00 H new ATOM 0 HG23 VAL B 75 63.158 -1.833 3.113 1.00 0.00 H new ATOM 3065 N VAL B 76 66.920 -2.928 0.727 1.00 0.00 N ATOM 3066 CA VAL B 76 67.347 -2.443 -0.617 1.00 0.00 C ATOM 3067 C VAL B 76 66.977 -3.434 -1.740 1.00 0.00 C ATOM 3068 O VAL B 76 66.303 -3.075 -2.686 1.00 0.00 O ATOM 3069 CB VAL B 76 68.863 -2.230 -0.592 1.00 0.00 C ATOM 3070 CG1 VAL B 76 69.368 -1.902 -1.997 1.00 0.00 C ATOM 3071 CG2 VAL B 76 69.183 -1.066 0.348 1.00 0.00 C ATOM 0 H VAL B 76 67.677 -3.199 1.355 1.00 0.00 H new ATOM 0 HA VAL B 76 66.825 -1.510 -0.830 1.00 0.00 H new ATOM 0 HB VAL B 76 69.353 -3.139 -0.243 1.00 0.00 H new ATOM 0 HG11 VAL B 76 70.447 -1.752 -1.970 1.00 0.00 H new ATOM 0 HG12 VAL B 76 69.133 -2.727 -2.670 1.00 0.00 H new ATOM 0 HG13 VAL B 76 68.884 -0.993 -2.355 1.00 0.00 H new ATOM 0 HG21 VAL B 76 70.261 -0.905 0.374 1.00 0.00 H new ATOM 0 HG22 VAL B 76 68.690 -0.163 -0.010 1.00 0.00 H new ATOM 0 HG23 VAL B 76 68.827 -1.300 1.351 1.00 0.00 H new ATOM 3081 N LEU B 77 67.459 -4.645 -1.688 1.00 0.00 N ATOM 3082 CA LEU B 77 67.180 -5.607 -2.806 1.00 0.00 C ATOM 3083 C LEU B 77 65.707 -6.023 -2.882 1.00 0.00 C ATOM 3084 O LEU B 77 65.159 -6.187 -3.955 1.00 0.00 O ATOM 3085 CB LEU B 77 68.057 -6.856 -2.646 1.00 0.00 C ATOM 3086 CG LEU B 77 67.839 -7.830 -3.842 1.00 0.00 C ATOM 3087 CD1 LEU B 77 69.172 -8.464 -4.257 1.00 0.00 C ATOM 3088 CD2 LEU B 77 66.860 -8.957 -3.461 1.00 0.00 C ATOM 0 H LEU B 77 68.031 -5.014 -0.928 1.00 0.00 H new ATOM 0 HA LEU B 77 67.417 -5.090 -3.736 1.00 0.00 H new ATOM 0 HB2 LEU B 77 69.106 -6.567 -2.591 1.00 0.00 H new ATOM 0 HB3 LEU B 77 67.816 -7.360 -1.710 1.00 0.00 H new ATOM 0 HG LEU B 77 67.424 -7.253 -4.668 1.00 0.00 H new ATOM 0 HD11 LEU B 77 69.007 -9.143 -5.094 1.00 0.00 H new ATOM 0 HD12 LEU B 77 69.869 -7.682 -4.556 1.00 0.00 H new ATOM 0 HD13 LEU B 77 69.588 -9.019 -3.416 1.00 0.00 H new ATOM 0 HD21 LEU B 77 66.724 -9.624 -4.312 1.00 0.00 H new ATOM 0 HD22 LEU B 77 67.263 -9.520 -2.619 1.00 0.00 H new ATOM 0 HD23 LEU B 77 65.899 -8.525 -3.181 1.00 0.00 H new ATOM 3100 N VAL B 78 65.078 -6.245 -1.777 1.00 0.00 N ATOM 3101 CA VAL B 78 63.659 -6.710 -1.797 1.00 0.00 C ATOM 3102 C VAL B 78 62.726 -5.640 -2.378 1.00 0.00 C ATOM 3103 O VAL B 78 61.785 -5.939 -3.085 1.00 0.00 O ATOM 3104 CB VAL B 78 63.237 -7.009 -0.358 1.00 0.00 C ATOM 3105 CG1 VAL B 78 64.202 -8.024 0.274 1.00 0.00 C ATOM 3106 CG2 VAL B 78 63.246 -5.689 0.439 1.00 0.00 C ATOM 0 H VAL B 78 65.480 -6.126 -0.847 1.00 0.00 H new ATOM 0 HA VAL B 78 63.587 -7.598 -2.425 1.00 0.00 H new ATOM 0 HB VAL B 78 62.236 -7.439 -0.344 1.00 0.00 H new ATOM 0 HG11 VAL B 78 63.893 -8.230 1.299 1.00 0.00 H new ATOM 0 HG12 VAL B 78 64.187 -8.949 -0.303 1.00 0.00 H new ATOM 0 HG13 VAL B 78 65.212 -7.614 0.275 1.00 0.00 H new ATOM 0 HG21 VAL B 78 62.947 -5.884 1.469 1.00 0.00 H new ATOM 0 HG22 VAL B 78 64.249 -5.263 0.427 1.00 0.00 H new ATOM 0 HG23 VAL B 78 62.548 -4.985 -0.014 1.00 0.00 H new ATOM 3116 N ALA B 79 62.973 -4.406 -2.073 1.00 0.00 N ATOM 3117 CA ALA B 79 62.092 -3.314 -2.589 1.00 0.00 C ATOM 3118 C ALA B 79 62.411 -3.041 -4.061 1.00 0.00 C ATOM 3119 O ALA B 79 61.590 -2.550 -4.805 1.00 0.00 O ATOM 3120 CB ALA B 79 62.288 -2.041 -1.761 1.00 0.00 C ATOM 0 H ALA B 79 63.748 -4.096 -1.487 1.00 0.00 H new ATOM 0 HA ALA B 79 61.052 -3.628 -2.504 1.00 0.00 H new ATOM 0 HB1 ALA B 79 61.641 -1.253 -2.147 1.00 0.00 H new ATOM 0 HB2 ALA B 79 62.035 -2.242 -0.720 1.00 0.00 H new ATOM 0 HB3 ALA B 79 63.328 -1.721 -1.826 1.00 0.00 H new ATOM 3126 N ALA B 80 63.598 -3.341 -4.488 1.00 0.00 N ATOM 3127 CA ALA B 80 63.957 -3.093 -5.911 1.00 0.00 C ATOM 3128 C ALA B 80 63.241 -4.092 -6.833 1.00 0.00 C ATOM 3129 O ALA B 80 63.066 -3.842 -8.007 1.00 0.00 O ATOM 3130 CB ALA B 80 65.467 -3.245 -6.090 1.00 0.00 C ATOM 0 H ALA B 80 64.338 -3.748 -3.916 1.00 0.00 H new ATOM 0 HA ALA B 80 63.647 -2.082 -6.175 1.00 0.00 H new ATOM 0 HB1 ALA B 80 65.730 -3.063 -7.132 1.00 0.00 H new ATOM 0 HB2 ALA B 80 65.983 -2.525 -5.455 1.00 0.00 H new ATOM 0 HB3 ALA B 80 65.767 -4.255 -5.811 1.00 0.00 H new ATOM 3136 N LEU B 81 62.806 -5.210 -6.312 1.00 0.00 N ATOM 3137 CA LEU B 81 62.094 -6.212 -7.169 1.00 0.00 C ATOM 3138 C LEU B 81 60.585 -5.980 -7.073 1.00 0.00 C ATOM 3139 O LEU B 81 59.864 -6.165 -8.026 1.00 0.00 O ATOM 3140 CB LEU B 81 62.438 -7.630 -6.694 1.00 0.00 C ATOM 3141 CG LEU B 81 63.959 -7.823 -6.660 1.00 0.00 C ATOM 3142 CD1 LEU B 81 64.278 -9.204 -6.083 1.00 0.00 C ATOM 3143 CD2 LEU B 81 64.541 -7.718 -8.076 1.00 0.00 C ATOM 0 H LEU B 81 62.911 -5.475 -5.333 1.00 0.00 H new ATOM 0 HA LEU B 81 62.409 -6.098 -8.206 1.00 0.00 H new ATOM 0 HB2 LEU B 81 62.020 -7.800 -5.702 1.00 0.00 H new ATOM 0 HB3 LEU B 81 61.986 -8.364 -7.361 1.00 0.00 H new ATOM 0 HG LEU B 81 64.402 -7.046 -6.037 1.00 0.00 H new ATOM 0 HD11 LEU B 81 