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 42 SER OG : rot 180:sc= 0.00529 USER MOD Set 1.2: B 43 SER OG : rot 180:sc= -0.613 USER MOD Set 2.1: B 29 SER OG : rot 150:sc= -0.152 USER MOD Set 2.2: B 31 LYS NZ :NH3+ -161:sc= -0.0651 (180deg=-0.459) USER MOD Set 3.1: A 82 THR OG1 : rot -116:sc= 0.589 USER MOD Set 3.2: B 8 MET CE :methyl 180:sc= -0.0729 (180deg=0) USER MOD Set 4.1: A 42 SER OG : rot 180:sc= 0.00264 USER MOD Set 4.2: A 43 SER OG : rot 180:sc= -0.459 USER MOD Set 5.1: A 29 SER OG : rot 160:sc= -0.148 USER MOD Set 5.2: A 31 LYS NZ :NH3+ -131:sc= -0.0452 (180deg=-0.417) USER MOD Set 6.1: A 8 MET CE :methyl 180:sc= -0.0197 (180deg=0) USER MOD Set 6.2: B 82 THR OG1 : rot -119:sc= 0.376 USER MOD Single : A 2 SER OG : rot 8:sc= 0.26! USER MOD Single : A 6 THR OG1 : rot 4:sc= 0.079 USER MOD Single : A 10 THR OG1 : rot -7:sc= -2.82! USER MOD Single : A 13 ASN :FLIP amide:sc= -0.483 F(o=-2.5,f=-0.48) USER MOD Single : A 16 HIS : no HD1:sc= -0.92 K(o=-0.92,f=-1.9) USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 19 SER OG : rot 111:sc= -0.734 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 151:sc= -1.62 (180deg=-4.49!) USER MOD Single : A 30 LYS NZ :NH3+ -166:sc=-0.000448 (180deg=-0.118) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN :FLIP amide:sc= -1.77 F(o=-4!,f=-1.8) USER MOD Single : A 39 THR OG1 : rot 128:sc= 1.22 USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 49 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.11) USER MOD Single : A 56 LYS NZ :NH3+ -163:sc= -0.0376 (180deg=-0.334) USER MOD Single : A 58 MET CE :methyl 137:sc= -1.93 (180deg=-5.05!) USER MOD Single : A 59 LYS NZ :NH3+ -165:sc=-0.00769 (180deg=-0.21) USER MOD Single : A 64 ASN : amide:sc= -0.0539 K(o=-0.054,f=-1.7!) USER MOD Single : A 72 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 85 CYS SG : rot 95:sc= 0.195 USER MOD Single : A 86 ASN : amide:sc= -0.596 X(o=-0.6,f=-0.15) USER MOD Single : A 87 ASN : amide:sc= -0.0765 K(o=-0.077,f=-1.6) USER MOD Single : B 2 SER OG : rot 6:sc= 0.48 USER MOD Single : B 6 THR OG1 : rot 2:sc= 0.323 USER MOD Single : B 10 THR OG1 : rot -1:sc= -2.88! USER MOD Single : B 13 ASN :FLIP amide:sc= -0.472 F(o=-2.6,f=-0.47) USER MOD Single : B 16 HIS : no HD1:sc= -1.01 K(o=-1,f=-1.7) USER MOD Single : B 18 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : B 19 SER OG : rot 116:sc= -0.684 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ 147:sc= -1.53 (180deg=-4.65!) USER MOD Single : B 30 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0826) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 GLN :FLIP amide:sc= -1.87 F(o=-4.2!,f=-1.9) USER MOD Single : B 39 THR OG1 : rot 127:sc= 1.2 USER MOD Single : B 48 GLN : amide:sc= -0.0162 K(o=-0.016,f=-1.7!) USER MOD Single : B 49 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0915) USER MOD Single : B 56 LYS NZ :NH3+ -163:sc= -0.0539 (180deg=-0.414) USER MOD Single : B 58 MET CE :methyl 136:sc= -1.95 (180deg=-4.88!) USER MOD Single : B 59 LYS NZ :NH3+ -165:sc= -0.0182 (180deg=-0.236) USER MOD Single : B 64 ASN : amide:sc= -0.0358 K(o=-0.036,f=-1.8!) USER MOD Single : B 72 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : B 85 CYS SG : rot 88:sc= 0.0881 USER MOD Single : B 86 ASN : amide:sc= -0.56 X(o=-0.56,f=-0.12) USER MOD Single : B 87 ASN : amide:sc= -0.0731 K(o=-0.073,f=-1.7) USER MOD Single : C 6 HIS : no HD1:sc= 0 X(o=0,f=-0.062) USER MOD Single : C 7 LYS NZ :NH3+ 173:sc= -4.27! (180deg=-4.55) USER MOD Single : C 10 SER OG : rot 180:sc= 0 USER MOD Single : D 6 HIS : no HD1:sc= 0 X(o=0,f=-0.059) USER MOD Single : D 7 LYS NZ :NH3+ 179:sc= -3.26 (180deg=-3.33) USER MOD Single : D 10 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N HIS C 6 78.469 10.982 5.843 1.00 0.00 N ATOM 98 CA HIS C 6 79.061 11.621 7.047 1.00 0.00 C ATOM 99 C HIS C 6 78.521 13.047 7.206 1.00 0.00 C ATOM 100 O HIS C 6 78.186 13.476 8.294 1.00 0.00 O ATOM 101 CB HIS C 6 80.582 11.653 6.892 1.00 0.00 C ATOM 102 CG HIS C 6 81.204 12.257 8.121 1.00 0.00 C ATOM 103 ND1 HIS C 6 80.935 11.784 9.398 1.00 0.00 N ATOM 104 CD2 HIS C 6 82.097 13.289 8.283 1.00 0.00 C ATOM 105 CE1 HIS C 6 81.651 12.522 10.264 1.00 0.00 C ATOM 106 NE2 HIS C 6 82.375 13.451 9.636 1.00 0.00 N ATOM 0 HA HIS C 6 78.793 11.048 7.935 1.00 0.00 H new ATOM 0 HB2 HIS C 6 80.963 10.643 6.739 1.00 0.00 H new ATOM 0 HB3 HIS C 6 80.855 12.234 6.011 1.00 0.00 H new ATOM 0 HD2 HIS C 6 82.517 13.882 7.484 1.00 0.00 H new ATOM 0 HE1 HIS C 6 81.642 12.381 11.335 1.00 0.00 H new ATOM 0 HE2 HIS C 6 83.001 14.136 10.060 1.00 0.00 H new ATOM 115 N LYS C 7 78.434 13.784 6.133 1.00 0.00 N ATOM 116 CA LYS C 7 77.921 15.184 6.223 1.00 0.00 C ATOM 117 C LYS C 7 76.485 15.206 6.768 1.00 0.00 C ATOM 118 O LYS C 7 76.152 16.007 7.619 1.00 0.00 O ATOM 119 CB LYS C 7 77.946 15.829 4.828 1.00 0.00 C ATOM 120 CG LYS C 7 77.380 17.275 4.884 1.00 0.00 C ATOM 121 CD LYS C 7 75.942 17.308 4.351 1.00 0.00 C ATOM 122 CE LYS C 7 75.301 18.656 4.694 1.00 0.00 C ATOM 123 NZ LYS C 7 76.327 19.735 4.600 1.00 0.00 N ATOM 0 H LYS C 7 78.696 13.478 5.196 1.00 0.00 H new ATOM 0 HA LYS C 7 78.561 15.744 6.905 1.00 0.00 H new ATOM 0 HB2 LYS C 7 78.967 15.847 4.448 1.00 0.00 H new ATOM 0 HB3 LYS C 7 77.358 15.229 4.133 1.00 0.00 H new ATOM 0 HG2 LYS C 7 77.403 17.642 5.910 1.00 0.00 H new ATOM 0 HG3 LYS C 7 78.009 17.941 4.294 1.00 0.00 H new ATOM 0 HD2 LYS C 7 75.939 17.156 3.272 1.00 0.00 H new ATOM 0 HD3 LYS C 7 75.362 16.496 4.789 1.00 0.00 H new ATOM 0 HE2 LYS C 7 74.477 18.863 4.011 1.00 0.00 H new ATOM 0 HE3 LYS C 7 74.881 18.626 5.700 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 75.868 20.661 4.716 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 77.038 19.604 5.348 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 76.791 19.693 3.670 1.00 0.00 H new ATOM 137 N LEU C 8 75.624 14.355 6.270 1.00 0.00 N ATOM 138 CA LEU C 8 74.207 14.370 6.750 1.00 0.00 C ATOM 139 C LEU C 8 74.109 13.886 8.198 1.00 0.00 C ATOM 140 O LEU C 8 73.575 14.569 9.051 1.00 0.00 O ATOM 141 CB LEU C 8 73.353 13.453 5.859 1.00 0.00 C ATOM 142 CG LEU C 8 71.888 13.457 6.342 1.00 0.00 C ATOM 143 CD1 LEU C 8 71.288 14.871 6.220 1.00 0.00 C ATOM 144 CD2 LEU C 8 71.078 12.460 5.502 1.00 0.00 C ATOM 0 H LEU C 8 75.837 13.656 5.558 1.00 0.00 H new ATOM 0 HA LEU C 8 73.843 15.396 6.699 1.00 0.00 H new ATOM 0 HB2 LEU C 8 73.403 13.790 4.824 1.00 0.00 H new ATOM 0 HB3 LEU C 8 73.749 12.438 5.884 1.00 0.00 H new ATOM 0 HG LEU C 8 71.852 13.161 7.390 1.00 0.00 H new ATOM 0 HD11 LEU C 8 70.254 14.858 6.564 1.00 0.00 H new ATOM 0 HD12 LEU C 8 71.865 15.565 6.831 1.00 0.00 H new ATOM 0 HD13 LEU C 8 71.320 15.191 5.179 1.00 0.00 H new ATOM 0 HD21 LEU C 8 70.041 12.458 5.839 1.00 0.00 H new ATOM 0 HD22 LEU C 8 71.118 12.752 4.452 1.00 0.00 H new ATOM 0 HD23 LEU C 8 71.499 11.461 5.617 1.00 0.00 H new ATOM 156 N LEU C 9 74.580 12.706 8.482 1.00 0.00 N ATOM 157 CA LEU C 9 74.459 12.188 9.873 1.00 0.00 C ATOM 158 C LEU C 9 75.214 13.101 10.842 1.00 0.00 C ATOM 159 O LEU C 9 74.764 13.349 11.942 1.00 0.00 O ATOM 160 CB LEU C 9 75.014 10.760 9.968 1.00 0.00 C ATOM 161 CG LEU C 9 74.420 9.866 8.859 1.00 0.00 C ATOM 162 CD1 LEU C 9 74.732 8.395 9.158 1.00 0.00 C ATOM 163 CD2 LEU C 9 72.901 10.049 8.762 1.00 0.00 C ATOM 0 H LEU C 9 75.040 12.082 7.819 1.00 0.00 H new ATOM 0 HA LEU C 9 73.403 12.172 10.143 1.00 0.00 H new ATOM 0 HB2 LEU C 9 76.100 10.781 9.882 1.00 0.00 H new ATOM 0 HB3 LEU C 9 74.780 10.338 10.946 1.00 0.00 H new ATOM 0 HG LEU C 9 74.869 10.157 7.910 1.00 0.00 H new ATOM 0 HD11 LEU C 9 74.311 7.767 8.373 1.00 0.00 H new ATOM 0 HD12 LEU C 9 75.812 8.253 9.197 1.00 0.00 H new ATOM 0 HD13 LEU C 9 74.295 8.118 10.117 1.00 0.00 H new ATOM 0 HD21 LEU C 9 72.507 9.408 7.973 1.00 0.00 H new ATOM 0 HD22 LEU C 9 72.441 9.779 9.713 1.00 0.00 H new ATOM 0 HD23 LEU C 9 72.674 11.090 8.531 1.00 0.00 H new ATOM 175 N SER C 10 76.363 13.594 10.462 1.00 0.00 N ATOM 176 CA SER C 10 77.130 14.470 11.393 1.00 0.00 C ATOM 177 C SER C 10 76.303 15.710 11.756 1.00 0.00 C ATOM 178 O SER C 10 76.020 15.953 12.912 1.00 0.00 O ATOM 179 CB SER C 10 78.434 14.905 10.721 1.00 0.00 C ATOM 180 OG SER C 10 79.185 15.702 11.627 1.00 0.00 O ATOM 0 H SER C 10 76.800 13.430 9.555 1.00 0.00 H new ATOM 0 HA SER C 10 77.352 13.914 12.304 1.00 0.00 H new ATOM 0 HB2 SER C 10 79.012 14.031 10.422 1.00 0.00 H new ATOM 0 HB3 SER C 10 78.219 15.470 9.814 1.00 0.00 H new ATOM 0 HG SER C 10 80.022 15.981 11.201 1.00 0.00 H new ATOM 323 N HIS D 6 70.022 -10.207 -13.611 1.00 0.00 N ATOM 324 CA HIS D 6 69.554 -10.828 -14.876 1.00 0.00 C ATOM 325 C HIS D 6 69.022 -12.242 -14.602 1.00 0.00 C ATOM 326 O HIS D 6 68.001 -12.639 -15.128 1.00 0.00 O ATOM 327 CB HIS D 6 70.726 -10.897 -15.856 1.00 0.00 C ATOM 328 CG HIS D 6 70.263 -11.489 -17.156 1.00 0.00 C ATOM 329 ND1 HIS D 6 69.190 -10.965 -17.861 1.00 0.00 N ATOM 330 CD2 HIS D 6 70.722 -12.548 -17.899 1.00 0.00 C ATOM 331 CE1 HIS D 6 69.039 -11.703 -18.976 1.00 0.00 C ATOM 332 NE2 HIS D 6 69.947 -12.679 -19.045 1.00 0.00 N ATOM 0 HA HIS D 6 68.750 -10.229 -15.302 1.00 0.00 H new ATOM 0 HB2 HIS D 6 71.132 -9.899 -16.023 1.00 0.00 H new ATOM 0 HB3 HIS D 6 71.529 -11.502 -15.435 1.00 0.00 H new ATOM 0 HD2 HIS D 6 71.556 -13.181 -17.634 1.00 0.00 H new ATOM 0 HE1 HIS D 6 68.278 -11.528 -19.722 1.00 0.00 H new ATOM 0 HE2 HIS D 6 70.050 -13.375 -19.784 1.00 0.00 H new ATOM 341 N LYS D 7 69.701 -13.003 -13.790 1.00 0.00 N ATOM 342 CA LYS D 7 69.229 -14.387 -13.492 1.00 0.00 C ATOM 343 C LYS D 7 67.839 -14.366 -12.844 1.00 0.00 C ATOM 344 O LYS D 7 66.976 -15.146 -13.194 1.00 0.00 O ATOM 345 CB LYS D 7 70.221 -15.075 -12.541 1.00 0.00 C ATOM 346 CG LYS D 7 69.722 -16.501 -12.174 1.00 0.00 C ATOM 347 CD LYS D 7 69.126 -16.510 -10.758 1.00 0.00 C ATOM 348 CE LYS D 7 68.355 -17.815 -10.537 1.00 0.00 C ATOM 349 NZ LYS D 7 69.085 -18.942 -11.181 1.00 0.00 N ATOM 0 H LYS D 7 70.563 -12.728 -13.319 1.00 0.00 H new ATOM 0 HA LYS D 7 69.167 -14.937 -14.431 1.00 0.00 H new ATOM 0 HB2 LYS D 7 71.202 -15.136 -13.012 1.00 0.00 H new ATOM 0 HB3 LYS D 7 70.338 -14.480 -11.635 1.00 0.00 H new ATOM 0 HG2 LYS D 7 68.971 -16.827 -12.894 1.00 0.00 H new ATOM 0 HG3 LYS D 7 70.549 -17.209 -12.232 1.00 0.00 H new ATOM 0 HD2 LYS D 7 69.920 -16.414 -10.017 1.00 0.00 H new ATOM 0 HD3 LYS D 7 68.462 -15.656 -10.626 1.00 0.00 H new ATOM 0 HE2 LYS D 7 68.240 -18.005 -9.470 1.00 0.00 H new ATOM 0 HE3 LYS D 7 67.352 -17.732 -10.955 1.00 0.00 H new ATOM 0 HZ1 LYS D 7 68.569 -19.830 -11.015 1.00 0.00 H new ATOM 0 HZ2 LYS D 7 69.157 -18.769 -12.204 1.00 0.00 H new ATOM 0 HZ3 LYS D 7 70.039 -19.015 -10.774 1.00 0.00 H new ATOM 363 N LEU D 8 67.619 -13.508 -11.884 1.00 0.00 N ATOM 364 CA LEU D 8 66.285 -13.486 -11.208 1.00 0.00 C ATOM 365 C LEU D 8 65.197 -12.963 -12.148 1.00 0.00 C ATOM 366 O LEU D 8 64.194 -13.614 -12.366 1.00 0.00 O ATOM 367 CB LEU D 8 66.352 -12.585 -9.966 1.00 0.00 C ATOM 368 CG LEU D 8 64.980 -12.537 -9.264 1.00 0.00 C ATOM 369 CD1 LEU D 8 64.589 -13.938 -8.764 1.00 0.00 C ATOM 370 CD2 LEU D 8 65.054 -11.567 -8.081 1.00 0.00 C ATOM 0 H LEU D 8 68.296 -12.827 -11.540 1.00 0.00 H new ATOM 0 HA LEU D 8 66.034 -14.507 -10.920 1.00 0.00 H new ATOM 0 HB2 LEU D 8 67.108 -12.961 -9.276 1.00 0.00 H new ATOM 0 HB3 LEU D 8 66.656 -11.579 -10.254 1.00 0.00 H new ATOM 0 HG LEU D 8 64.225 -12.196 -9.973 1.00 0.00 H new ATOM 0 HD11 LEU D 8 63.618 -13.890 -8.270 1.00 0.00 H new ATOM 0 HD12 LEU D 8 64.533 -14.624 -9.610 1.00 0.00 H new ATOM 0 HD13 LEU D 8 65.338 -14.294 -8.057 1.00 0.00 H new ATOM 0 HD21 LEU D 8 64.086 -11.529 -7.581 1.00 0.00 H new ATOM 0 HD22 LEU D 8 65.813 -11.909 -7.377 1.00 0.00 H new ATOM 0 HD23 LEU