65.358 -9.347 -6.057 1.00 0.00 H new ATOM 0 HD12 LEU B 81 63.877 -9.277 -5.072 1.00 0.00 H new ATOM 0 HD13 LEU B 81 63.826 -9.973 -6.709 1.00 0.00 H new ATOM 0 HD21 LEU B 81 65.621 -7.857 -8.037 1.00 0.00 H new ATOM 0 HD22 LEU B 81 64.099 -8.487 -8.709 1.00 0.00 H new ATOM 0 HD23 LEU B 81 64.317 -6.735 -8.490 1.00 0.00 H new ATOM 3155 N THR B 82 60.103 -5.595 -5.933 1.00 0.00 N ATOM 3156 CA THR B 82 58.633 -5.369 -5.812 1.00 0.00 C ATOM 3157 C THR B 82 58.220 -4.166 -6.687 1.00 0.00 C ATOM 3158 O THR B 82 57.275 -4.242 -7.458 1.00 0.00 O ATOM 3159 CB THR B 82 58.236 -5.143 -4.344 1.00 0.00 C ATOM 3160 OG1 THR B 82 56.835 -5.335 -4.209 1.00 0.00 O ATOM 3161 CG2 THR B 82 58.593 -3.729 -3.898 1.00 0.00 C ATOM 0 H THR B 82 60.648 -5.427 -5.087 1.00 0.00 H new ATOM 0 HA THR B 82 58.107 -6.256 -6.164 1.00 0.00 H new ATOM 0 HB THR B 82 58.779 -5.853 -3.720 1.00 0.00 H new ATOM 0 HG1 THR B 82 56.422 -4.511 -3.876 1.00 0.00 H new ATOM 0 HG21 THR B 82 58.303 -3.592 -2.856 1.00 0.00 H new ATOM 0 HG22 THR B 82 59.668 -3.576 -3.999 1.00 0.00 H new ATOM 0 HG23 THR B 82 58.064 -3.007 -4.520 1.00 0.00 H new ATOM 3169 N VAL B 83 58.925 -3.065 -6.595 1.00 0.00 N ATOM 3170 CA VAL B 83 58.567 -1.878 -7.430 1.00 0.00 C ATOM 3171 C VAL B 83 58.910 -2.147 -8.887 1.00 0.00 C ATOM 3172 O VAL B 83 58.183 -1.786 -9.790 1.00 0.00 O ATOM 3173 CB VAL B 83 59.375 -0.661 -6.985 1.00 0.00 C ATOM 3174 CG1 VAL B 83 58.936 0.563 -7.790 1.00 0.00 C ATOM 3175 CG2 VAL B 83 59.152 -0.411 -5.502 1.00 0.00 C ATOM 0 H VAL B 83 59.729 -2.938 -5.981 1.00 0.00 H new ATOM 0 HA VAL B 83 57.499 -1.691 -7.314 1.00 0.00 H new ATOM 0 HB VAL B 83 60.435 -0.846 -7.159 1.00 0.00 H new ATOM 0 HG11 VAL B 83 59.512 1.432 -7.473 1.00 0.00 H new ATOM 0 HG12 VAL B 83 59.107 0.381 -8.851 1.00 0.00 H new ATOM 0 HG13 VAL B 83 57.875 0.749 -7.620 1.00 0.00 H new ATOM 0 HG21 VAL B 83 59.730 0.458 -5.189 1.00 0.00 H new ATOM 0 HG22 VAL B 83 58.093 -0.228 -5.319 1.00 0.00 H new ATOM 0 HG23 VAL B 83 59.472 -1.284 -4.934 1.00 0.00 H new ATOM 3185 N ALA B 84 60.039 -2.746 -9.118 1.00 0.00 N ATOM 3186 CA ALA B 84 60.466 -3.007 -10.510 1.00 0.00 C ATOM 3187 C ALA B 84 59.471 -3.933 -11.207 1.00 0.00 C ATOM 3188 O ALA B 84 59.266 -3.853 -12.401 1.00 0.00 O ATOM 3189 CB ALA B 84 61.850 -3.657 -10.507 1.00 0.00 C ATOM 0 H ALA B 84 60.686 -3.067 -8.398 1.00 0.00 H new ATOM 0 HA ALA B 84 60.505 -2.060 -11.049 1.00 0.00 