D 8 65.315 -10.572 -8.442 1.00 0.00 H new ATOM 382 N LEU D 9 65.361 -11.784 -12.677 1.00 0.00 N ATOM 383 CA LEU D 9 64.303 -11.226 -13.562 1.00 0.00 C ATOM 384 C LEU D 9 64.104 -12.135 -14.783 1.00 0.00 C ATOM 385 O LEU D 9 62.993 -12.346 -15.228 1.00 0.00 O ATOM 386 CB LEU D 9 64.687 -9.816 -14.027 1.00 0.00 C ATOM 387 CG LEU D 9 65.077 -8.928 -12.826 1.00 0.00 C ATOM 388 CD1 LEU D 9 65.114 -7.460 -13.262 1.00 0.00 C ATOM 389 CD2 LEU D 9 64.082 -9.086 -11.663 1.00 0.00 C ATOM 0 H LEU D 9 66.176 -11.186 -12.536 1.00 0.00 H new ATOM 0 HA LEU D 9 63.372 -11.173 -12.998 1.00 0.00 H new ATOM 0 HB2 LEU D 9 65.520 -9.874 -14.728 1.00 0.00 H new ATOM 0 HB3 LEU D 9 63.851 -9.365 -14.562 1.00 0.00 H new ATOM 0 HG LEU D 9 66.062 -9.243 -12.481 1.00 0.00 H new ATOM 0 HD11 LEU D 9 65.390 -6.835 -12.413 1.00 0.00 H new ATOM 0 HD12 LEU D 9 65.848 -7.335 -14.058 1.00 0.00 H new ATOM 0 HD13 LEU D 9 64.130 -7.164 -13.626 1.00 0.00 H new ATOM 0 HD21 LEU D 9 64.387 -8.447 -10.834 1.00 0.00 H new ATOM 0 HD22 LEU D 9 63.085 -8.798 -11.996 1.00 0.00 H new ATOM 0 HD23 LEU D 9 64.069 -10.125 -11.334 1.00 0.00 H new ATOM 401 N SER D 10 65.162 -12.665 -15.342 1.00 0.00 N ATOM 402 CA SER D 10 65.005 -13.538 -16.542 1.00 0.00 C ATOM 403 C SER D 10 64.129 -14.750 -16.203 1.00 0.00 C ATOM 404 O SER D 10 63.094 -14.958 -16.806 1.00 0.00 O ATOM 405 CB SER D 10 66.383 -14.028 -16.999 1.00 0.00 C ATOM 406 OG SER D 10 66.239 -14.799 -18.184 1.00 0.00 O ATOM 0 H SER D 10 66.121 -12.532 -15.021 1.00 0.00 H new ATOM 0 HA SER D 10 64.531 -12.963 -17.338 1.00 0.00 H new ATOM 0 HB2 SER D 10 67.041 -13.179 -17.182 1.00 0.00 H new ATOM 0 HB3 SER D 10 66.847 -14.628 -16.216 1.00 0.00 H new ATOM 0 HG SER D 10 67.119 -15.112 -18.479 1.00 0.00 H new ATOM 462 N SER A 2 49.985 -9.016 7.741 1.00 0.00 N ATOM 463 CA SER A 2 49.258 -8.143 6.763 1.00 0.00 C ATOM 464 C SER A 2 49.797 -6.722 6.882 1.00 0.00 C ATOM 465 O SER A 2 49.518 -5.869 6.063 1.00 0.00 O ATOM 466 CB SER A 2 47.763 -8.147 7.080 1.00 0.00 C ATOM 467 OG SER A 2 47.152 -7.028 6.452 1.00 0.00 O ATOM 0 HA SER A 2 49.409 -8.518 5.751 1.00 0.00 H new ATOM 0 HB2 SER A 2 47.306 -9.072 6.728 1.00 0.00 H new ATOM 0 HB3 SER A 2 47.607 -8.105 8.158 1.00 0.00 H new ATOM 0 HG SER A 2 47.800 -6.590 5.861 1.00 0.00 H new ATOM 473 N GLU A 3 50.577 -6.467 7.894 1.00 0.00 N ATOM 474 CA GLU A 3 51.145 -5.104 8.061 1.00 0.00 C ATOM 475 C GLU A 3 52.075 -4.812 6.887 1.00 0.00 C ATOM 476 O GLU A 3 51.983 -3.795 6.247 1.00 0.00 O ATOM 477 CB GLU A 3 51.944 -5.036 9.361 1.00 0.00 C ATOM 478 CG GLU A 3 50.996 -5.125 10.563 1.00 0.00 C ATOM 479 CD GLU A 3 50.549 -6.577 10.762 1.00 0.00 C ATOM 480 OE1 GLU A 3 51.097 -7.443 10.099 1.00 0.00 O ATOM 481 OE2 GLU A 3 49.659 -6.797 11.568 1.00 0.00 O ATOM 0 H GLU A 3 50.845 -7.142 8.610 1.00 0.00 H new ATOM 0 HA GLU A 3 50.338 -4.372 8.094 1.00 0.00 H new ATOM 0 HB2 GLU A 3 52.667 -5.851 9.396 1.00 0.00 H new ATOM 0 HB3 GLU A 3 52.510 -4.105 9.402 1.00 0.00 H new ATOM 0 HG2 GLU A 3 51.497 -4.762 11.461 1.00 0.00 H new ATOM 0 HG3 GLU A 3 50.128 -4.486 10.402 1.00 0.00 H new ATOM 488 N LEU A 4 52.981 -5.704 6.618 1.00 0.00 N ATOM 489 CA LEU A 4 53.942 -5.491 5.495 1.00 0.00 C ATOM 490 C LEU A 4 53.174 -5.351 4.174 1.00 0.00 C ATOM 491 O LEU A 4 53.491 -4.520 3.346 1.00 0.00 O ATOM 492 CB LEU A 4 54.900 -6.680 5.447 1.00 0.00 C ATOM 493 CG LEU A 4 55.940 -6.552 4.310 1.00 0.00 C ATOM 494 CD1 LEU A 4 56.529 -5.142 4.267 1.00 0.00 C ATOM 495 CD2 LEU A 4 57.085 -7.545 4.566 1.00 0.00 C ATOM 0 H LEU A 4 53.102 -6.579 7.128 1.00 0.00 H new ATOM 0 HA LEU A 4 54.513 -4.575 5.650 1.00 0.00 H new ATOM 0 HB2 LEU A 4 55.418 -6.765 6.402 1.00 0.00 H new ATOM 0 HB3 LEU A 4 54.329 -7.598 5.312 1.00 0.00 H new ATOM 0 HG LEU A 4 55.444 -6.762 3.362 1.00 0.00 H new ATOM 0 HD11 LEU A 4 57.258 -5.077 3.459 1.00 0.00 H new ATOM 0 HD12 LEU A 4 55.731 -4.419 4.095 1.00 0.00 H new ATOM 0 HD13 LEU A 4 57.019 -4.923 5.216 1.00 0.00 H new ATOM 0 HD21 LEU A 4 57.824 -7.462 3.769 1.00 0.00 H new ATOM 0 HD22 LEU A 4 57.556 -7.318 5.522 1.00 0.00 H new ATOM 0 HD23 LEU A 4 56.688 -8.560 4.589 1.00 0.00 H new ATOM 507 N GLU A 5 52.148 -6.139 3.987 1.00 0.00 N ATOM 508 CA GLU A 5 51.335 -6.035 2.739 1.00 0.00 C ATOM 509 C GLU A 5 50.850 -4.596 2.585 1.00 0.00 C ATOM 510 O GLU A 5 50.950 -3.988 1.530 1.00 0.00 O ATOM 511 CB GLU A 5 50.103 -6.936 2.892 1.00 0.00 C ATOM 512 CG GLU A 5 49.243 -6.852 1.624 1.00 0.00 C ATOM 513 CD GLU A 5 48.046 -7.793 1.751 1.00 0.00 C ATOM 514 OE1 GLU A 5 48.075 -8.642 2.627 1.00 0.00 O ATOM 515 OE2 GLU A 5 47.123 -7.658 0.963 1.00 0.00 O ATOM 0 H GLU A 5 51.837 -6.852 4.647 1.00 0.00 H new ATOM 0 HA GLU A 5 51.931 -6.331 1.876 1.00 0.00 H new ATOM 0 HB2 GLU A 5 50.413 -7.966 3.066 1.00 0.00 H new ATOM 0 HB3 GLU A 5 49.520 -6.628 3.760 1.00 0.00 H new ATOM 0 HG2 GLU A 5 48.899 -5.829 1.473 1.00 0.00 H new ATOM 0 HG3 GLU A 5 49.838 -7.120 0.751 1.00 0.00 H new ATOM 522 N THR A 6 50.321 -4.055 3.642 1.00 0.00 N ATOM 523 CA THR A 6 49.809 -2.664 3.607 1.00 0.00 C ATOM 524 C THR A 6 50.955 -1.688 3.398 1.00 0.00 C ATOM 525 O THR A 6 50.776 -0.629 2.860 1.00 0.00 O ATOM 526 CB THR A 6 49.125 -2.344 4.933 1.00 0.00 C ATOM 527 OG1 THR A 6 49.974 -2.704 6.008 1.00 0.00 O ATOM 528 CG2 THR A 6 47.814 -3.116 5.031 1.00 0.00 C ATOM 0 H THR A 6 50.221 -4.526 4.541 1.00 0.00 H new ATOM 0 HA THR A 6 49.100 -2.570 2.785 1.00 0.00 H new ATOM 0 HB THR A 6 48.918 -1.275 4.983 1.00 0.00 H new ATOM 0 HG1 THR A 6 50.833 -3.017 5.656 1.00 0.00 H new ATOM 0 HG21 THR A 6 47.327 -2.887 5.979 1.00 0.00 H new ATOM 0 HG22 THR A 6 47.160 -2.829 4.208 1.00 0.00 H new ATOM 0 HG23 THR A 6 48.017 -4.186 4.977 1.00 0.00 H new ATOM 536 N ALA A 7 52.118 -2.023 3.862 1.00 0.00 N ATOM 537 CA ALA A 7 53.277 -1.095 3.726 1.00 0.00 C ATOM 538 C ALA A 7 53.552 -0.809 2.244 1.00 0.00 C ATOM 539 O ALA A 7 53.737 0.315 1.849 1.00 0.00 O ATOM 540 CB ALA A 7 54.508 -1.736 4.367 1.00 0.00 C ATOM 0 H ALA A 7 52.323 -2.904 4.334 1.00 0.00 H new ATOM 0 HA ALA A 7 53.049 -0.154 4.227 1.00 0.00 H new ATOM 0 HB1 ALA A 7 55.360 -1.063 4.271 1.00 0.00 H new ATOM 0 HB2 ALA A 7 54.312 -1.925 5.422 1.00 0.00 H new ATOM 0 HB3 ALA A 7 54.731 -2.677 3.865 1.00 0.00 H new ATOM 546 N MET A 8 53.582 -1.818 1.419 1.00 0.00 N ATOM 547 CA MET A 8 53.848 -1.588 -0.026 1.00 0.00 C ATOM 548 C MET A 8 52.766 -0.673 -0.614 1.00 0.00 C ATOM 549 O MET A 8 53.061 0.237 -1.350 1.00 0.00 O ATOM 550 CB MET A 8 53.841 -2.939 -0.749 1.00 0.00 C ATOM 551 CG MET A 8 54.153 -2.739 -2.235 1.00 0.00 C ATOM 552 SD MET A 8 54.159 -4.344 -3.074 1.00 0.00 S ATOM 553 CE MET A 8 54.150 -3.720 -4.774 1.00 0.00 C ATOM 0 H MET A 8 53.434 -2.792 1.684 1.00 0.00 H new ATOM 0 HA MET A 8 54.818 -1.108 -0.153 1.00 0.00 H new ATOM 0 HB2 MET A 8 54.578 -3.605 -0.300 1.00 0.00 H new ATOM 0 HB3 MET A 8 52.868 -3.417 -0.634 1.00 0.00 H new ATOM 0 HG2 MET A 8 53.410 -2.083 -2.688 1.00 0.00 H new ATOM 0 HG3 MET A 8 55.121 -2.252 -2.352 1.00 0.00 H new ATOM 0 HE1 MET A 8 54.152 -4.559 -5.470 1.00 0.00 H new ATOM 0 HE2 MET A 8 53.256 -3.117 -4.936 1.00 0.00 H new ATOM 0 HE3 MET A 8 55.036 -3.108 -4.941 1.00 0.00 H new ATOM 563 N GLU A 9 51.524 -0.907 -0.282 1.00 0.00 N ATOM 564 CA GLU A 9 50.407 -0.058 -0.812 1.00 0.00 C ATOM 565 C GLU A 9 50.545 1.382 -0.322 1.00 0.00 C ATOM 566 O GLU A 9 50.288 2.323 -1.043 1.00 0.00 O ATOM 567 CB GLU A 9 49.075 -0.622 -0.290 1.00 0.00 C ATOM 568 CG GLU A 9 47.894 0.137 -0.914 1.00 0.00 C ATOM 569 CD GLU A 9 47.822 -0.164 -2.411 1.00 0.00 C ATOM 570 OE1 GLU A 9 48.320 -1.203 -2.810 1.00 0.00 O ATOM 571 OE2 GLU A 9 47.271 0.650 -3.133 1.00 0.00 O ATOM 0 H GLU A 9 51.229 -1.659 0.341 1.00 0.00 H new ATOM 0 HA GLU A 9 50.440 -0.069 -1.901 1.00 0.00 H new ATOM 0 HB2 GLU A 9 49.002 -1.683 -0.530 1.00 0.00 H new ATOM 0 HB3 GLU A 9 49.037 -0.538 0.796 1.00 0.00 H new ATOM 0 HG2 GLU A 9 46.963 -0.157 -0.429 1.00 0.00 H new ATOM 0 HG3 GLU A 9 48.012 1.209 -0.754 1.00 0.00 H new ATOM 578 N THR A 10 50.920 1.551 0.905 1.00 0.00 N ATOM 579 CA THR A 10 51.050 2.914 1.473 1.00 0.00 C ATOM 580 C THR A 10 52.102 3.701 0.700 1.00 0.00 C ATOM 581 O THR A 10 51.911 4.851 0.367 1.00 0.00 O ATOM 582 CB THR A 10 51.458 2.802 2.941 1.00 0.00 C ATOM 583 OG1 THR A 10 52.510 1.857 3.073 1.00 0.00 O ATOM 584 CG2 THR A 10 50.262 2.355 3.780 1.00 0.00 C ATOM 0 H THR A 10 51.146 0.793 1.550 1.00 0.00 H new ATOM 0 HA THR A 10 50.097 3.437 1.396 1.00 0.00 H new ATOM 0 HB THR A 10 51.798 3.776 3.292 1.00 0.00 H new ATOM 0 HG1 THR A 10 52.663 1.415 2.212 1.00 0.00 H new ATOM 0 HG21 THR A 10 50.560 2.277 4.826 1.00 0.00 H new ATOM 0 HG22 THR A 10 49.458 3.085 3.685 1.00 0.00 H new ATOM 0 HG23 THR A 10 49.914 1.384 3.429 1.00 0.00 H new ATOM 592 N LEU A 11 53.210 3.091 0.415 1.00 0.00 N ATOM 593 CA LEU A 11 54.283 3.802 -0.334 1.00 0.00 C ATOM 594 C LEU A 11 53.757 4.296 -1.695 1.00 0.00 C ATOM 595 O LEU A 11 54.166 5.329 -2.175 1.00 0.00 O ATOM 596 CB LEU A 11 55.466 2.847 -0.574 1.00 0.00 C ATOM 597 CG LEU A 11 56.057 2.351 0.764 1.00 0.00 C ATOM 598 CD1 LEU A 11 57.007 1.171 0.488 1.00 0.00 C ATOM 599 CD2 LEU A 11 56.828 3.488 1.498 1.00 0.00 C ATOM 0 H LEU A 11 53.424 2.126 0.668 1.00 0.00 H new ATOM 0 HA LEU A 11 54.606 4.659 0.257 1.00 0.00 H new ATOM 0 HB2 LEU A 11 55.135 1.995 -1.168 1.00 0.00 H new ATOM 0 HB3 LEU A 11 56.238 3.357 -1.150 1.00 0.00 H new ATOM 0 HG LEU A 11 55.238 2.031 1.409 1.00 0.00 H new ATOM 0 HD11 LEU A 11 57.428 0.815 1.428 1.00 0.00 H new ATOM 0 HD12 LEU A 11 56.454 0.363 0.010 1.00 0.00 H new ATOM 0 HD13 LEU A 11 57.812 1.498 -0.170 1.00 0.00 H new ATOM 0 HD21 LEU A 11 57.232 3.107 2.436 1.00 0.00 H new ATOM 0 HD22 LEU A 11 57.645 3.840 0.868 1.00 0.00 H new ATOM 0 HD23 LEU A 11 56.148 4.314 1.705 1.00 0.00 H new ATOM 611 N ILE A 12 52.889 3.565 -2.343 1.00 0.00 N ATOM 612 CA ILE A 12 52.386 4.016 -3.687 1.00 0.00 C ATOM 613 C ILE A 12 51.285 5.085 -3.544 1.00 0.00 C ATOM 614 O ILE A 12 51.124 5.913 -4.416 1.00 0.00 O ATOM 615 CB ILE A 12 51.825 2.828 -4.494 1.00 0.00 C ATOM 616 CG1 ILE A 12 52.645 1.561 -4.234 1.00 0.00 C ATOM 617 CG2 ILE A 12 51.870 3.148 -5.989 1.00 0.00 C ATOM 618 CD1 ILE A 12 54.142 1.846 -4.366 1.00 0.00 C ATOM 0 H ILE A 12 52.505 2.681 -2.009 1.00 0.00 H new ATOM 0 HA ILE A 12 53.236 4.447 -4.216 1.00 0.00 H new ATOM 0 HB ILE A 12 50.795 2.659 -4.179 1.00 0.00 H new ATOM 0 HG12 ILE A 12 52.429 1.181 -3.235 1.00 0.00 H new ATOM 0 HG13 ILE A 12 52.355 0.783 -4.940 1.00 0.00 H new ATOM 0 HG21 ILE A 12 51.472 2.305 -6.554 1.00 0.00 H new ATOM 0 HG22 ILE A 12 51.269 4.035 -6.190 1.00 0.00 H new ATOM 0 HG23 ILE A 12 52.901 3.333 -6.291 1.00 0.00 H new ATOM 0 HD11 ILE A 12 54.704 0.932 -4.177 1.00 0.00 H new ATOM 0 HD12 ILE A 12 54.357 2.203 -5.373 1.00 0.00 H new ATOM 0 HD13 ILE A 12 54.433 2.607 -3.642 1.00 0.00 H new ATOM 630 N ASN A 13 50.516 5.087 -2.494 1.00 0.00 N ATOM 631 CA ASN A 13 49.443 6.119 -2.395 1.00 0.00 C ATOM 632 C ASN A 13 50.073 7.508 -2.310 1.00 0.00 C ATOM 633 O ASN A 13 49.602 8.461 -2.896 1.00 0.00 O ATOM 634 CB ASN A 13 48.596 5.870 -1.149 1.00 0.00 C ATOM 635 CG ASN A 13 47.482 6.918 -1.081 1.00 0.00 C ATOM 636 OD1 ASN A 13 47.228 7.513 0.052 1.00 0.00 O flip ATOM 637 ND2 ASN A 13 46.840 7.202 -2.074 1.00 0.00 N flip ATOM 0 H ASN A 13 50.578 4.434 -1.713 1.00 0.00 H new ATOM 0 HA ASN A 13 48.809 6.059 -3.280 1.00 0.00 H new ATOM 0 HB2 ASN A 13 48.168 4.868 -1.180 1.00 0.00 H new ATOM 0 HB3 ASN A 13 49.218 5.924 -0.255 1.00 0.00 H new ATOM 0 HD21 ASN A 13 47.038 6.737 -2.960 1.00 0.00 H new ATOM 0 HD22 ASN A 13 46.103 7.905 -2.021 1.00 0.00 H new ATOM 644 N VAL A 14 51.134 7.621 -1.571 1.00 0.00 N ATOM 645 CA VAL A 14 51.811 8.940 -1.419 1.00 0.00 C ATOM 646 C VAL A 14 52.724 9.231 -2.617 