H new ATOM 0 HB1 ALA B 84 62.164 -3.849 -11.533 1.00 0.00 H new ATOM 0 HB2 ALA B 84 62.565 -2.988 -10.028 1.00 0.00 H new ATOM 0 HB3 ALA B 84 61.809 -4.598 -9.958 1.00 0.00 H new ATOM 3195 N CYS B 85 58.849 -4.811 -10.472 1.00 0.00 N ATOM 3196 CA CYS B 85 57.866 -5.745 -11.087 1.00 0.00 C ATOM 3197 C CYS B 85 56.693 -4.946 -11.652 1.00 0.00 C ATOM 3198 O CYS B 85 56.188 -5.229 -12.719 1.00 0.00 O ATOM 3199 CB CYS B 85 57.362 -6.713 -10.012 1.00 0.00 C ATOM 3200 SG CYS B 85 58.645 -7.938 -9.655 1.00 0.00 S ATOM 0 H CYS B 85 58.980 -4.922 -9.467 1.00 0.00 H new ATOM 0 HA CYS B 85 58.339 -6.306 -11.893 1.00 0.00 H new ATOM 0 HB2 CYS B 85 57.105 -6.165 -9.106 1.00 0.00 H new ATOM 0 HB3 CYS B 85 56.454 -7.210 -10.352 1.00 0.00 H new ATOM 0 HG CYS B 85 59.501 -7.438 -8.814 1.00 0.00 H new ATOM 3206 N ASN B 86 56.265 -3.940 -10.941 1.00 0.00 N ATOM 3207 CA ASN B 86 55.130 -3.105 -11.429 1.00 0.00 C ATOM 3208 C ASN B 86 55.582 -2.278 -12.634 1.00 0.00 C ATOM 3209 O ASN B 86 54.800 -1.940 -13.503 1.00 0.00 O ATOM 3210 CB ASN B 86 54.686 -2.161 -10.313 1.00 0.00 C ATOM 3211 CG ASN B 86 54.231 -2.981 -9.107 1.00 0.00 C ATOM 3212 OD1 ASN B 86 54.498 -2.549 -7.906 1.00 0.00 O flip ATOM 3213 ND2 ASN B 86 53.636 -4.029 -9.259 1.00 0.00 N flip ATOM 0 H ASN B 86 56.653 -3.659 -10.041 1.00 0.00 H new ATOM 0 HA ASN B 86 54.302 -3.752 -11.721 1.00 0.00 H new ATOM 0 HB2 ASN B 86 55.507 -1.503 -10.030 1.00 0.00 H new ATOM 0 HB3 ASN B 86 53.873 -1.525 -10.662 1.00 0.00 H new ATOM 0 HD21 ASN B 86 53.428 -4.366 -10.199 1.00 0.00 H new ATOM 0 HD22 ASN B 86 53.344 -4.572 -8.447 1.00 0.00 H new ATOM 3220 N ASN B 87 56.835 -1.929 -12.670 1.00 0.00 N ATOM 3221 CA ASN B 87 57.364 -1.093 -13.786 1.00 0.00 C ATOM 3222 C ASN B 87 57.174 -1.796 -15.134 1.00 0.00 C ATOM 3223 O ASN B 87 56.856 -1.168 -16.124 1.00 0.00 O ATOM 3224 CB ASN B 87 58.854 -0.841 -13.550 1.00 0.00 C ATOM 3225 CG ASN B 87 59.419 0.015 -14.681 1.00 0.00 C ATOM 3226 OD1 ASN B 87 58.682 0.658 -15.401 1.00 0.00 O ATOM 3227 ND2 ASN B 87 60.709 0.053 -14.869 1.00 0.00 N ATOM 0 H ASN B 87 57.526 -2.189 -11.966 1.00 0.00 H new ATOM 0 HA ASN B 87 56.817 -0.150 -13.811 1.00 0.00 H new ATOM 0 HB2 ASN B 87 59.000 -0.339 -12.594 1.00 0.00 H new ATOM 0 HB3 ASN B 87 59.389 -1.789 -13.497 1.00 0.00 H new ATOM 0 HD21 ASN B 87 61.098 0.623 -15.620 1.00 0.00 H new ATOM 0 HD22 ASN B 87 61.329 -0.487 -14.265 1.00 0.00 H new