1.00 0.00 C ATOM 647 O VAL A 14 52.834 10.356 -3.056 1.00 0.00 O ATOM 648 CB VAL A 14 52.632 8.938 -0.120 1.00 0.00 C ATOM 649 CG1 VAL A 14 51.703 9.224 1.071 1.00 0.00 C ATOM 650 CG2 VAL A 14 53.328 7.567 0.061 1.00 0.00 C ATOM 0 H VAL A 14 51.568 6.852 -1.060 1.00 0.00 H new ATOM 0 HA VAL A 14 51.053 9.722 -1.377 1.00 0.00 H new ATOM 0 HB VAL A 14 53.397 9.713 -0.171 1.00 0.00 H new ATOM 0 HG11 VAL A 14 52.283 9.223 1.994 1.00 0.00 H new ATOM 0 HG12 VAL A 14 51.232 10.198 0.939 1.00 0.00 H new ATOM 0 HG13 VAL A 14 50.934 8.454 1.126 1.00 0.00 H new ATOM 0 HG21 VAL A 14 53.908 7.573 0.984 1.00 0.00 H new ATOM 0 HG22 VAL A 14 52.575 6.780 0.111 1.00 0.00 H new ATOM 0 HG23 VAL A 14 53.991 7.381 -0.784 1.00 0.00 H new ATOM 660 N PHE A 15 53.398 8.242 -3.134 1.00 0.00 N ATOM 661 CA PHE A 15 54.319 8.496 -4.284 1.00 0.00 C ATOM 662 C PHE A 15 53.552 9.068 -5.483 1.00 0.00 C ATOM 663 O PHE A 15 53.943 10.056 -6.068 1.00 0.00 O ATOM 664 CB PHE A 15 54.964 7.175 -4.712 1.00 0.00 C ATOM 665 CG PHE A 15 55.789 7.410 -5.960 1.00 0.00 C ATOM 666 CD1 PHE A 15 57.057 7.994 -5.865 1.00 0.00 C ATOM 667 CD2 PHE A 15 55.274 7.061 -7.215 1.00 0.00 C ATOM 668 CE1 PHE A 15 57.809 8.230 -7.021 1.00 0.00 C ATOM 669 CE2 PHE A 15 56.028 7.293 -8.372 1.00 0.00 C ATOM 670 CZ PHE A 15 57.295 7.878 -8.275 1.00 0.00 C ATOM 0 H PHE A 15 53.354 7.274 -2.815 1.00 0.00 H new ATOM 0 HA PHE A 15 55.075 9.214 -3.966 1.00 0.00 H new ATOM 0 HB2 PHE A 15 55.594 6.787 -3.912 1.00 0.00 H new ATOM 0 HB3 PHE A 15 54.196 6.426 -4.904 1.00 0.00 H new ATOM 0 HD1 PHE A 15 57.456 8.263 -4.898 1.00 0.00 H new ATOM 0 HD2 PHE A 15 54.294 6.613 -7.290 1.00 0.00 H new ATOM 0 HE1 PHE A 15 58.786 8.684 -6.946 1.00 0.00 H new ATOM 0 HE2 PHE A 15 55.631 7.020 -9.339 1.00 0.00 H new ATOM 0 HZ PHE A 15 57.877 8.058 -9.167 1.00 0.00 H new ATOM 680 N HIS A 16 52.480 8.437 -5.857 1.00 0.00 N ATOM 681 CA HIS A 16 51.691 8.909 -7.028 1.00 0.00 C ATOM 682 C HIS A 16 50.937 10.194 -6.690 1.00 0.00 C ATOM 683 O HIS A 16 50.548 10.938 -7.570 1.00 0.00 O ATOM 684 CB HIS A 16 50.678 7.824 -7.434 1.00 0.00 C ATOM 685 CG HIS A 16 51.364 6.733 -8.217 1.00 0.00 C ATOM 686 ND1 HIS A 16 52.540 6.952 -8.922 1.00 0.00 N ATOM 687 CD2 HIS A 16 51.040 5.412 -8.430 1.00 0.00 C ATOM 688 CE1 HIS A 16 52.876 5.791 -9.520 1.00 0.00 C ATOM 689 NE2 HIS A 16 51.995 4.827 -9.250 1.00 0.00 N ATOM 0 H HIS A 16 52.110 7.605 -5.398 1.00 0.00 H new ATOM 0 HA HIS A 16 52.378 9.109 -7.850 1.00 0.00 H new ATOM 0 HB2 HIS A 16 50.210 7.403 -6.544 1.00 0.00 H new ATOM 0 HB3 HIS A 16 49.882 8.266 -8.034 1.00 0.00 H new ATOM 0 HD2 HIS A 16 50.176 4.909 -8.022 1.00 0.00 H new ATOM 0 HE1 HIS A 16 53.750 5.658 -10.140 1.00 0.00 H new ATOM 0 HE2 HIS A 16 52.018 3.861 -9.578 1.00 0.00 H new ATOM 698 N ALA A 17 50.689 10.457 -5.439 1.00 0.00 N ATOM 699 CA ALA A 17 49.919 11.683 -5.100 1.00 0.00 C ATOM 700 C ALA A 17 50.813 12.924 -5.147 1.00 0.00 C ATOM 701 O ALA A 17 50.585 13.822 -5.931 1.00 0.00 O ATOM 702 CB ALA A 17 49.341 11.530 -3.694 1.00 0.00 C ATOM 0 H ALA A 17 50.981 9.885 -4.647 1.00 0.00 H new ATOM 0 HA ALA A 17 49.120 11.809 -5.830 1.00 0.00 H new ATOM 0 HB1 ALA A 17 48.774 12.424 -3.434 1.00 0.00 H new ATOM 0 HB2 ALA A 17 48.683 10.661 -3.664 1.00 0.00 H new ATOM 0 HB3 ALA A 17 50.153 11.395 -2.979 1.00 0.00 H new ATOM 708 N HIS A 18 51.790 13.022 -4.294 1.00 0.00 N ATOM 709 CA HIS A 18 52.626 14.254 -4.289 1.00 0.00 C ATOM 710 C HIS A 18 53.423 14.397 -5.595 1.00 0.00 C ATOM 711 O HIS A 18 53.584 15.482 -6.116 1.00 0.00 O ATOM 712 CB HIS A 18 53.586 14.206 -3.098 1.00 0.00 C ATOM 713 CG HIS A 18 52.817 14.417 -1.819 1.00 0.00 C ATOM 714 ND1 HIS A 18 52.261 13.366 -1.103 1.00 0.00 N ATOM 715 CD2 HIS A 18 52.506 15.556 -1.118 1.00 0.00 C ATOM 716 CE1 HIS A 18 51.650 13.891 -0.023 1.00 0.00 C ATOM 717 NE2 HIS A 18 51.771 15.220 0.013 1.00 0.00 N ATOM 0 H HIS A 18 52.045 12.313 -3.607 1.00 0.00 H new ATOM 0 HA HIS A 18 51.967 15.118 -4.204 1.00 0.00 H new ATOM 0 HB2 HIS A 18 54.100 13.245 -3.071 1.00 0.00 H new ATOM 0 HB3 HIS A 18 54.352 14.974 -3.204 1.00 0.00 H new ATOM 0 HD2 HIS A 18 52.789 16.559 -1.402 1.00 0.00 H new ATOM 0 HE1 HIS A 18 51.127 13.309 0.721 1.00 0.00 H new ATOM 0 HE2 HIS A 18 51.402 15.855 0.721 1.00 0.00 H new ATOM 726 N SER A 19 53.948 13.311 -6.108 1.00 0.00 N ATOM 727 CA SER A 19 54.767 13.365 -7.357 1.00 0.00 C ATOM 728 C SER A 19 53.906 13.717 -8.564 1.00 0.00 C ATOM 729 O SER A 19 54.409 14.037 -9.622 1.00 0.00 O ATOM 730 CB SER A 19 55.380 11.984 -7.596 1.00 0.00 C ATOM 731 OG SER A 19 55.925 11.498 -6.378 1.00 0.00 O ATOM 0 H SER A 19 53.842 12.378 -5.709 1.00 0.00 H new ATOM 0 HA SER A 19 55.535 14.129 -7.236 1.00 0.00 H new ATOM 0 HB2 SER A 19 54.621 11.296 -7.969 1.00 0.00 H new ATOM 0 HB3 SER A 19 56.157 12.045 -8.358 1.00 0.00 H new ATOM 0 HG SER A 19 55.393 10.738 -6.062 1.00 0.00 H new ATOM 737 N GLY A 20 52.617 13.633 -8.424 1.00 0.00 N ATOM 738 CA GLY A 20 51.705 13.929 -9.569 1.00 0.00 C ATOM 739 C GLY A 20 51.089 15.317 -9.416 1.00 0.00 C ATOM 740 O GLY A 20 50.151 15.659 -10.107 1.00 0.00 O ATOM 0 H GLY A 20 52.147 13.370 -7.558 1.00 0.00 H new ATOM 0 HA2 GLY A 20 52.258 13.871 -10.507 1.00 0.00 H new ATOM 0 HA3 GLY A 20 50.917 13.178 -9.617 1.00 0.00 H new ATOM 744 N LYS A 21 51.607 16.142 -8.542 1.00 0.00 N ATOM 745 CA LYS A 21 51.027 17.509 -8.409 1.00 0.00 C ATOM 746 C LYS A 21 51.673 18.389 -9.470 1.00 0.00 C ATOM 747 O LYS A 21 51.025 18.841 -10.394 1.00 0.00 O ATOM 748 CB LYS A 21 51.308 18.079 -7.015 1.00 0.00 C ATOM 749 CG LYS A 21 50.722 17.165 -5.928 1.00 0.00 C ATOM 750 CD LYS A 21 49.194 17.292 -5.886 1.00 0.00 C ATOM 751 CE LYS A 21 48.650 16.539 -4.669 1.00 0.00 C ATOM 752 NZ LYS A 21 47.231 16.933 -4.432 1.00 0.00 N ATOM 0 H LYS A 21 52.392 15.932 -7.926 1.00 0.00 H new ATOM 0 HA LYS A 21 49.946 17.473 -8.543 1.00 0.00 H new ATOM 0 HB2 LYS A 21 52.383 18.183 -6.869 1.00 0.00 H new ATOM 0 HB3 LYS A 21 50.876 19.076 -6.930 1.00 0.00 H new ATOM 0 HG2 LYS A 21 51.002 16.130 -6.125 1.00 0.00 H new ATOM 0 HG3 LYS A 21 51.142 17.429 -4.957 1.00 0.00 H new ATOM 0 HD2 LYS A 21 48.907 18.342 -5.834 1.00 0.00 H new ATOM 0 HD3 LYS A 21 48.760 16.888 -6.800 1.00 0.00 H new ATOM 0 HE2 LYS A 21 48.717 15.464 -4.834 1.00 0.00 H new ATOM 0 HE3 LYS A 21 49.253 16.765 -3.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 46.862 16.421 -3.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 47.180 17.957 -4.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 46.661 16.696 -5.269 1.00 0.00 H new ATOM 822 N TYR A 26 55.143 10.437 -14.117 1.00 0.00 N ATOM 823 CA TYR A 26 55.957 9.316 -13.548 1.00 0.00 C ATOM 824 C TYR A 26 57.442 9.649 -13.327 1.00 0.00 C ATOM 825 O TYR A 26 58.265 8.755 -13.347 1.00 0.00 O ATOM 826 CB TYR A 26 55.857 8.086 -14.463 1.00 0.00 C ATOM 827 CG TYR A 26 54.466 8.003 -15.052 1.00 0.00 C ATOM 828 CD1 TYR A 26 53.356 7.882 -14.207 1.00 0.00 C ATOM 829 CD2 TYR A 26 54.285 8.042 -16.442 1.00 0.00 C ATOM 830 CE1 TYR A 26 52.069 7.800 -14.748 1.00 0.00 C ATOM 831 CE2 TYR A 26 52.997 7.962 -16.983 1.00 0.00 C ATOM 832 CZ TYR A 26 51.889 7.840 -16.137 1.00 0.00 C ATOM 833 OH TYR A 26 50.619 7.758 -16.673 1.00 0.00 O ATOM 0 HA TYR A 26 55.534 9.121 -12.562 1.00 0.00 H new ATOM 0 HB2 TYR A 26 56.597 8.152 -15.260 1.00 0.00 H new ATOM 0 HB3 TYR A 26 56.078 7.181 -13.898 1.00 0.00 H new ATOM 0 HD1 TYR A 26 53.494 7.852 -13.136 1.00 0.00 H new ATOM 0 HD2 TYR A 26 55.140 8.134 -17.095 1.00 0.00 H new ATOM 0 HE1 TYR A 26 51.214 7.706 -14.095 1.00 0.00 H new ATOM 0 HE2 TYR A 26 52.858 7.994 -18.054 1.00 0.00 H new ATOM 0 HH TYR A 26 50.673 7.802 -17.651 1.00 0.00 H new ATOM 843 N LYS A 27 57.808 10.878 -13.055 1.00 0.00 N ATOM 844 CA LYS A 27 59.256 11.179 -12.764 1.00 0.00 C ATOM 845 C LYS A 27 59.288 12.057 -11.517 1.00 0.00 C ATOM 846 O LYS A 27 58.472 12.944 -11.364 1.00 0.00 O ATOM 847 CB LYS A 27 59.917 11.923 -13.929 1.00 0.00 C ATOM 848 CG LYS A 27 61.444 11.950 -13.718 1.00 0.00 C ATOM 849 CD LYS A 27 62.063 10.552 -14.024 1.00 0.00 C ATOM 850 CE LYS A 27 63.068 10.650 -15.181 1.00 0.00 C ATOM 851 NZ LYS A 27 64.217 11.502 -14.770 1.00 0.00 N ATOM 0 H LYS A 27 57.180 11.681 -13.021 1.00 0.00 H new ATOM 0 HA LYS A 27 59.805 10.249 -12.617 1.00 0.00 H new ATOM 0 HB2 LYS A 27 59.678 11.431 -14.872 1.00 0.00 H new ATOM 0 HB3 LYS A 27 59.529 12.940 -13.992 1.00 0.00 H new ATOM 0 HG2 LYS A 27 61.893 12.703 -14.366 1.00 0.00 H new ATOM 0 HG3 LYS A 27 61.670 12.237 -12.691 1.00 0.00 H new ATOM 0 HD2 LYS A 27 62.560 10.165 -13.134 1.00 0.00 H new ATOM 0 HD3 LYS A 27 61.273 9.846 -14.280 1.00 0.00 H new ATOM 0 HE2 LYS A 27 63.419 9.656 -15.457 1.00 0.00 H new ATOM 0 HE3 LYS A 27 62.585 11.073 -16.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 65.072 11.201 -15.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 64.011 12.496 -14.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 64.372 11.406 -13.746 1.00 0.00 H new ATOM 865 N LEU A 28 60.209 11.822 -10.611 1.00 0.00 N ATOM 866 CA LEU A 28 60.263 12.644 -9.379 1.00 0.00 C ATOM 867 C LEU A 28 61.270 13.769 -9.615 1.00 0.00 C ATOM 868 O LEU A 28 62.109 13.679 -10.486 1.00 0.00 O ATOM 869 CB LEU A 28 60.695 11.731 -8.213 1.00 0.00 C ATOM 870 CG LEU A 28 60.061 12.175 -6.890 1.00 0.00 C ATOM 871 CD1 LEU A 28 58.530 11.955 -6.901 1.00 0.00 C ATOM 872 CD2 LEU A 28 60.697 11.374 -5.747 1.00 0.00 C ATOM 0 H LEU A 28 60.921 11.095 -10.680 1.00 0.00 H new ATOM 0 HA LEU A 28 59.296 13.083 -9.133 1.00 0.00 H new ATOM 0 HB2 LEU A 28 60.407 10.702 -8.429 1.00 0.00 H new ATOM 0 HB3 LEU A 28 61.781 11.746 -8.121 1.00 0.00 H new ATOM 0 HG LEU A 28 60.241 13.241 -6.750 1.00 0.00 H new ATOM 0 HD11 LEU A 28 58.109 12.279 -5.949 1.00 0.00 H new ATOM 0 HD12 LEU A 28 58.085 12.534 -7.711 1.00 0.00 H new ATOM 0 HD13 LEU A 28 58.316 10.897 -7.051 1.00 0.00 H new ATOM 0 HD21 LEU A 28 60.255 11.680 -4.799 1.00 0.00 H new ATOM 0 HD22 LEU A 28 60.518 10.310 -5.905 1.00 0.00 H new ATOM 0 HD23 LEU A 28 61.770 11.562 -5.724 1.00 0.00 H new ATOM 884 N SER A 29 61.161 14.843 -8.883 1.00 0.00 N ATOM 885 CA SER A 29 62.089 15.998 -9.082 1.00 0.00 C ATOM 886 C SER A 29 62.551 16.533 -7.726 1.00 0.00 C ATOM 887 O SER A 29 61.991 16.214 -6.696 1.00 0.00 O ATOM 888 CB SER A 29 61.357 17.101 -9.846 1.00 0.00 C ATOM 889 OG SER A 29 62.224 18.213 -10.016 1.00 0.00 O ATOM 0 H SER A 29 60.464 14.973 -8.149 1.00 0.00 H new ATOM 0 HA SER A 29 62.960 15.672 -9.650 1.00 0.00 H new ATOM 0 HB2 SER A 29 61.029 16.730 -10.817 1.00 0.00 H new ATOM 0 HB3 SER A 29 60.462 17.403 -9.302 1.00 0.00 H new ATOM 0 HG SER A 29 61.899 18.771 -10.753 1.00 0.00 H new ATOM 895 N LYS A 30 63.573 17.345 -7.719 1.00 0.00 N ATOM 896 CA LYS A 30 64.083 17.904 -6.428 1.00 0.00 C ATOM 897 C LYS A 30 62.939 18.459 -5.557 1.00 0.00 C ATOM 898 O LYS A 30 62.876 18.196 -4.374 1.00 0.00 O ATOM 899 CB LYS A 30 65.075 19.029 -6.758 1.00 0.00 C ATOM 900 CG LYS A 30 65.444 19.816 -5.495 1.00 0.00 C ATOM 901 CD LYS A 30 66.612 20.753 -5.806 1.00 0.00 C ATOM 902 CE LYS A 30 66.826 21.706 -4.632 1.00 0.00 C ATOM 903 NZ LYS A 30 65.786 22.772 -4.657 1.00 0.00 N ATOM 0 H LYS A 30 64.079 17.648 -8.551 1.00 0.00 H new ATOM 0 HA LYS A 30 64.567 17.109 -5.861 1.00 0.00 H new ATOM 0 HB2 LYS A 30 65.975 18.607 -7.205 1.00 0.00 H new ATOM 0 HB3 LYS A 30 64.637 19.701 -7.496 1.00 0.00 H new ATOM 0 HG2 LYS A 30 64.585 20.390 -5.147 1.00 0.00 H new ATOM 0 HG3 LYS A 30 65.716 19.131 -4.692 1.00 0.00 H new ATOM 0 HD2 LYS A 30 67.518 20.175 -5.989 1.00 0.00 H new ATOM 0 HD3 LYS A 30 66.406 21.319 -6.715 1.00 0.00 H new ATOM 0 HE2 LYS A 30 66.776 21.157 -3.692 1.00 0.00 H new ATOM 0 HE3 LYS A 30 67.819 22.152 -4.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 66.063 23.543 -4.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 65.692 23.143 -5.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 64.875 22.376 -4.349 1.00 0.00 H new ATOM 917 N LYS A 31 62.060 19.244 -6.104 1.00 0.00 N ATOM 918 CA LYS A 31 60.955 19.824 -5.272 1.00 0.00 C ATOM 919 C LYS A 31 59.928 18.752 -4.866 1.00 0.00 C ATOM 920 O LYS A 31 59.257 18.873 -3.858 1.00 0.00 O ATOM 921 CB LYS A 31 60.258 20.935 -6.062 1.00 0.00 C ATOM 922 CG LYS A 31 59.825 20.401 -7.429 1.00 0.00 C ATOM 923 CD LYS A 31 59.174 21.527 -8.232 1.00 0.00 C ATOM 924 CE LYS A 31 58.714 20.984 -9.587 1.00 0.00 C ATOM 925 NZ LYS A 31 59.897 20.555 -10.385 1.00 0.00 N ATOM 0 H LYS A 31 62.051 19.514 -7.088 1.00 0.00 H new ATOM 0 HA LYS A 31 61.392 20.229 -4.359 1.00 0.00 H new ATOM 0 HB2 LYS A 31 59.390 21.297 -5.511 1.00 0.00 H new ATOM 0 HB3 LYS A 31 60.932 21.782 -6.188 1.00 0.00 H new ATOM 0 HG2 LYS A 31 60.687 20.007 -7.967 1.00 0.00 H new ATOM 0 HG3 LYS A 31 59.123 19.576 -7.304 1.00 0.00 H new ATOM 0 HD2 LYS A 31 58.325 21.935 -7.684 1.00 0.00 H new ATOM 0 HD3 LYS A 31 59.883 22.343 -8.376 1.00 0.00 H new ATOM 0 HE2 LYS A 31 58.037 20.142 -9.441 1.00 0.00 H new ATOM 0 HE3 LYS A 31 58.158 21.750 -10.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 59.835 20.958 -11.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 60.767 20.890 -9.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 59.916 19.517 -10.447 1.00 0.00 H new ATOM 939 N GLU A 32 59.802 17.708 -5.632 1.00 0.00 N ATOM 940 CA GLU A 32 58.813 16.640 -5.279 1.00 0.00 C ATOM 941 C GLU A 32 59.323 15.789 -4.103 1.00 0.00 C ATOM 942 O GLU A 32 58.569 15.383 -3.240 1.00 0.00 O ATOM 943 CB GLU A 32 58.577 15.733 -6.481 1.00 0.00 C ATOM 944 CG GLU A 32 57.774 16.470 -7.557 1.00 0.00 C ATOM 945 CD GLU A 32 57.812 15.658 -8.852 1.00 0.00 C ATOM 946 OE1 GLU A 32 57.180 14.614 -8.895 1.00 0.00 O ATOM 947 OE2 GLU A 32 58.475 16.093 -9.779 1.00 0.00 O ATOM 0 H GLU A 32 60.336 17.543 -6.485 1.00 0.00 H new ATOM 0 HA GLU A 32 57.881 17.125 -4.989 1.00 0.00 H new ATOM 0 HB2 GLU A 32 59.533 15.406 -6.891 1.00 0.00 H new ATOM 0 HB3 GLU A 32 58.041 14.837 -6.169 1.00 0.00 H new ATOM 0 HG2 GLU A 32 56.744 16.608 -7.229 1.00 0.00 H new ATOM 0 HG3 GLU A 32 58.191 17.463 -7.723 1.00 0.00 H new ATOM 954 N LEU A 33 60.597 15.502 -4.084 1.00 0.00 N ATOM 955 CA LEU A 33 61.156 14.661 -2.985 1.00 0.00 C ATOM 956 C LEU A 33 61.295 15.471 -1.689 1.00 0.00 C ATOM 957 O LEU A 33 61.078 14.960 -0.610 1.00 0.00 O ATOM 958 CB LEU A 33 62.504 14.055 -3.410 1.00 0.00 C ATOM 959 CG LEU A 33 63.647 15.096 -3.331 1.00 0.00 C ATOM 960 CD1 LEU A 33 64.360 15.036 -1.960 1.00 0.00 C ATOM 961 CD2 LEU A 33 64.674 14.801 -4.430 1.00 0.00 C ATOM 0 H LEU A 33 61.274 15.813 -4.781 1.00 0.00 H new ATOM 0 HA LEU A 33 60.462 13.844 -2.788 1.00 0.00 H new ATOM 0 HB2 LEU A 33 62.740 13.205 -2.769 1.00 0.00 H new ATOM 0 HB3 LEU A 33 62.428 13.674 -4.429 1.00 0.00 H new ATOM 0 HG LEU A 33 63.216 16.089 -3.461 1.00 0.00 H new ATOM 0 HD11 LEU A 33 65.158 15.778 -1.932 1.00 0.00 H new ATOM 0 HD12 LEU A 33 63.642 15.246 -1.167 1.00 0.00 H new ATOM 0 HD13 LEU A 33 64.783 14.042 -1.813 1.00 0.00 H new ATOM 0 HD21 LEU A 33 65.481 15.531 -4.379 1.00 0.00 H new ATOM 0 HD22 LEU A 33 65.081 13.800 -4.288 1.00 0.00 H new ATOM 0 HD23 LEU A 33 64.191 14.862 -5.405 1.00 0.00 H new ATOM 973 N LYS A 34 61.649 16.726 -1.772 1.00 0.00 N ATOM 974 CA LYS A 34 61.792 17.544 -0.531 1.00 0.00 C ATOM 975 C LYS A 34 60.452 17.601 0.229 1.00 0.00 C ATOM 976 O LYS A 34 60.411 17.517 1.443 1.00 0.00 O ATOM 977 CB LYS A 34 62.221 18.966 -0.924 1.00 0.00 C ATOM 978 CG LYS A 34 62.478 19.801 0.332 1.00 0.00 C ATOM 979 CD LYS A 34 62.887 21.219 -0.072 1.00 0.00 C ATOM 980 CE LYS A 34 63.171 22.041 1.187 1.00 0.00 C ATOM 981 NZ LYS A 34 63.726 23.368 0.803 1.00 0.00 N ATOM 0 H LYS A 34 61.845 17.220 -2.643 1.00 0.00 H new ATOM 0 HA LYS A 34 62.541 17.091 0.118 1.00 0.00 H new ATOM 0 HB2 LYS A 34 63.123 18.927 -1.535 1.00 0.00 H new ATOM 0 HB3 LYS A 34 61.445 19.434 -1.530 1.00 0.00 H new ATOM 0 HG2 LYS A 34 61.581 19.832 0.951 1.00 0.00 H new ATOM 0 HG3 LYS A 34 63.263 19.342 0.932 1.00 0.00 H new ATOM 0 HD2 LYS A 34 63.772 21.188 -0.707 1.00 0.00 H new ATOM 0 HD3 LYS A 34 62.093 21.687 -0.654 1.00 0.00 H new ATOM 0 HE2 LYS A 34 62.255 22.172 1.762 1.00 0.00 H new ATOM 0 HE3 LYS A 34 63.877 21.512 1.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 63.918 23.925 1.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 64.610 23.234 0.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 63.038 23.873 0.209 1.00 0.00 H new ATOM 995 N ASP A 35 59.361 17.755 -0.479 1.00 0.00 N ATOM 996 CA ASP A 35 58.019 17.836 0.186 1.00 0.00 C ATOM 997 C ASP A 35 57.510 16.441 0.566 1.00 0.00 C ATOM 998 O ASP A 35 56.783 16.270 1.525 1.00 0.00 O ATOM 999 CB ASP A 35 57.023 18.496 -0.773 1.00 0.00 C ATOM 1000 CG ASP A 35 55.716 18.792 -0.034 1.00 0.00 C ATOM 1001 OD1 ASP A 35 55.491 18.184 0.998 1.00 0.00 O ATOM 1002 OD2 ASP A 35 54.963 19.623 -0.515 1.00 0.00 O ATOM 0 H ASP A 35 59.340 17.829 -1.496 1.00 0.00 H new ATOM 0 HA ASP A 35 58.116 18.427 1.097 1.00 0.00 H new ATOM 0 HB2 ASP A 35 57.444 19.419 -1.172 1.00 0.00 H new ATOM 0 HB3 ASP A 35 56.832 17.840 -1.622 1.00 0.00 H new ATOM 1007 N LEU A 36 57.856 15.457 -0.204 1.00 0.00 N ATOM 1008 CA LEU A 36 57.371 14.072 0.061 1.00 0.00 C ATOM 1009 C LEU A 36 57.925 13.482 1.373 1.00 0.00 C ATOM 1010 O LEU A 36 57.232 12.786 2.081 1.00 0.00 O ATOM 1011 CB LEU A 36 57.780 13.188 -1.120 1.00 0.00 C ATOM 1012 CG LEU A 36 57.364 11.730 -0.886 1.00 0.00 C ATOM 1013 CD1 LEU A 36 55.858 11.640 -0.613 1.00 0.00 C ATOM 1014 CD2 LEU A 36 57.701 10.925 -2.144 1.00 0.00 C ATOM 0 H LEU A 36 58.463 15.549 -1.019 1.00 0.00 H new ATOM 0 HA LEU A 36 56.287 14.108 0.173 1.00 0.00 H new ATOM 0 HB2 LEU A 36 57.317 13.560 -2.034 1.00 0.00 H new ATOM 0 HB3 LEU A 36 58.859 13.243 -1.264 1.00 0.00 H new ATOM 0 HG LEU A 36 57.897 11.333 -0.022 1.00 0.00 H new ATOM 0 HD11 LEU A 36 55.579 10.599 -0.449 1.00 0.00 H new ATOM 0 HD12 LEU A 36 55.613 12.225 0.274 1.00 0.00 H new ATOM 0 HD13 LEU A 36 55.309 12.032 -1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 36 57.413 9.884 -1.998 1.00 0.00 H new ATOM 0 HD22 LEU A 36 57.158 11.336 -2.995 1.00 0.00 H new ATOM 0 HD23 LEU A 36 58.773 10.981 -2.336 1.00 0.00 H new ATOM 1026 N LEU A 37 59.165 13.713 1.684 1.00 0.00 N ATOM 1027 CA LEU A 37 59.746 13.119 2.934 1.00 0.00 C ATOM 1028 C LEU A 37 59.499 13.982 4.187 1.00 0.00 C ATOM 1029 O LEU A 37 59.256 13.470 5.259 1.00 0.00 O ATOM 1030 CB LEU A 37 61.252 12.944 2.735 1.00 0.00 C ATOM 1031 CG LEU A 37 61.924 14.313 2.449 1.00 0.00 C ATOM 1032 CD1 LEU A 37 62.569 14.870 3.731 1.00 0.00 C ATOM 1033 CD2 LEU A 37 63.011 14.150 1.375 1.00 0.00 C ATOM 0 H LEU A 37 59.807 14.284 1.135 1.00 0.00 H new ATOM 0 HA LEU A 37 59.249 12.164 3.104 1.00 0.00 H new ATOM 0 HB2 LEU A 37 61.693 12.495 3.625 1.00 0.00 H new ATOM 0 HB3 LEU A 37 61.439 12.260 1.907 1.00 0.00 H new ATOM 0 HG LEU A 37 61.159 15.005 2.098 1.00 0.00 H new ATOM 0 HD11 LEU A 37 63.037 15.831 3.515 1.00 0.00 H new ATOM 0 HD12 LEU A 37 61.803 15.003 4.495 1.00 0.00 H new ATOM 0 HD13 LEU A 37 63.324 14.172 4.091 1.00 0.00 H new ATOM 0 HD21 LEU A 37 63.478 15.116 1.180 1.00 0.00 H new ATOM 0 HD22 LEU A 37 63.766 13.446 1.725 1.00 0.00 H new ATOM 0 HD23 LEU A 37 62.561 13.772 0.457 1.00 0.00 H new ATOM 1045 N GLN A 38 59.603 15.282 4.082 1.00 0.00 N ATOM 1046 CA GLN A 38 59.424 16.147 5.284 1.00 0.00 C ATOM 1047 C GLN A 38 58.001 16.050 5.813 1.00 0.00 C ATOM 1048 O GLN A 38 57.756 16.033 7.002 1.00 0.00 O ATOM 1049 CB GLN A 38 59.706 17.601 4.870 1.00 0.00 C ATOM 1050 CG GLN A 38 58.673 18.073 3.845 1.00 0.00 C ATOM 1051 CD GLN A 38 59.120 19.405 3.229 1.00 0.00 C ATOM 1052 OE1 GLN A 38 60.395 19.663 3.091 1.00 0.00 O flip ATOM 1053 NE2 GLN A 38 58.297 20.218 2.858 1.00 0.00 N flip ATOM 0 H GLN A 38 59.804 15.781 3.215 1.00 0.00 H new ATOM 0 HA GLN A 38 60.106 15.821 6.069 1.00 0.00 H new ATOM 0 HB2 GLN A 38 59.679 18.247 5.747 1.00 0.00 H new ATOM 0 HB3 GLN A 38 60.708 17.678 4.448 1.00 0.00 H new ATOM 0 HG2 GLN A 38 58.554 17.323 3.063 1.00 0.00 H new ATOM 0 HG3 GLN A 38 57.701 18.192 4.324 1.00 0.00 H new ATOM 0 HE21 GLN A 38 57.302 20.021 2.964 1.00 0.00 H new ATOM 0 HE22 GLN A 38 58.601 21.098 2.441 1.00 0.00 H new ATOM 1062 N THR A 39 57.064 16.029 4.915 1.00 0.00 N ATOM 1063 CA THR A 39 55.642 15.984 5.320 1.00 0.00 C ATOM 1064 C THR A 39 55.276 14.621 5.915 1.00 0.00 C ATOM 1065 O THR A 39 54.526 14.535 6.868 1.00 0.00 O ATOM 1066 CB THR A 39 54.753 16.292 4.113 1.00 0.00 C ATOM 1067 OG1 THR A 39 55.071 17.585 3.618 1.00 0.00 O ATOM 1068 CG2 THR A 39 53.288 16.268 4.543 1.00 0.00 C ATOM 0 H THR A 39 57.226 16.041 3.908 1.00 0.00 H new ATOM 0 HA THR A 39 55.480 16.737 6.091 1.00 0.00 H new ATOM 0 HB THR A 39 54.919 15.546 3.336 1.00 0.00 H new ATOM 0 HG1 THR A 39 55.254 17.531 2.657 1.00 0.00 H new ATOM 0 HG21 THR A 39 52.653 16.487 3.684 1.00 0.00 H new ATOM 0 HG22 THR A 39 53.040 15.282 4.935 1.00 0.00 H new ATOM 0 HG23 THR A 39 53.124 17.018 5.317 1.00 0.00 H new ATOM 1076 N GLU A 40 55.768 13.554 5.348 1.00 0.00 N ATOM 1077 CA GLU A 40 55.417 12.194 5.864 1.00 0.00 C ATOM 1078 C GLU A 40 56.474 11.677 6.852 1.00 0.00 C ATOM 1079 O GLU A 40 56.230 10.729 7.576 1.00 0.00 O ATOM 1080 CB GLU A 40 55.330 11.243 4.672 1.00 0.00 C ATOM 1081 CG GLU A 40 54.013 11.471 3.915 1.00 0.00 C ATOM 1082 CD GLU A 40 54.039 12.842 3.245 1.00 0.00 C ATOM 1083 OE1 GLU A 40 55.118 13.287 2.904 1.00 0.00 O ATOM 1084 OE2 GLU A 40 52.979 13.424 3.086 1.00 0.00 O ATOM 0 H GLU A 40 56.400 13.562 4.547 1.00 0.00 H new ATOM 0 HA GLU A 40 54.466 12.249 6.394 1.00 0.00 H new ATOM 0 HB2 GLU A 40 56.176 11.405 4.004 1.00 0.00 H new ATOM 0 HB3 GLU A 40 55.388 10.210 5.015 1.00 0.00 H new ATOM 0 HG2 GLU A 40 53.873 10.692 3.166 1.00 0.00 H new ATOM 0 HG3 GLU A 40 53.170 11.407 4.603 1.00 0.00 H new ATOM 1091 N LEU A 41 57.636 12.276 6.891 1.00 0.00 N ATOM 1092 CA LEU A 41 58.700 11.807 7.839 1.00 0.00 C ATOM 1093 C LEU A 41 59.322 13.028 8.527 1.00 0.00 C ATOM 1094 O LEU A 41 60.421 13.444 8.219 1.00 0.00 O ATOM 1095 CB LEU A 41 59.768 11.014 7.053 1.00 0.00 C ATOM 1096 CG LEU A 41 59.459 9.498 7.096 1.00 0.00 C ATOM 1097 CD1 LEU A 41 60.137 8.799 5.914 1.00 0.00 C ATOM 1098 CD2 LEU A 41 59.995 8.897 8.406 1.00 0.00 C ATOM 0 H LEU A 41 57.898 13.071 6.308 1.00 0.00 H new ATOM 0 HA LEU A 41 58.274 11.152 8.599 1.00 0.00 H new ATOM 0 HB2 LEU A 41 59.795 11.356 6.018 1.00 0.00 H new ATOM 0 HB3 LEU A 41 60.754 11.202 7.477 1.00 0.00 H new ATOM 0 HG LEU A 41 58.380 9.354 7.039 1.00 0.00 H new ATOM 0 HD11 LEU A 41 59.917 7.732 5.948 1.00 0.00 H new ATOM 0 HD12 LEU A 41 59.762 9.217 4.980 1.00 0.00 H new ATOM 0 HD13 LEU A 41 61.215 8.949 5.972 1.00 0.00 H new ATOM 0 HD21 LEU A 41 59.776 7.830 8.433 1.00 0.00 H new ATOM 0 HD22 LEU A 41 61.073 9.048 8.461 1.00 0.00 H new ATOM 0 HD23 LEU A 41 59.516 9.387 9.254 1.00 0.00 H new ATOM 1110 N SER A 42 58.611 13.591 9.463 1.00 0.00 N ATOM 1111 CA SER A 42 59.104 14.772 10.204 1.00 0.00 C ATOM 1112 C SER A 42 59.974 14.312 11.369 1.00 0.00 C ATOM 1113 O SER A 42 59.682 13.336 12.028 1.00 0.00 O ATOM 1114 CB SER A 42 57.902 15.547 10.752 1.00 0.00 C ATOM 1115 OG SER A 42 57.102 14.679 11.544 1.00 0.00 O ATOM 0 H SER A 42 57.686 13.269 9.748 1.00 0.00 H new ATOM 0 HA SER A 42 59.690 15.408 9.540 1.00 0.00 H new ATOM 0 HB2 SER A 42 58.242 16.392 11.350 1.00 0.00 H new ATOM 0 HB3 SER A 42 57.313 15.954 9.930 1.00 0.00 H new ATOM 0 HG SER A 42 56.333 15.174 11.897 1.00 0.00 H new ATOM 1121 N SER A 43 61.025 15.016 11.635 1.00 0.00 N ATOM 1122 CA SER A 43 61.918 14.653 12.767 1.00 0.00 C ATOM 1123 C SER A 43 62.745 13.405 12.434 1.00 0.00 C ATOM 1124 O SER A 43 63.598 12.999 13.200 1.00 0.00 O ATOM 1125 CB SER A 43 61.078 14.406 14.030 1.00 0.00 C ATOM 1126 OG SER A 43 59.921 15.228 13.987 1.00 0.00 O ATOM 0 H SER A 43 61.313 15.842 11.111 1.00 0.00 H new ATOM 0 HA SER A 43 62.606 15.480 12.944 1.00 0.00 H new ATOM 0 HB2 SER A 43 60.791 13.356 14.091 1.00 0.00 H new ATOM 0 HB3 SER A 43 61.665 14.629 14.921 1.00 0.00 H new ATOM 0 HG SER A 43 59.380 15.074 14.789 1.00 0.00 H new ATOM 1132 N PHE A 44 62.530 12.818 11.286 1.00 0.00 N ATOM 1133 CA PHE A 44 63.327 11.622 10.876 1.00 0.00 C ATOM 1134 C PHE A 44 64.255 12.060 9.746 1.00 0.00 C ATOM 1135 O PHE A 44 65.458 12.134 9.896 1.00 0.00 O ATOM 1136 CB PHE A 44 62.389 10.520 10.377 1.00 0.00 C ATOM 1137 CG PHE A 44 61.557 10.010 11.528 1.00 0.00 C ATOM 1138 CD1 PHE A 44 62.096 9.071 12.417 1.00 0.00 C ATOM 1139 CD2 PHE A 44 60.247 10.474 11.711 1.00 0.00 C ATOM 1140 CE1 PHE A 44 61.330 8.597 13.488 1.00 0.00 C ATOM 1141 CE2 PHE A 44 59.480 9.998 12.783 1.00 0.00 C ATOM 1142 CZ PHE A 44 60.023 9.060 13.671 1.00 0.00 C ATOM 0 H PHE A 44 61.830 13.118 10.608 1.00 0.00 H new ATOM 0 HA PHE A 44 63.899 11.232 11.718 1.00 0.00 H new ATOM 0 HB2 PHE A 44 61.742 10.907 9.590 1.00 0.00 H new ATOM 0 HB3 PHE A 44 62.967 9.704 9.942 1.00 0.00 H new ATOM 0 HD1 PHE A 44 63.105 8.712 12.276 1.00 0.00 H new ATOM 0 HD2 PHE A 44 59.829 11.198 11.027 1.00 0.00 H new ATOM 0 HE1 PHE A 44 61.748 7.874 14.173 1.00 0.00 H new ATOM 0 HE2 PHE A 44 58.470 10.354 12.925 1.00 0.00 H new ATOM 0 HZ PHE A 44 59.432 8.694 14.497 1.00 0.00 H new ATOM 1152 N LEU A 45 63.682 12.390 8.625 1.00 0.00 N ATOM 1153 CA LEU A 45 64.476 12.874 7.462 1.00 0.00 C ATOM 1154 C LEU A 45 64.415 14.408 7.464 1.00 0.00 C ATOM 1155 O LEU A 45 63.387 14.988 7.758 1.00 0.00 O ATOM 1156 CB LEU A 45 63.852 12.338 6.168 1.00 0.00 C ATOM 1157 CG LEU A 45 64.212 10.858 5.950 1.00 0.00 C ATOM 1158 CD1 LEU A 45 65.700 10.714 5.601 1.00 0.00 C ATOM 1159 CD2 LEU A 45 63.890 10.046 7.212 1.00 0.00 C ATOM 0 H LEU A 45 62.676 12.344 8.462 1.00 0.00 H new ATOM 0 HA LEU A 45 65.509 12.532 7.527 1.00 0.00 H new ATOM 0 HB2 LEU A 45 62.769 12.449 6.210 1.00 0.00 H new ATOM 0 HB3 LEU A 45 64.201 12.929 5.321 1.00 0.00 H new ATOM 0 HG LEU A 45 63.619 10.476 5.119 1.00 0.00 H new ATOM 0 HD11 LEU A 45 65.938 9.661 5.450 1.00 0.00 H new ATOM 0 HD12 LEU A 45 65.915 11.269 4.688 1.00 0.00 H new ATOM 0 HD13 LEU A 45 66.305 11.109 6.417 1.00 0.00 H new ATOM 0 HD21 LEU A 45 64.148 9.000 7.047 1.00 0.00 H new ATOM 0 HD22 LEU A 45 64.467 10.434 8.052 1.00 0.00 H new ATOM 0 HD23 LEU A 45 62.826 10.126 7.435 1.00 0.00 H new ATOM 1171 N ASP A 46 65.498 15.077 7.162 1.00 0.00 N ATOM 1172 CA ASP A 46 65.508 16.572 7.167 1.00 0.00 C ATOM 1173 C ASP A 46 65.983 17.072 5.808 1.00 0.00 C ATOM 1174 O ASP A 46 66.721 16.414 5.105 1.00 0.00 O ATOM 1175 CB ASP A 46 66.477 17.054 8.248 1.00 0.00 C ATOM 1176 CG ASP A 46 66.045 16.497 9.604 1.00 0.00 C ATOM 1177 OD1 ASP A 46 64.961 15.940 9.675 1.00 0.00 O ATOM 1178 OD2 ASP A 46 66.806 16.632 10.548 1.00 0.00 O ATOM 0 H ASP A 46 66.387 14.646 6.909 1.00 0.00 H new ATOM 0 HA ASP A 46 64.507 16.953 7.368 1.00 0.00 H new ATOM 0 HB2 ASP A 46 67.490 16.727 8.015 1.00 0.00 H new ATOM 0 HB3 ASP A 46 66.492 18.143 8.278 1.00 0.00 H new ATOM 1183 N VAL A 47 65.563 18.247 5.449 1.00 0.00 N ATOM 1184 CA VAL A 47 65.974 18.841 4.148 1.00 0.00 C ATOM 1185 C VAL A 47 65.803 20.344 4.241 1.00 0.00 C ATOM 1186 O VAL A 47 66.562 21.111 3.690 1.00 0.00 O ATOM 1187 CB VAL A 47 65.076 18.316 3.021 1.00 0.00 C ATOM 1188 CG1 VAL A 47 65.385 16.850 2.761 1.00 0.00 C ATOM 1189 CG2 VAL A 47 63.599 18.468 3.410 1.00 0.00 C ATOM 0 H VAL A 47 64.943 18.832 6.009 1.00 0.00 H new ATOM 0 HA VAL A 47 67.009 18.575 3.935 1.00 0.00 H new ATOM 0 HB VAL A 47 65.268 18.894 2.117 1.00 0.00 H new ATOM 0 HG11 VAL A 47 64.745 16.480 1.960 1.00 0.00 H new ATOM 0 HG12 VAL A 47 66.430 16.745 2.469 1.00 0.00 H new ATOM 0 HG13 VAL A 47 65.202 16.273 3.667 1.00 0.00 H new ATOM 0 HG21 VAL A 47 62.970 18.092 2.603 1.00 0.00 H new ATOM 0 HG22 VAL A 47 63.402 17.899 4.319 1.00 0.00 H new ATOM 0 HG23 VAL A 47 63.375 19.520 3.585 1.00 0.00 H new ATOM 1199 N GLN A 48 64.794 20.774 4.930 1.00 0.00 N ATOM 1200 CA GLN A 48 64.547 22.235 5.049 1.00 0.00 C ATOM 1201 C GLN A 48 65.343 22.811 6.219 1.00 0.00 C ATOM 1202 O GLN A 48 65.608 23.995 6.283 1.00 0.00 O ATOM 1203 CB GLN A 48 63.059 22.448 5.269 1.00 0.00 C ATOM 1204 CG GLN A 48 62.635 21.814 6.593 1.00 0.00 C ATOM 1205 CD GLN A 48 61.108 21.846 6.700 1.00 0.00 C ATOM 1206 OE1 GLN A 48 60.434 22.275 5.785 1.00 0.00 O ATOM 1207 NE2 GLN A 48 60.531 21.395 7.781 1.00 0.00 N ATOM 0 H GLN A 48 64.126 20.178 5.419 1.00 0.00 H new ATOM 0 HA GLN A 48 64.867 22.745 4.140 1.00 0.00 H new ATOM 0 HB2 GLN A 48 62.832 23.514 5.277 1.00 0.00 H new ATOM 0 HB3 GLN A 48 62.494 22.008 4.447 1.00 0.00 H new ATOM 0 HG2 GLN A 48 62.994 20.786 6.649 1.00 0.00 H new ATOM 0 HG3 GLN A 48 63.081 22.354 7.428 1.00 0.00 H new ATOM 0 HE21 GLN A 48 61.097 21.035 8.549 1.00 0.00 H new ATOM 0 HE22 GLN A 48 59.514 21.403 7.857 1.00 0.00 H new ATOM 1216 N LYS A 49 65.733 21.981 7.140 1.00 0.00 N ATOM 1217 CA LYS A 49 66.518 22.473 8.302 1.00 0.00 C ATOM 1218 C LYS A 49 67.895 22.907 7.810 1.00 0.00 C ATOM 1219 O LYS A 49 68.449 23.888 8.261 1.00 0.00 O ATOM 1220 CB LYS A 49 66.678 21.338 9.313 1.00 0.00 C ATOM 1221 CG LYS A 49 65.292 20.819 9.707 1.00 0.00 C ATOM 1222 CD LYS A 49 65.429 19.601 10.648 1.00 0.00 C ATOM 1223 CE LYS A 49 64.245 18.650 10.445 1.00 0.00 C ATOM 1224 NZ LYS A 49 62.974 19.351 10.786 1.00 0.00 N ATOM 0 H LYS A 49 65.542 20.979 7.139 1.00 0.00 H new ATOM 0 HA LYS A 49 66.008 23.313 8.774 1.00 0.00 H new ATOM 0 HB2 LYS A 49 67.273 20.532 8.883 1.00 0.00 H new ATOM 0 HB3 LYS A 49 67.212 21.692 10.195 1.00 0.00 H new ATOM 0 HG2 LYS A 49 64.726 21.609 10.202 1.00 0.00 H new ATOM 0 HG3 LYS A 49 64.733 20.538 8.814 1.00 0.00 H new ATOM 0 HD2 LYS A 49 66.365 19.079 10.448 1.00 0.00 H new ATOM 0 HD3 LYS A 49 65.466 19.934 11.685 1.00 0.00 H new ATOM 0 HE2 LYS A 49 64.216 18.306 9.411 1.00 0.00 H new ATOM 0 HE3 LYS A 49 64.364 17.766 11.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 62.204 18.656 10.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 63.084 19.847 11.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 62.747 20.040 10.041 1.00 0.00 H new ATOM 1238 N ASP A 50 68.454 22.164 6.884 1.00 0.00 N ATOM 1239 CA ASP A 50 69.809 22.503 6.341 1.00 0.00 C ATOM 1240 C ASP A 50 69.771 22.542 4.813 1.00 0.00 C ATOM 1241 O ASP A 50 69.503 21.550 4.162 1.00 0.00 O ATOM 1242 CB ASP A 50 70.810 21.436 6.788 1.00 0.00 C ATOM 1243 CG ASP A 50 71.046 21.563 8.295 1.00 0.00 C ATOM 1244 OD1 ASP A 50 70.683 22.587 8.847 1.00 0.00 O ATOM 1245 OD2 ASP A 50 71.584 20.630 8.874 1.00 0.00 O ATOM 0 H ASP A 50 68.027 21.331 6.478 1.00 0.00 H new ATOM 0 HA ASP A 50 70.108 23.481 6.717 1.00 0.00 H new ATOM 0 HB2 ASP A 50 70.430 20.442 6.550 1.00 0.00 H new ATOM 0 HB3 ASP A 50 71.750 21.555 6.250 1.00 0.00 H new ATOM 1250 N ALA A 51 70.065 23.673 4.236 1.00 0.00 N ATOM 1251 CA ALA A 51 70.072 23.770 2.750 1.00 0.00 C ATOM 1252 C ALA A 51 71.258 22.969 2.216 1.00 0.00 C ATOM 1253 O ALA A 51 71.244 22.489 1.100 1.00 0.00 O ATOM 1254 CB ALA A 51 70.203 25.234 2.322 1.00 0.00 C ATOM 0 H ALA A 51 70.301 24.534 4.729 1.00 0.00 H new ATOM 0 HA ALA A 51 69.140 23.371 2.349 1.00 0.00 H new ATOM 0 HB1 ALA A 51 70.207 25.296 1.234 1.00 0.00 H new ATOM 0 HB2 ALA A 51 69.361 25.805 2.715 1.00 0.00 H new ATOM 0 HB3 ALA A 51 71.134 25.645 2.713 1.00 0.00 H new ATOM 1260 N ASP A 52 72.288 22.825 3.002 1.00 0.00 N ATOM 1261 CA ASP A 52 73.472 22.057 2.537 1.00 0.00 C ATOM 1262 C ASP A 52 73.085 20.582 2.414 1.00 0.00 C ATOM 1263 O ASP A 52 73.656 19.849 1.636 1.00 0.00 O ATOM 1264 CB ASP A 52 74.611 22.217 3.550 1.00 0.00 C ATOM 1265 CG ASP A 52 75.129 23.657 3.503 1.00 0.00 C ATOM 1266 OD1 ASP A 52 75.027 24.268 2.451 1.00 0.00 O ATOM 1267 OD2 ASP A 52 75.612 24.125 4.519 1.00 0.00 O ATOM 0 H ASP A 52 72.360 23.206 3.945 1.00 0.00 H new ATOM 0 HA ASP A 52 73.805 22.429 1.568 1.00 0.00 H new ATOM 0 HB2 ASP A 52 74.258 21.978 4.553 1.00 0.00 H new ATOM 0 HB3 ASP A 52 75.417 21.520 3.321 1.00 0.00 H new ATOM 1272 N ALA A 53 72.106 20.142 3.164 1.00 0.00 N ATOM 1273 CA ALA A 53 71.662 18.716 3.081 1.00 0.00 C ATOM 1274 C ALA A 53 70.902 18.469 1.777 1.00 0.00 C ATOM 1275 O ALA A 53 71.035 17.438 1.154 1.00 0.00 O ATOM 1276 CB ALA A 53 70.728 18.412 4.271 1.00 0.00 C ATOM 0 H ALA A 53 71.592 20.713 3.835 1.00 0.00 H new ATOM 0 HA ALA A 53 72.539 18.069 3.109 1.00 0.00 H new ATOM 0 HB1 ALA A 53 70.399 17.374 4.219 1.00 0.00 H new ATOM 0 HB2 ALA A 53 71.264 18.576 5.206 1.00 0.00 H new ATOM 0 HB3 ALA A 53 69.860 19.070 4.230 1.00 0.00 H new ATOM 1282 N VAL A 54 70.084 19.396 1.378 1.00 0.00 N ATOM 1283 CA VAL A 54 69.283 19.209 0.136 1.00 0.00 C ATOM 1284 C VAL A 54 70.143 19.246 -1.117 1.00 0.00 C ATOM 1285 O VAL A 54 70.093 18.368 -1.934 1.00 0.00 O ATOM 1286 CB VAL A 54 68.261 20.338 0.026 1.00 0.00 C ATOM 1287 CG1 VAL A 54 67.250 19.980 -1.060 1.00 0.00 C ATOM 1288 CG2 VAL A 54 67.553 20.525 1.366 1.00 0.00 C ATOM 0 H VAL A 54 69.933 20.282 1.860 1.00 0.00 H new ATOM 0 HA VAL A 54 68.806 18.231 0.205 1.00 0.00 H new ATOM 0 HB VAL A 54 68.761 21.271 -0.235 1.00 0.00 H new ATOM 0 HG11 VAL A 54 66.514 20.779 -1.149 1.00 0.00 H new ATOM 0 HG12 VAL A 54 67.767 19.855 -2.011 1.00 0.00 H new ATOM 0 HG13 VAL A 54 66.746 19.050 -0.796 1.00 0.00 H new ATOM 0 HG21 VAL A 54 66.825 21.332 1.283 1.00 0.00 H new ATOM 0 HG22 VAL A 54 67.042 19.602 1.640 1.00 0.00 H new ATOM 0 HG23 VAL A 54 68.286 20.775 2.133 1.00 0.00 H new ATOM 1298 N ASP A 55 70.884 20.281 -1.309 1.00 0.00 N ATOM 1299 CA ASP A 55 71.693 20.381 -2.552 1.00 0.00 C ATOM 1300 C ASP A 55 72.739 19.274 -2.615 1.00 0.00 C ATOM 1301 O ASP A 55 73.015 18.734 -3.659 1.00 0.00 O ATOM 1302 CB ASP A 55 72.400 21.735 -2.573 1.00 0.00 C ATOM 1303 CG ASP A 55 73.425 21.803 -1.438 1.00 0.00 C ATOM 1304 OD1 ASP A 55 73.183 21.192 -0.409 1.00 0.00 O ATOM 1305 OD2 ASP A 55 74.430 22.467 -1.615 1.00 0.00 O ATOM 0 H ASP A 55 70.971 21.067 -0.665 1.00 0.00 H new ATOM 0 HA ASP A 55 71.029 20.279 -3.410 1.00 0.00 H new ATOM 0 HB2 ASP A 55 72.896 21.882 -3.532 1.00 0.00 H new ATOM 0 HB3 ASP A 55 71.671 22.538 -2.465 1.00 0.00 H new ATOM 1310 N LYS A 56 73.353 18.966 -1.518 1.00 0.00 N ATOM 1311 CA LYS A 56 74.421 17.928 -1.528 1.00 0.00 C ATOM 1312 C LYS A 56 73.845 16.525 -1.763 1.00 0.00 C ATOM 1313 O LYS A 56 74.442 15.704 -2.431 1.00 0.00 O ATOM 1314 CB LYS A 56 75.145 17.966 -0.188 1.00 0.00 C ATOM 1315 CG LYS A 56 75.946 19.267 -0.080 1.00 0.00 C ATOM 1316 CD LYS A 56 76.674 19.308 1.267 1.00 0.00 C ATOM 1317 CE LYS A 56 77.474 20.609 1.380 1.00 0.00 C ATOM 1318 NZ LYS A 56 78.579 20.603 0.382 1.00 0.00 N ATOM 0 H LYS A 56 73.165 19.387 -0.608 1.00 0.00 H new ATOM 0 HA LYS A 56 75.109 18.142 -2.346 1.00 0.00 H new ATOM 0 HB2 LYS A 56 74.426 17.900 0.628 1.00 0.00 H new ATOM 0 HB3 LYS A 56 75.810 17.108 -0.097 1.00 0.00 H new ATOM 0 HG2 LYS A 56 76.665 19.333 -0.896 1.00 0.00 H new ATOM 0 HG3 LYS A 56 75.280 20.125 -0.172 1.00 0.00 H new ATOM 0 HD2 LYS A 56 75.954 19.240 2.083 1.00 0.00 H new ATOM 0 HD3 LYS A 56 77.341 18.450 1.358 1.00 0.00 H new ATOM 0 HE2 LYS A 56 76.821 21.465 1.210 1.00 0.00 H new ATOM 0 HE3 LYS A 56 77.880 20.712 2.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 79.282 21.325 0.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 79.032 19.667 0.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 78.196 20.813 -0.562 1.00 0.00 H new ATOM 1332 N ILE A 57 72.711 16.232 -1.189 1.00 0.00 N ATOM 1333 CA ILE A 57 72.118 14.875 -1.341 1.00 0.00 C ATOM 1334 C ILE A 57 71.362 14.767 -2.663 1.00 0.00 C ATOM 1335 O ILE A 57 71.599 13.884 -3.463 1.00 0.00 O ATOM 1336 CB ILE A 57 71.160 14.640 -0.167 1.00 0.00 C ATOM 1337 CG1 ILE A 57 71.970 14.483 1.118 1.00 0.00 C ATOM 1338 CG2 ILE A 57 70.325 13.380 -0.397 1.00 0.00 C ATOM 1339 CD1 ILE A 57 71.044 14.578 2.330 1.00 0.00 C ATOM 0 H ILE A 57 72.167 16.879 -0.618 1.00 0.00 H new ATOM 0 HA ILE A 57 72.907 14.123 -1.343 1.00 0.00 H new ATOM 0 HB ILE A 57 70.488 15.494 -0.085 1.00 0.00 H new ATOM 0 HG12 ILE A 57 72.486 13.523 1.118 1.00 0.00 H new ATOM 0 HG13 ILE A 57 72.736 15.257 1.173 1.00 0.00 H new ATOM 0 HG21 ILE A 57 69.652 13.231 0.447 1.00 0.00 H new ATOM 0 HG22 ILE A 57 69.742 13.492 -1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 57 70.985 12.518 -0.491 1.00 0.00 H new ATOM 0 HD11 ILE A 57 71.628 14.465 3.244 1.00 0.00 H new ATOM 0 HD12 ILE A 57 70.548 15.549 2.334 1.00 0.00 H new ATOM 0 HD13 ILE A 57 70.295 13.788 2.278 1.00 0.00 H new ATOM 1351 N MET A 58 70.436 15.644 -2.873 1.00 0.00 N ATOM 1352 CA MET A 58 69.624 15.599 -4.111 1.00 0.00 C ATOM 1353 C MET A 58 70.487 15.747 -5.371 1.00 0.00 C ATOM 1354 O MET A 58 70.291 15.043 -6.341 1.00 0.00 O ATOM 1355 CB MET A 58 68.584 16.718 -4.068 1.00 0.00 C ATOM 1356 CG MET A 58 67.816 16.778 -5.396 1.00 0.00 C ATOM 1357 SD MET A 58 68.719 17.851 -6.547 1.00 0.00 S ATOM 1358 CE MET A 58 68.180 17.100 -8.103 1.00 0.00 C ATOM 0 H MET A 58 70.202 16.402 -2.232 1.00 0.00 H new ATOM 0 HA MET A 58 69.136 14.625 -4.159 1.00 0.00 H new ATOM 0 HB2 MET A 58 67.890 16.548 -3.245 1.00 0.00 H new ATOM 0 HB3 MET A 58 69.074 17.673 -3.879 1.00 0.00 H new ATOM 0 HG2 MET A 58 67.711 15.778 -5.816 1.00 0.00 H new ATOM 0 HG3 MET A 58 66.809 17.163 -5.233 1.00 0.00 H new ATOM 0 HE1 MET A 58 67.937 17.884 -8.820 1.00 0.00 H new ATOM 0 HE2 MET A 58 68.980 16.477 -8.503 1.00 0.00 H new ATOM 0 HE3 MET A 58 67.297 16.486 -7.924 1.00 0.00 H new ATOM 1368 N LYS A 59 71.425 16.654 -5.392 1.00 0.00 N ATOM 1369 CA LYS A 59 72.248 16.810 -6.626 1.00 0.00 C ATOM 1370 C LYS A 59 73.128 15.575 -6.800 1.00 0.00 C ATOM 1371 O LYS A 59 73.372 15.120 -7.900 1.00 0.00 O ATOM 1372 CB LYS A 59 73.131 18.059 -6.542 1.00 0.00 C ATOM 1373 CG LYS A 59 72.253 19.310 -6.456 1.00 0.00 C ATOM 1374 CD LYS A 59 73.140 20.557 -6.372 1.00 0.00 C ATOM 1375 CE LYS A 59 72.262 21.808 -6.288 1.00 0.00 C ATOM 1376 NZ LYS A 59 71.605 22.042 -7.605 1.00 0.00 N ATOM 0 H LYS A 59 71.655 17.284 -4.623 1.00 0.00 H new ATOM 0 HA LYS A 59 71.580 16.919 -7.480 1.00 0.00 H new ATOM 0 HB2 LYS A 59 73.780 17.998 -5.669 1.00 0.00 H new ATOM 0 HB3 LYS A 59 73.778 18.117 -7.417 1.00 0.00 H new ATOM 0 HG2 LYS A 59 71.604 19.372 -7.329 1.00 0.00 H new ATOM 0 HG3 LYS A 59 71.606 19.253 -5.581 1.00 0.00 H new ATOM 0 HD2 LYS A 59 73.788 20.496 -5.498 1.00 0.00 H new ATOM 0 HD3 LYS A 59 73.788 20.614 -7.246 1.00 0.00 H new ATOM 0 HE2 LYS A 59 71.508 21.685 -5.510 1.00 0.00 H new ATOM 0 HE3 LYS A 59 72.867 22.672 -6.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 71.220 23.008 -7.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 72.303 21.924 -8.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 70.833 21.357 -7.734 1.00 0.00 H new ATOM 1390 N GLU A 60 73.608 15.030 -5.717 1.00 0.00 N ATOM 1391 CA GLU A 60 74.474 13.824 -5.806 1.00 0.00 C ATOM 1392 C GLU A 60 73.602 12.570 -5.820 1.00 0.00 C ATOM 1393 O GLU A 60 74.055 11.503 -6.187 1.00 0.00 O ATOM 1394 CB GLU A 60 75.424 13.778 -4.608 1.00 0.00 C ATOM 1395 CG GLU A 60 76.320 15.019 -4.613 1.00 0.00 C ATOM 1396 CD GLU A 60 77.226 14.989 -5.846 1.00 0.00 C ATOM 1397 OE1 GLU A 60 77.484 13.905 -6.343 1.00 0.00 O ATOM 1398 OE2 GLU A 60 77.642 16.053 -6.275 1.00 0.00 O ATOM 0 H GLU A 60 73.436 15.370 -4.771 1.00 0.00 H new ATOM 0 HA GLU A 60 75.060 13.868 -6.724 1.00 0.00 H new ATOM 0 HB2 GLU A 60 74.853 13.733 -3.680 1.00 0.00 H new ATOM 0 HB3 GLU A 60 76.035 12.876 -4.650 1.00 0.00 H new ATOM 0 HG2 GLU A 60 75.709 15.922 -4.619 1.00 0.00 H new ATOM 0 HG3 GLU A 60 76.923 15.049 -3.706 1.00 0.00 H new ATOM 1405 N LEU A 61 72.344 12.692 -5.430 1.00 0.00 N ATOM 1406 CA LEU A 61 71.460 11.472 -5.441 1.00 0.00 C ATOM 1407 C LEU A 61 70.902 11.347 -6.860 1.00 0.00 C ATOM 1408 O LEU A 61 70.531 10.279 -7.305 1.00 0.00 O ATOM 1409 CB LEU A 61 70.371 11.554 -4.370 1.00 0.00 C ATOM 1410 CG LEU A 61 69.484 10.305 -4.401 1.00 0.00 C ATOM 1411 CD1 LEU A 61 70.276 9.080 -3.938 1.00 0.00 C ATOM 1412 CD2 LEU A 61 68.294 10.530 -3.466 1.00 0.00 C ATOM 0 H LEU A 61 71.904 13.556 -5.114 1.00 0.00 H new ATOM 0 HA LEU A 61 72.023 10.574 -5.188 1.00 0.00 H new ATOM 0 HB2 LEU A 61 70.829 11.656 -3.386 1.00 0.00 H new ATOM 0 HB3 LEU A 61 69.761 12.443 -4.532 1.00 0.00 H new ATOM 0 HG LEU A 61 69.137 10.129 -5.419 1.00 0.00 H new ATOM 0 HD11 LEU A 61 69.634 8.200 -3.965 1.00 0.00 H new ATOM 0 HD12 LEU A 61 71.129 8.927 -4.599 1.00 0.00 H new ATOM 0 HD13 LEU A 61 70.630 9.239 -2.920 1.00 0.00 H new ATOM 0 HD21 LEU A 61 67.652 9.649 -3.476 1.00 0.00 H new ATOM 0 HD22 LEU A 61 68.655 10.704 -2.452 1.00 0.00 H new ATOM 0 HD23 LEU A 61 67.726 11.397 -3.802 1.00 0.00 H new ATOM 1424 N ASP A 62 70.964 12.423 -7.617 1.00 0.00 N ATOM 1425 CA ASP A 62 70.572 12.360 -9.060 1.00 0.00 C ATOM 1426 C ASP A 62 71.886 12.054 -9.766 1.00 0.00 C ATOM 1427 O ASP A 62 72.239 12.585 -10.787 1.00 0.00 O ATOM 1428 CB ASP A 62 69.958 13.686 -9.544 1.00 0.00 C ATOM 1429 CG ASP A 62 68.431 13.631 -9.439 1.00 0.00 C ATOM 1430 OD1 ASP A 62 67.894 12.542 -9.457 1.00 0.00 O ATOM 1431 OD2 ASP A 62 67.824 14.683 -9.355 1.00 0.00 O ATOM 0 H ASP A 62 71.270 13.341 -7.294 1.00 0.00 H new ATOM 0 HA ASP A 62 69.802 11.615 -9.257 1.00 0.00 H new ATOM 0 HB2 ASP A 62 70.341 14.513 -8.946 1.00 0.00 H new ATOM 0 HB3 ASP A 62 70.252 13.876 -10.576 1.00 0.00 H new ATOM 1436 N GLU A 63 72.589 11.190 -9.113 1.00 0.00 N ATOM 1437 CA GLU A 63 73.928 10.726 -9.552 1.00 0.00 C ATOM 1438 C GLU A 63 73.991 10.601 -11.076 1.00 0.00 C ATOM 1439 O GLU A 63 75.057 10.625 -11.657 1.00 0.00 O ATOM 1440 CB GLU A 63 74.208 9.376 -8.917 1.00 0.00 C ATOM 1441 CG GLU A 63 73.232 8.331 -9.460 1.00 0.00 C ATOM 1442 CD GLU A 63 73.316 7.063 -8.606 1.00 0.00 C ATOM 1443 OE1 GLU A 63 74.215 6.272 -8.839 1.00 0.00 O ATOM 1444 OE2 GLU A 63 72.480 6.906 -7.731 1.00 0.00 O ATOM 0 H GLU A 63 72.274 10.761 -8.243 1.00 0.00 H new ATOM 0 HA GLU A 63 74.677 11.454 -9.241 1.00 0.00 H new ATOM 0 HB2 GLU A 63 75.233 9.072 -9.127 1.00 0.00 H new ATOM 0 HB3 GLU A 63 74.112 9.447 -7.834 1.00 0.00 H new ATOM 0 HG2 GLU A 63 72.216 8.725 -9.446 1.00 0.00 H new ATOM 0 HG3 GLU A 63 73.470 8.100 -10.498 1.00 0.00 H new ATOM 1451 N ASN A 64 72.873 10.493 -11.741 1.00 0.00 N ATOM 1452 CA ASN A 64 72.907 10.396 -13.231 1.00 0.00 C ATOM 1453 C ASN A 64 72.961 11.817 -13.779 1.00 0.00 C ATOM 1454 O ASN A 64 72.903 12.052 -14.968 1.00 0.00 O ATOM 1455 CB ASN A 64 71.649 9.686 -13.736 1.00 0.00 C ATOM 1456 CG ASN A 64 71.702 8.208 -13.350 1.00 0.00 C ATOM 1457 OD1 ASN A 64 72.766 7.657 -13.144 1.00 0.00 O ATOM 1458 ND2 ASN A 64 70.588 7.540 -13.232 1.00 0.00 N ATOM 0 H ASN A 64 71.943 10.468 -11.322 1.00 0.00 H new ATOM 0 HA ASN A 64 73.774 9.824 -13.561 1.00 0.00 H new ATOM 0 HB2 ASN A 64 70.761 10.152 -13.309 1.00 0.00 H new ATOM 0 HB3 ASN A 64 71.573 9.787 -14.819 1.00 0.00 H new ATOM 0 HD21 ASN A 64 70.609 6.555 -12.967 1.00 0.00 H new ATOM 0 HD22 ASN A 64 69.695 8.002 -13.405 1.00 0.00 H new ATOM 1465 N GLY A 65 73.086 12.761 -12.895 1.00 0.00 N ATOM 1466 CA GLY A 65 73.161 14.194 -13.305 1.00 0.00 C ATOM 1467 C GLY A 65 71.912 14.590 -14.103 1.00 0.00 C ATOM 1468 O GLY A 65 71.991 15.366 -15.035 1.00 0.00 O ATOM 0 H GLY A 65 73.141 12.602 -11.889 1.00 0.00 H new ATOM 0 HA2 GLY A 65 73.252 14.827 -12.422 1.00 0.00 H new ATOM 0 HA3 GLY A 65 74.053 14.360 -13.909 1.00 0.00 H new ATOM 1472 N ASP A 66 70.762 14.062 -13.757 1.00 0.00 N ATOM 1473 CA ASP A 66 69.512 14.408 -14.513 1.00 0.00 C ATOM 1474 C ASP A 66 68.675 15.436 -13.733 1.00 0.00 C ATOM 1475 O ASP A 66 67.800 16.069 -14.288 1.00 0.00 O ATOM 1476 CB ASP A 66 68.691 13.131 -14.731 1.00 0.00 C ATOM 1477 CG ASP A 66 68.311 12.527 -13.378 1.00 0.00 C ATOM 1478 OD1 ASP A 66 68.887 12.940 -12.387 1.00 0.00 O ATOM 1479 OD2 ASP A 66 67.456 11.656 -13.357 1.00 0.00 O ATOM 0 H ASP A 66 70.633 13.407 -12.985 1.00 0.00 H new ATOM 0 HA ASP A 66 69.785 14.845 -15.474 1.00 0.00 H new ATOM 0 HB2 ASP A 66 67.792 13.358 -15.304 1.00 0.00 H new ATOM 0 HB3 ASP A 66 69.267 12.411 -15.313 1.00 0.00 H new ATOM 1484 N GLY A 67 68.929 15.620 -12.466 1.00 0.00 N ATOM 1485 CA GLY A 67 68.131 16.622 -11.690 1.00 0.00 C ATOM 1486 C GLY A 67 66.766 16.019 -11.345 1.00 0.00 C ATOM 1487 O GLY A 67 66.021 16.518 -10.497 1.00 0.00 O ATOM 0 H GLY A 67 69.647 15.127 -11.935 1.00 0.00 H new ATOM 0 HA2 GLY A 67 68.660 16.899 -10.778 1.00 0.00 H new ATOM 0 HA3 GLY A 67 68.002 17.533 -12.274 1.00 0.00 H new ATOM 1491 N GLU A 68 66.446 14.928 -11.992 1.00 0.00 N ATOM 1492 CA GLU A 68 65.169 14.230 -11.751 1.00 0.00 C ATOM 1493 C GLU A 68 65.501 12.953 -10.997 1.00 0.00 C ATOM 1494 O GLU A 68 66.438 12.254 -11.317 1.00 0.00 O ATOM 1495 CB GLU A 68 64.535 13.893 -13.099 1.00 0.00 C ATOM 1496 CG GLU A 68 64.083 15.187 -13.780 1.00 0.00 C ATOM 1497 CD GLU A 68 63.493 14.863 -15.153 1.00 0.00 C ATOM 1498 OE1 GLU A 68 63.615 13.726 -15.577 1.00 0.00 O ATOM 1499 OE2 GLU A 68 62.934 15.761 -15.760 1.00 0.00 O ATOM 0 H GLU A 68 67.040 14.488 -12.695 1.00 0.00 H new ATOM 0 HA GLU A 68 64.472 14.842 -11.178 1.00 0.00 H new ATOM 0 HB2 GLU A 68 65.251 13.367 -13.730 1.00 0.00 H new ATOM 0 HB3 GLU A 68 63.685 13.226 -12.958 1.00 0.00 H new ATOM 0 HG2 GLU A 68 63.340 15.694 -13.164 1.00 0.00 H new ATOM 0 HG3 GLU A 68 64.927 15.868 -13.887 1.00 0.00 H new ATOM 1506 N VAL A 69 64.774 12.675 -9.968 1.00 0.00 N ATOM 1507 CA VAL A 69 65.057 11.481 -9.135 1.00 0.00 C ATOM 1508 C VAL A 69 64.097 10.349 -9.478 1.00 0.00 C ATOM 1509 O VAL A 69 62.923 10.557 -9.707 1.00 0.00 O ATOM 1510 CB VAL A 69 64.875 11.921 -7.699 1.00 0.00 C ATOM 1511 CG1 VAL A 69 64.962 10.723 -6.757 1.00 0.00 C ATOM 1512 CG2 VAL A 69 65.986 12.918 -7.360 1.00 0.00 C ATOM 0 H VAL A 69 63.978 13.233 -9.658 1.00 0.00 H new ATOM 0 HA VAL A 69 66.065 11.103 -9.309 1.00 0.00 H new ATOM 0 HB VAL A 69 63.894 12.382 -7.579 1.00 0.00 H new ATOM 0 HG11 VAL A 69 64.829 11.058 -5.728 1.00 0.00 H new ATOM 0 HG12 VAL A 69 64.181 10.005 -7.008 1.00 0.00 H new ATOM 0 HG13 VAL A 69 65.938 10.249 -6.860 1.00 0.00 H new ATOM 0 HG21 VAL A 69 65.875 13.250 -6.328 1.00 0.00 H new ATOM 0 HG22 VAL A 69 66.956 12.437 -7.484 1.00 0.00 H new ATOM 0 HG23 VAL A 69 65.919 13.778 -8.026 1.00 0.00 H new ATOM 1522 N ASP A 70 64.599 9.143 -9.525 1.00 0.00 N ATOM 1523 CA ASP A 70 63.735 7.980 -9.861 1.00 0.00 C ATOM 1524 C ASP A 70 63.291 7.287 -8.569 1.00 0.00 C ATOM 1525 O ASP A 70 64.113 6.882 -7.775 1.00 0.00 O ATOM 1526 CB ASP A 70 64.540 6.991 -10.706 1.00 0.00 C ATOM 1527 CG ASP A 70 64.794 7.580 -12.095 1.00 0.00 C ATOM 1528 OD1 ASP A 70 64.029 8.439 -12.503 1.00 0.00 O ATOM 1529 OD2 ASP A 70 65.743 7.155 -12.730 1.00 0.00 O ATOM 0 H ASP A 70 65.577 8.915 -9.344 1.00 0.00 H new ATOM 0 HA ASP A 70 62.860 8.319 -10.415 1.00 0.00 H new ATOM 0 HB2 ASP A 70 65.488 6.769 -10.217 1.00 0.00 H new ATOM 0 HB3 ASP A 70 63.998 6.049 -10.794 1.00 0.00 H new ATOM 1534 N PHE A 71 62.003 7.169 -8.360 1.00 0.00 N ATOM 1535 CA PHE A 71 61.457 6.507 -7.121 1.00 0.00 C ATOM 1536 C PHE A 71 62.429 5.462 -6.545 1.00 0.00 C ATOM 1537 O PHE A 71 62.543 5.312 -5.346 1.00 0.00 O ATOM 1538 CB PHE A 71 60.162 5.793 -7.496 1.00 0.00 C ATOM 1539 CG PHE A 71 60.470 4.720 -8.513 1.00 0.00 C ATOM 1540 CD1 PHE A 71 60.808 3.430 -8.091 1.00 0.00 C ATOM 1541 CD2 PHE A 71 60.423 5.019 -9.880 1.00 0.00 C ATOM 1542 CE1 PHE A 71 61.096 2.435 -9.034 1.00 0.00 C ATOM 1543 CE2 PHE A 71 60.712 4.026 -10.823 1.00 0.00 C ATOM 1544 CZ PHE A 71 61.048 2.734 -10.401 1.00 0.00 C ATOM 0 H PHE A 71 61.289 7.508 -9.005 1.00 0.00 H new ATOM 0 HA PHE A 71 61.299 7.277 -6.366 1.00 0.00 H new ATOM 0 HB2 PHE A 71 59.705 5.352 -6.610 1.00 0.00 H new ATOM 0 HB3 PHE A 71 59.444 6.504 -7.905 1.00 0.00 H new ATOM 0 HD1 PHE A 71 60.847 3.201 -7.036 1.00 0.00 H new ATOM 0 HD2 PHE A 71 60.164 6.015 -10.207 1.00 0.00 H new ATOM 0 HE1 PHE A 71 61.355 1.439 -8.707 1.00 0.00 H new ATOM 0 HE2 PHE A 71 60.676 4.257 -11.877 1.00 0.00 H new ATOM 0 HZ PHE A 71 61.270 1.968 -11.130 1.00 0.00 H new ATOM 1554 N GLN A 72 63.118 4.732 -7.380 1.00 0.00 N ATOM 1555 CA GLN A 72 64.066 3.696 -6.865 1.00 0.00 C ATOM 1556 C GLN A 72 65.141 4.361 -5.996 1.00 0.00 C ATOM 1557 O GLN A 72 65.514 3.859 -4.958 1.00 0.00 O ATOM 1558 CB GLN A 72 64.730 2.995 -8.052 1.00 0.00 C ATOM 1559 CG GLN A 72 65.691 1.915 -7.549 1.00 0.00 C ATOM 1560 CD GLN A 72 66.287 1.172 -8.745 1.00 0.00 C ATOM 1561 OE1 GLN A 72 65.847 1.350 -9.864 1.00 0.00 O ATOM 1562 NE2 GLN A 72 67.264 0.329 -8.554 1.00 0.00 N ATOM 0 H GLN A 72 63.067 4.806 -8.396 1.00 0.00 H new ATOM 0 HA GLN A 72 63.521 2.969 -6.263 1.00 0.00 H new ATOM 0 HB2 GLN A 72 63.970 2.548 -8.693 1.00 0.00 H new ATOM 0 HB3 GLN A 72 65.271 3.722 -8.658 1.00 0.00 H new ATOM 0 HG2 GLN A 72 66.485 2.367 -6.955 1.00 0.00 H new ATOM 0 HG3 GLN A 72 65.164 1.217 -6.899 1.00 0.00 H new ATOM 0 HE21 GLN A 72 67.633 0.180 -7.615 1.00 0.00 H new ATOM 0 HE22 GLN A 72 67.659 -0.181 -9.344 1.00 0.00 H new ATOM 1571 N GLU A 73 65.647 5.483 -6.419 1.00 0.00 N ATOM 1572 CA GLU A 73 66.699 6.184 -5.624 1.00 0.00 C ATOM 1573 C GLU A 73 66.106 6.679 -4.302 1.00 0.00 C ATOM 1574 O GLU A 73 66.728 6.629 -3.258 1.00 0.00 O ATOM 1575 CB GLU A 73 67.167 7.391 -6.430 1.00 0.00 C ATOM 1576 CG GLU A 73 67.958 6.917 -7.646 1.00 0.00 C ATOM 1577 CD GLU A 73 68.299 8.116 -8.532 1.00 0.00 C ATOM 1578 OE1 GLU A 73 67.927 9.222 -8.171 1.00 0.00 O ATOM 1579 OE2 GLU A 73 68.931 7.910 -9.554 1.00 0.00 O ATOM 0 H GLU A 73 65.378 5.950 -7.285 1.00 0.00 H new ATOM 0 HA GLU A 73 67.525 5.504 -5.416 1.00 0.00 H new ATOM 0 HB2 GLU A 73 66.309 7.983 -6.749 1.00 0.00 H new ATOM 0 HB3 GLU A 73 67.787 8.038 -5.809 1.00 0.00 H new ATOM 0 HG2 GLU A 73 68.872 6.416 -7.326 1.00 0.00 H new ATOM 0 HG3 GLU A 73 67.376 6.188 -8.210 1.00 0.00 H new ATOM 1586 N PHE A 74 64.904 7.173 -4.368 1.00 0.00 N ATOM 1587 CA PHE A 74 64.207 7.717 -3.164 1.00 0.00 C ATOM 1588 C PHE A 74 64.028 6.659 -2.064 1.00 0.00 C ATOM 1589 O PHE A 74 64.163 6.950 -0.896 1.00 0.00 O ATOM 1590 CB PHE A 74 62.827 8.205 -3.618 1.00 0.00 C ATOM 1591 CG PHE A 74 62.046 8.749 -2.447 1.00 0.00 C ATOM 1592 CD1 PHE A 74 61.230 7.890 -1.703 1.00 0.00 C ATOM 1593 CD2 PHE A 74 62.116 10.107 -2.122 1.00 0.00 C ATOM 1594 CE1 PHE A 74 60.485 8.388 -0.629 1.00 0.00 C ATOM 1595 CE2 PHE A 74 61.373 10.606 -1.046 1.00 0.00 C ATOM 1596 CZ PHE A 74 60.557 9.746 -0.300 1.00 0.00 C ATOM 0 H PHE A 74 64.358 7.225 -5.228 1.00 0.00 H new ATOM 0 HA PHE A 74 64.810 8.521 -2.741 1.00 0.00 H new ATOM 0 HB2 PHE A 74 62.940 8.978 -4.378 1.00 0.00 H new ATOM 0 HB3 PHE A 74 62.278 7.384 -4.079 1.00 0.00 H new ATOM 0 HD1 PHE A 74 61.175 6.842 -1.958 1.00 0.00 H new ATOM 0 HD2 PHE A 74 62.742 10.770 -2.700 1.00 0.00 H new ATOM 0 HE1 PHE A 74 59.855 7.725 -0.054 1.00 0.00 H new ATOM 0 HE2 PHE A 74 61.429 11.654 -0.791 1.00 0.00 H new ATOM 0 HZ PHE A 74 59.983 10.131 0.530 1.00 0.00 H new ATOM 1606 N VAL A 75 63.705 5.451 -2.419 1.00 0.00 N ATOM 1607 CA VAL A 75 63.488 4.404 -1.373 1.00 0.00 C ATOM 1608 C VAL A 75 64.815 3.979 -0.715 1.00 0.00 C ATOM 1609 O VAL A 75 64.862 3.685 0.462 1.00 0.00 O ATOM 1610 CB VAL A 75 62.772 3.188 -2.002 1.00 0.00 C ATOM 1611 CG1 VAL A 75 63.785 2.231 -2.644 1.00 0.00 C ATOM 1612 CG2 VAL A 75 61.983 2.435 -0.923 1.00 0.00 C ATOM 0 H VAL A 75 63.581 5.138 -3.382 1.00 0.00 H new ATOM 0 HA VAL A 75 62.860 4.824 -0.587 1.00 0.00 H new ATOM 0 HB VAL A 75 62.093 3.553 -2.773 1.00 0.00 H new ATOM 0 HG11 VAL A 75 63.258 1.382 -3.080 1.00 0.00 H new ATOM 0 HG12 VAL A 75 64.337 2.755 -3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 75 64.481 1.874 -1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 75 61.480 1.578 -1.371 1.00 0.00 H new ATOM 0 HG22 VAL A 75 62.666 2.089 -0.147 1.00 0.00 H new ATOM 0 HG23 VAL A 75 61.242 3.102 -0.483 1.00 0.00 H new ATOM 1622 N VAL A 76 65.882 3.921 -1.466 1.00 0.00 N ATOM 1623 CA VAL A 76 67.180 3.483 -0.867 1.00 0.00 C ATOM 1624 C VAL A 76 67.707 4.519 0.137 1.00 0.00 C ATOM 1625 O VAL A 76 67.975 4.200 1.275 1.00 0.00 O ATOM 1626 CB VAL A 76 68.222 3.298 -1.978 1.00 0.00 C ATOM 1627 CG1 VAL A 76 69.607 3.039 -1.361 1.00 0.00 C ATOM 1628 CG2 VAL A 76 67.823 2.109 -2.856 1.00 0.00 C ATOM 0 H VAL A 76 65.914 4.155 -2.458 1.00 0.00 H new ATOM 0 HA VAL A 76 67.009 2.542 -0.344 1.00 0.00 H new ATOM 0 HB VAL A 76 68.265 4.203 -2.584 1.00 0.00 H new ATOM 0 HG11 VAL A 76 70.341 2.909 -2.156 1.00 0.00 H new ATOM 0 HG12 VAL A 76 69.893 3.887 -0.739 1.00 0.00 H new ATOM 0 HG13 VAL A 76 69.570 2.137 -0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 76 68.562 1.976 -3.646 1.00 0.00 H new ATOM 0 HG22 VAL A 76 67.776 1.206 -2.247 1.00 0.00 H new ATOM 0 HG23 VAL A 76 66.846 2.297 -3.301 1.00 0.00 H new ATOM 1638 N LEU A 77 67.923 5.734 -0.291 1.00 0.00 N ATOM 1639 CA LEU A 77 68.503 6.759 0.636 1.00 0.00 C ATOM 1640 C LEU A 77 67.523 7.194 1.742 1.00 0.00 C ATOM 1641 O LEU A 77 67.902 7.329 2.890 1.00 0.00 O ATOM 1642 CB LEU A 77 68.952 7.974 -0.192 1.00 0.00 C ATOM 1643 CG LEU A 77 69.523 9.091 0.724 1.00 0.00 C ATOM 1644 CD1 LEU A 77 70.735 9.758 0.056 1.00 0.00 C ATOM 1645 CD2 LEU A 77 68.465 10.176 0.980 1.00 0.00 C ATOM 0 H LEU A 77 67.726 6.063 -1.236 1.00 0.00 H new ATOM 0 HA LEU A 77 69.353 6.307 1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 77 69.710 7.667 -0.913 1.00 0.00 H new ATOM 0 HB3 LEU A 77 68.108 8.362 -0.762 1.00 0.00 H new ATOM 0 HG LEU A 77 69.816 8.629 1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 77 71.126 10.539 0.708 1.00 0.00 H new ATOM 0 HD12 LEU A 77 71.509 9.012 -0.121 1.00 0.00 H new ATOM 0 HD13 LEU A 77 70.431 10.197 -0.894 1.00 0.00 H new ATOM 0 HD21 LEU A 77 68.885 10.949 1.624 1.00 0.00 H new ATOM 0 HD22 LEU A 77 68.161 10.619 0.032 1.00 0.00 H new ATOM 0 HD23 LEU A 77 67.597 9.731 1.467 1.00 0.00 H new ATOM 1657 N VAL A 78 66.288 7.442 1.420 1.00 0.00 N ATOM 1658 CA VAL A 78 65.323 7.900 2.473 1.00 0.00 C ATOM 1659 C VAL A 78 65.101 6.798 3.519 1.00 0.00 C ATOM 1660 O VAL A 78 65.002 7.065 4.700 1.00 0.00 O ATOM 1661 CB VAL A 78 63.999 8.292 1.802 1.00 0.00 C ATOM 1662 CG1 VAL A 78 62.966 8.796 2.838 1.00 0.00 C ATOM 1663 CG2 VAL A 78 64.292 9.405 0.788 1.00 0.00 C ATOM 0 H VAL A 78 65.899 7.351 0.481 1.00 0.00 H new ATOM 0 HA VAL A 78 65.734 8.767 2.990 1.00 0.00 H new ATOM 0 HB VAL A 78 63.574 7.416 1.312 1.00 0.00 H new ATOM 0 HG11 VAL A 78 62.041 9.065 2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 78 62.765 8.008 3.564 1.00 0.00 H new ATOM 0 HG13 VAL A 78 63.364 9.671 3.353 1.00 0.00 H new ATOM 0 HG21 VAL A 78 63.366 9.702 0.296 1.00 0.00 H new ATOM 0 HG22 VAL A 78 64.721 10.264 1.304 1.00 0.00 H new ATOM 0 HG23 VAL A 78 64.998 9.041 0.042 1.00 0.00 H new ATOM 1673 N ALA A 79 65.013 5.571 3.098 1.00 0.00 N ATOM 1674 CA ALA A 79 64.788 4.461 4.073 1.00 0.00 C ATOM 1675 C ALA A 79 66.098 4.115 4.795 1.00 0.00 C ATOM 1676 O ALA A 79 66.093 3.626 5.905 1.00 0.00 O ATOM 1677 CB ALA A 79 64.244 3.231 3.343 1.00 0.00 C ATOM 0 H ALA A 79 65.086 5.284 2.122 1.00 0.00 H new ATOM 0 HA ALA A 79 64.058 4.784 4.815 1.00 0.00 H new ATOM 0 HB1 ALA A 79 64.082 2.425 4.059 1.00 0.00 H new ATOM 0 HB2 ALA A 79 63.300 3.483 2.860 1.00 0.00 H new ATOM 0 HB3 ALA A 79 64.962 2.908 2.589 1.00 0.00 H new ATOM 1683 N ALA A 80 67.221 4.360 4.179 1.00 0.00 N ATOM 1684 CA ALA A 80 68.522 4.041 4.843 1.00 0.00 C ATOM 1685 C ALA A 80 68.643 4.859 6.125 1.00 0.00 C ATOM 1686 O ALA A 80 69.343 4.493 7.045 1.00 0.00 O ATOM 1687 CB ALA A 80 69.685 4.399 3.909 1.00 0.00 C ATOM 0 H ALA A 80 67.297 4.766 3.247 1.00 0.00 H new ATOM 0 HA ALA A 80 68.557 2.976 5.073 1.00 0.00 H new ATOM 0 HB1 ALA A 80 70.630 4.164 4.398 1.00 0.00 H new ATOM 0 HB2 ALA A 80 69.601 3.824 2.987 1.00 0.00 H new ATOM 0 HB3 ALA A 80 69.651 5.464 3.677 1.00 0.00 H new ATOM 1693 N LEU A 81 67.984 5.980 6.174 1.00 0.00 N ATOM 1694 CA LEU A 81 68.055 6.855 7.382 1.00 0.00 C ATOM 1695 C LEU A 81 66.902 6.525 8.336 1.00 0.00 C ATOM 1696 O LEU A 81 66.971 6.780 9.520 1.00 0.00 O ATOM 1697 CB LEU A 81 67.959 8.311 6.922 1.00 0.00 C ATOM 1698 CG LEU A 81 69.129 8.628 5.974 1.00 0.00 C ATOM 1699 CD1 LEU A 81 68.819 9.873 5.138 1.00 0.00 C ATOM 1700 CD2 LEU A 81 70.404 8.879 6.781 1.00 0.00 C ATOM 0 H LEU A 81 67.392 6.334 5.423 1.00 0.00 H new ATOM 0 HA LEU A 81 68.993 6.691 7.912 1.00 0.00 H new ATOM 0 HB2 LEU A 81 67.009 8.481 6.415 1.00 0.00 H new ATOM 0 HB3 LEU A 81 67.984 8.978 7.784 1.00 0.00 H new ATOM 0 HG LEU A 81 69.272 7.774 5.312 1.00 0.00 H new ATOM 0 HD11 LEU A 81 69.657 10.083 4.473 1.00 0.00 H new ATOM 0 HD12 LEU A 81 67.921 9.699 4.546 1.00 0.00 H new ATOM 0 HD13 LEU A 81 68.658 10.725 5.799 1.00 0.00 H new ATOM 0 HD21 LEU A 81 71.227 9.102 6.102 1.00 0.00 H new ATOM 0 HD22 LEU A 81 70.249 9.723 7.453 1.00 0.00 H new ATOM 0 HD23 LEU A 81 70.646 7.991 7.364 1.00 0.00 H new ATOM 1712 N THR A 82 65.827 5.994 7.825 1.00 0.00 N ATOM 1713 CA THR A 82 64.674 5.691 8.723 1.00 0.00 C ATOM 1714 C THR A 82 65.030 4.519 9.663 1.00 0.00 C ATOM 1715 O THR A 82 64.912 4.624 10.871 1.00 0.00 O ATOM 1716 CB THR A 82 63.404 5.416 7.887 1.00 0.00 C ATOM 1717 OG1 THR A 82 62.269 5.888 8.596 1.00 0.00 O ATOM 1718 CG2 THR A 82 63.224 3.924 7.588 1.00 0.00 C ATOM 0 H THR A 82 65.695 5.759 6.841 1.00 0.00 H new ATOM 0 HA THR A 82 64.461 6.555 9.352 1.00 0.00 H new ATOM 0 HB THR A 82 63.511 5.937 6.936 1.00 0.00 H new ATOM 0 HG1 THR A 82 61.688 5.132 8.824 1.00 0.00 H new ATOM 0 HG21 THR A 82 62.319 3.778 6.998 1.00 0.00 H new ATOM 0 HG22 THR A 82 64.085 3.559 7.028 1.00 0.00 H new ATOM 0 HG23 THR A 82 63.140 3.373 8.525 1.00 0.00 H new ATOM 1726 N VAL A 83 65.476 3.407 9.125 1.00 0.00 N ATOM 1727 CA VAL A 83 65.842 2.249 10.002 1.00 0.00 C ATOM 1728 C VAL A 83 67.161 2.542 10.714 1.00 0.00 C ATOM 1729 O VAL A 83 67.352 2.195 11.861 1.00 0.00 O ATOM 1730 CB VAL A 83 66.015 0.961 9.172 1.00 0.00 C ATOM 1731 CG1 VAL A 83 65.824 -0.263 10.072 1.00 0.00 C ATOM 1732 CG2 VAL A 83 64.997 0.919 8.038 1.00 0.00 C ATOM 0 H VAL A 83 65.601 3.252 8.125 1.00 0.00 H new ATOM 0 HA VAL A 83 65.038 2.107 10.724 1.00 0.00 H new ATOM 0 HB VAL A 83 67.019 0.952 8.748 1.00 0.00 H new ATOM 0 HG11 VAL A 83 65.947 -1.171 9.482 1.00 0.00 H new ATOM 0 HG12 VAL A 83 66.565 -0.246 10.871 1.00 0.00 H new ATOM 0 HG13 VAL A 83 64.824 -0.244 10.505 1.00 0.00 H new ATOM 0 HG21 VAL A 83 65.132 0.004 7.461 1.00 0.00 H new ATOM 0 HG22 VAL A 83 63.989 0.941 8.453 1.00 0.00 H new ATOM 0 HG23 VAL A 83 65.141 1.782 7.388 1.00 0.00 H new ATOM 1742 N ALA A 84 68.084 3.150 10.025 1.00 0.00 N ATOM 1743 CA ALA A 84 69.403 3.435 10.642 1.00 0.00 C ATOM 1744 C ALA A 84 69.213 4.323 11.869 1.00 0.00 C ATOM 1745 O ALA A 84 69.895 4.176 12.862 1.00 0.00 O ATOM 1746 CB ALA A 84 70.302 4.153 9.633 1.00 0.00 C ATOM 0 H ALA A 84 67.980 3.462 9.059 1.00 0.00 H new ATOM 0 HA ALA A 84 69.869 2.495 10.939 1.00 0.00 H new ATOM 0 HB1 ALA A 84 71.269 4.360 10.091 1.00 0.00 H new ATOM 0 HB2 ALA A 84 70.443 3.520 8.757 1.00 0.00 H new ATOM 0 HB3 ALA A 84 69.835 5.091 9.332 1.00 0.00 H new ATOM 1752 N CYS A 85 68.282 5.230 11.820 1.00 0.00 N ATOM 1753 CA CYS A 85 68.049 6.112 12.993 1.00 0.00 C ATOM 1754 C CYS A 85 67.593 5.266 14.181 1.00 0.00 C ATOM 1755 O CYS A 85 67.996 5.495 15.301 1.00 0.00 O ATOM 1756 CB CYS A 85 66.968 7.139 12.654 1.00 0.00 C ATOM 1757 SG CYS A 85 67.659 8.400 11.557 1.00 0.00 S ATOM 0 H CYS A 85 67.673 5.399 11.020 1.00 0.00 H new ATOM 0 HA CYS A 85 68.974 6.630 13.248 1.00 0.00 H new ATOM 0 HB2 CYS A 85 66.122 6.648 12.174 1.00 0.00 H new ATOM 0 HB3 CYS A 85 66.592 7.602 13.566 1.00 0.00 H new ATOM 0 HG CYS A 85 67.409 8.084 10.321 1.00 0.00 H new ATOM 1763 N ASN A 86 66.758 4.290 13.946 1.00 0.00 N ATOM 1764 CA ASN A 86 66.283 3.432 15.072 1.00 0.00 C ATOM 1765 C ASN A 86 67.480 2.730 15.715 1.00 0.00 C ATOM 1766 O ASN A 86 67.552 2.577 16.918 1.00 0.00 O ATOM 1767 CB ASN A 86 65.318 2.368 14.542 1.00 0.00 C ATOM 1768 CG ASN A 86 64.010 3.028 14.111 1.00 0.00 C ATOM 1769 OD1 ASN A 86 63.483 2.734 13.056 1.00 0.00 O ATOM 1770 ND2 ASN A 86 63.459 3.918 14.885 1.00 0.00 N ATOM 0 H ASN A 86 66.385 4.050 13.028 1.00 0.00 H new ATOM 0 HA ASN A 86 65.775 4.058 15.806 1.00 0.00 H new ATOM 0 HB2 ASN A 86 65.767 1.844 13.698 1.00 0.00 H new ATOM 0 HB3 ASN A 86 65.124 1.623 15.313 1.00 0.00 H new ATOM 0 HD21 ASN A 86 62.587 4.367 14.606 1.00 0.00 H new ATOM 0 HD22 ASN A 86 63.899 4.166 15.771 1.00 0.00 H new ATOM 1777 N ASN A 87 68.410 2.280 14.918 1.00 0.00 N ATOM 1778 CA ASN A 87 69.589 1.564 15.478 1.00 0.00 C ATOM 1779 C ASN A 87 70.363 2.471 16.438 1.00 0.00 C ATOM 1780 O ASN A 87 70.787 2.047 17.493 1.00 0.00 O ATOM 1781 CB ASN A 87 70.503 1.133 14.330 1.00 0.00 C ATOM 1782 CG ASN A 87 71.717 0.396 14.895 1.00 0.00 C ATOM 1783 OD1 ASN A 87 71.676 -0.117 15.994 1.00 0.00 O ATOM 1784 ND2 ASN A 87 72.805 0.323 14.182 1.00 0.00 N ATOM 0 H ASN A 87 68.404 2.378 13.903 1.00 0.00 H new ATOM 0 HA ASN A 87 69.245 0.689 16.030 1.00 0.00 H new ATOM 0 HB2 ASN A 87 69.959 0.486 13.641 1.00 0.00 H new ATOM 0 HB3 ASN A 87 70.826 2.005 13.761 1.00 0.00 H new ATOM 0 HD21 ASN A 87 73.622 -0.165 14.548 1.00 0.00 H new ATOM 0 HD22 ASN A 87 72.839 0.754 13.258 1.00 0.00 H new ATOM 1905 N SER B 2 49.231 10.171 5.682 1.00 0.00 N ATOM 1906 CA SER B 2 49.424 9.299 6.885 1.00 0.00 C ATOM 1907 C SER B 2 49.694 7.873 6.418 1.00 0.00 C ATOM 1908 O SER B 2 50.091 7.018 7.186 1.00 0.00 O ATOM 1909 CB SER B 2 48.160 9.317 7.743 1.00 0.00 C ATOM 1910 OG SER B 2 48.206 8.226 8.653 1.00 0.00 O ATOM 0 HA SER B 2 50.263 9.667 7.475 1.00 0.00 H new ATOM 0 HB2 SER B 2 48.087 10.259 8.287 1.00 0.00 H new ATOM 0 HB3 SER B 2 47.275 9.244 7.111 1.00 0.00 H new ATOM 0 HG SER B 2 49.077 7.781 8.587 1.00 0.00 H new ATOM 1916 N GLU B 3 49.493 7.616 5.157 1.00 0.00 N ATOM 1917 CA GLU B 3 49.747 6.249 4.633 1.00 0.00 C ATOM 1918 C GLU B 3 51.235 5.937 4.769 1.00 0.00 C ATOM 1919 O GLU B 3 51.619 4.917 5.280 1.00 0.00 O ATOM 1920 CB GLU B 3 49.357 6.186 3.156 1.00 0.00 C ATOM 1921 CG GLU B 3 47.834 6.294 3.009 1.00 0.00 C ATOM 1922 CD GLU B 3 47.397 7.748 3.203 1.00 0.00 C ATOM 1923 OE1 GLU B 3 48.261 8.606 3.263 1.00 0.00 O ATOM 1924 OE2 GLU B 3 46.202 7.979 3.298 1.00 0.00 O ATOM 0 H GLU B 3 49.164 8.293 4.468 1.00 0.00 H new ATOM 0 HA GLU B 3 49.158 5.525 5.196 1.00 0.00 H new ATOM 0 HB2 GLU B 3 49.841 6.995 2.609 1.00 0.00 H new ATOM 0 HB3 GLU B 3 49.707 5.251 2.719 1.00 0.00 H new ATOM 0 HG2 GLU B 3 47.528 5.941 2.024 1.00 0.00 H new ATOM 0 HG3 GLU B 3 47.342 5.656 3.743 1.00 0.00 H new ATOM 1931 N LEU B 4 52.067 6.817 4.298 1.00 0.00 N ATOM 1932 CA LEU B 4 53.536 6.584 4.373 1.00 0.00 C ATOM 1933 C LEU B 4 53.968 6.450 5.841 1.00 0.00 C ATOM 1934 O LEU B 4 54.783 5.618 6.184 1.00 0.00 O ATOM 1935 CB LEU B 4 54.247 7.752 3.694 1.00 0.00 C ATOM 1936 CG LEU B 4 55.783 7.600 3.729 1.00 0.00 C ATOM 1937 CD1 LEU B 4 56.205 6.176 3.352 1.00 0.00 C ATOM 1938 CD2 LEU B 4 56.399 8.571 2.715 1.00 0.00 C ATOM 0 H LEU B 4 51.792 7.696 3.860 1.00 0.00 H new ATOM 0 HA LEU B 4 53.802 5.659 3.862 1.00 0.00 H new ATOM 0 HB2 LEU B 4 53.914 7.825 2.659 1.00 0.00 H new ATOM 0 HB3 LEU B 4 53.964 8.683 4.186 1.00 0.00 H new ATOM 0 HG LEU B 4 56.128 7.815 4.740 1.00 0.00 H new ATOM 0 HD11 LEU B 4 57.292 6.098 3.385 1.00 0.00 H new ATOM 0 HD12 LEU B 4 55.769 5.469 4.057 1.00 0.00 H new ATOM 0 HD13 LEU B 4 55.855 5.947 2.345 1.00 0.00 H new ATOM 0 HD21 LEU B 4 57.484 8.473 2.730 1.00 0.00 H new ATOM 0 HD22 LEU B 4 56.028 8.339 1.717 1.00 0.00 H new ATOM 0 HD23 LEU B 4 56.123 9.593 2.976 1.00 0.00 H new ATOM 1950 N GLU B 5 53.406 7.244 6.710 1.00 0.00 N ATOM 1951 CA GLU B 5 53.756 7.148 8.156 1.00 0.00 C ATOM 1952 C GLU B 5 53.517 5.718 8.619 1.00 0.00 C ATOM 1953 O GLU B 5 54.342 5.100 9.271 1.00 0.00 O ATOM 1954 CB GLU B 5 52.811 8.068 8.943 1.00 0.00 C ATOM 1955 CG GLU B 5 53.160 8.007 10.436 1.00 0.00 C ATOM 1956 CD GLU B 5 52.230 8.933 11.221 1.00 0.00 C ATOM 1957 OE1 GLU B 5 51.610 9.782 10.601 1.00 0.00 O ATOM 1958 OE2 GLU B 5 52.166 8.786 12.429 1.00 0.00 O ATOM 0 H GLU B 5 52.716 7.959 6.480 1.00 0.00 H new ATOM 0 HA GLU B 5 54.796 7.433 8.314 1.00 0.00 H new ATOM 0 HB2 GLU B 5 52.898 9.092 8.580 1.00 0.00 H new ATOM 0 HB3 GLU B 5 51.776 7.762 8.788 1.00 0.00 H new ATOM 0 HG2 GLU B 5 53.063 6.984 10.800 1.00 0.00 H new ATOM 0 HG3 GLU B 5 54.198 8.303 10.589 1.00 0.00 H new ATOM 1965 N THR B 6 52.382 5.192 8.281 1.00 0.00 N ATOM 1966 CA THR B 6 52.049 3.810 8.687 1.00 0.00 C ATOM 1967 C THR B 6 52.978 2.825 7.997 1.00 0.00 C ATOM 1968 O THR B 6 53.218 1.754 8.491 1.00 0.00 O ATOM 1969 CB THR B 6 50.612 3.496 8.279 1.00 0.00 C ATOM 1970 OG1 THR B 6 50.410 3.849 6.922 1.00 0.00 O ATOM 1971 CG2 THR B 6 49.641 4.276 9.161 1.00 0.00 C ATOM 0 H THR B 6 51.663 5.666 7.735 1.00 0.00 H new ATOM 0 HA THR B 6 52.163 3.722 9.767 1.00 0.00 H new ATOM 0 HB THR B 6 50.432 2.428 8.404 1.00 0.00 H new ATOM 0 HG1 THR B 6 51.250 4.180 6.541 1.00 0.00 H new ATOM 0 HG21 THR B 6 48.617 4.048 8.865 1.00 0.00 H new ATOM 0 HG22 THR B 6 49.789 3.994 10.203 1.00 0.00 H new ATOM 0 HG23 THR B 6 49.822 5.345 9.045 1.00 0.00 H new ATOM 1979 N ALA B 7 53.448 3.152 6.829 1.00 0.00 N ATOM 1980 CA ALA B 7 54.307 2.191 6.087 1.00 0.00 C ATOM 1981 C ALA B 7 55.564 1.870 6.910 1.00 0.00 C ATOM 1982 O ALA B 7 55.962 0.743 7.040 1.00 0.00 O ATOM 1983 CB ALA B 7 54.702 2.801 4.741 1.00 0.00 C ATOM 0 H ALA B 7 53.276 4.040 6.357 1.00 0.00 H new ATOM 0 HA ALA B 7 53.755 1.267 5.916 1.00 0.00 H new ATOM 0 HB1 ALA B 7 55.332 2.099 4.194 1.00 0.00 H new ATOM 0 HB2 ALA B 7 53.804 3.012 4.160 1.00 0.00 H new ATOM 0 HB3 ALA B 7 55.252 3.727 4.909 1.00 0.00 H new ATOM 1989 N MET B 8 56.196 2.876 7.456 1.00 0.00 N ATOM 1990 CA MET B 8 57.424 2.644 8.260 1.00 0.00 C ATOM 1991 C MET B 8 57.100 1.739 9.447 1.00 0.00 C ATOM 1992 O MET B 8 57.822 0.823 9.748 1.00 0.00 O ATOM 1993 CB MET B 8 57.963 3.988 8.760 1.00 0.00 C ATOM 1994 CG MET B 8 59.261 3.776 9.547 1.00 0.00 C ATOM 1995 SD MET B 8 59.881 5.380 10.115 1.00 0.00 S ATOM 1996 CE MET B 8 61.124 4.766 11.278 1.00 0.00 C ATOM 0 H MET B 8 55.910 3.852 7.377 1.00 0.00 H new ATOM 0 HA MET B 8 58.179 2.159 7.641 1.00 0.00 H new ATOM 0 HB2 MET B 8 58.145 4.652 7.915 1.00 0.00 H new ATOM 0 HB3 MET B 8 57.220 4.474 9.393 1.00 0.00 H new ATOM 0 HG2 MET B 8 59.081 3.120 10.399 1.00 0.00 H new ATOM 0 HG3 MET B 8 60.005 3.286 8.919 1.00 0.00 H new ATOM 0 HE1 MET B 8 61.632 5.609 11.746 1.00 0.00 H new ATOM 0 HE2 MET B 8 60.638 4.163 12.045 1.00 0.00 H new ATOM 0 HE3 MET B 8 61.852 4.155 10.744 1.00 0.00 H new ATOM 2006 N GLU B 9 56.006 1.991 10.110 1.00 0.00 N ATOM 2007 CA GLU B 9 55.611 1.151 11.287 1.00 0.00 C ATOM 2008 C GLU B 9 55.332 -0.284 10.852 1.00 0.00 C ATOM 2009 O GLU B 9 55.664 -1.228 11.539 1.00 0.00 O ATOM 2010 CB GLU B 9 54.332 1.736 11.902 1.00 0.00 C ATOM 2011 CG GLU B 9 53.961 0.979 13.186 1.00 0.00 C ATOM 2012 CD GLU B 9 54.996 1.274 14.274 1.00 0.00 C ATOM 2013 OE1 GLU B 9 55.642 2.306 14.187 1.00 0.00 O ATOM 2014 OE2 GLU B 9 55.127 0.461 15.175 1.00 0.00 O ATOM 0 H GLU B 9 55.360 2.749 9.889 1.00 0.00 H new ATOM 0 HA GLU B 9 56.425 1.150 12.012 1.00 0.00 H new ATOM 0 HB2 GLU B 9 54.478 2.793 12.125 1.00 0.00 H new ATOM 0 HB3 GLU B 9 53.514 1.672 11.185 1.00 0.00 H new ATOM 0 HG2 GLU B 9 52.969 1.279 13.523 1.00 0.00 H new ATOM 0 HG3 GLU B 9 53.920 -0.092 12.990 1.00 0.00 H new ATOM 2021 N THR B 10 54.699 -0.450 9.735 1.00 0.00 N ATOM 2022 CA THR B 10 54.359 -1.811 9.259 1.00 0.00 C ATOM 2023 C THR B 10 55.637 -2.615 9.031 1.00 0.00 C ATOM 2024 O THR B 10 55.736 -3.764 9.413 1.00 0.00 O ATOM 2025 CB THR B 10 53.576 -1.700 7.953 1.00 0.00 C ATOM 2026 OG1 THR B 10 54.208 -0.763 7.100 1.00 0.00 O ATOM 2027 CG2 THR B 10 52.143 -1.247 8.234 1.00 0.00 C ATOM 0 H THR B 10 54.398 0.308 9.122 1.00 0.00 H new ATOM 0 HA THR B 10 53.752 -2.320 10.008 1.00 0.00 H new ATOM 0 HB THR B 10 53.552 -2.677 7.471 1.00 0.00 H new ATOM 0 HG1 THR B 10 54.990 -0.384 7.553 1.00 0.00 H new ATOM 0 HG21 THR B 10 51.595 -1.171 7.295 1.00 0.00 H new ATOM 0 HG22 THR B 10 51.653 -1.972 8.883 1.00 0.00 H new ATOM 0 HG23 THR B 10 52.159 -0.274 8.724 1.00 0.00 H new ATOM 2035 N LEU B 11 56.608 -2.019 8.413 1.00 0.00 N ATOM 2036 CA LEU B 11 57.884 -2.739 8.149 1.00 0.00 C ATOM 2037 C LEU B 11 58.504 -3.239 9.473 1.00 0.00 C ATOM 2038 O LEU B 11 59.117 -4.285 9.508 1.00 0.00 O ATOM 2039 CB LEU B 11 58.878 -1.790 7.458 1.00 0.00 C ATOM 2040 CG LEU B 11 58.330 -1.304 6.101 1.00 0.00 C ATOM 2041 CD1 LEU B 11 59.226 -0.176 5.573 1.00 0.00 C ATOM 2042 CD2 LEU B 11 58.285 -2.456 5.063 1.00 0.00 C ATOM 0 H LEU B 11 56.577 -1.057 8.075 1.00 0.00 H new ATOM 0 HA LEU B 11 57.675 -3.594 7.506 1.00 0.00 H new ATOM 0 HB2 LEU B 11 59.075 -0.933 8.102 1.00 0.00 H new ATOM 0 HB3 LEU B 11 59.829 -2.301 7.308 1.00 0.00 H new ATOM 0 HG LEU B 11 57.312 -0.943 6.250 1.00 0.00 H new ATOM 0 HD11 LEU B 11 58.844 0.173 4.613 1.00 0.00 H new ATOM 0 HD12 LEU B 11 59.228 0.650 6.284 1.00 0.00 H new ATOM 0 HD13 LEU B 11 60.243 -0.548 5.446 1.00 0.00 H new ATOM 0 HD21 LEU B 11 57.894 -2.079 4.118 1.00 0.00 H new ATOM 0 HD22 LEU B 11 59.291 -2.847 4.909 1.00 0.00 H new ATOM 0 HD23 LEU B 11 57.639 -3.253 5.431 1.00 0.00 H new ATOM 2054 N ILE B 12 58.389 -2.503 10.552 1.00 0.00 N ATOM 2055 CA ILE B 12 59.011 -2.970 11.841 1.00 0.00 C ATOM 2056 C ILE B 12 58.136 -4.033 12.539 1.00 0.00 C ATOM 2057 O ILE B 12 58.647 -4.874 13.248 1.00 0.00 O ATOM 2058 CB ILE B 12 59.222 -1.787 12.810 1.00 0.00 C ATOM 2059 CG1 ILE B 12 59.630 -0.518 12.047 1.00 0.00 C ATOM 2060 CG2 ILE B 12 60.318 -2.135 13.824 1.00 0.00 C ATOM 2061 CD1 ILE B 12 60.726 -0.821 11.023 1.00 0.00 C ATOM 0 H ILE B 12 57.899 -1.610 10.601 1.00 0.00 H new ATOM 0 HA ILE B 12 59.974 -3.413 11.586 1.00 0.00 H new ATOM 0 HB ILE B 12 58.281 -1.601 13.327 1.00 0.00 H new ATOM 0 HG12 ILE B 12 58.761 -0.099 11.541 1.00 0.00 H new ATOM 0 HG13 ILE B 12 59.983 0.236 12.751 1.00 0.00 H new ATOM 0 HG21 ILE B 12 60.463 -1.297 14.505 1.00 0.00 H new ATOM 0 HG22 ILE B 12 60.022 -3.017 14.392 1.00 0.00 H new ATOM 0 HG23 ILE B 12 61.250 -2.339 13.297 1.00 0.00 H new ATOM 0 HD11 ILE B 12 60.996 0.095 10.497 1.00 0.00 H new ATOM 0 HD12 ILE B 12 61.603 -1.217 11.535 1.00 0.00 H new ATOM 0 HD13 ILE B 12 60.361 -1.557 10.306 1.00 0.00 H new ATOM 2073 N ASN B 13 56.848 -4.001 12.392 1.00 0.00 N ATOM 2074 CA ASN B 13 56.018 -5.019 13.102 1.00 0.00 C ATOM 2075 C ASN B 13 56.367 -6.415 12.589 1.00 0.00 C ATOM 2076 O ASN B 13 56.442 -7.371 13.335 1.00 0.00 O ATOM 2077 CB ASN B 13 54.531 -4.747 12.867 1.00 0.00 C ATOM 2078 CG ASN B 13 53.709 -5.788 13.627 1.00 0.00 C ATOM 2079 OD1 ASN B 13 52.700 -6.367 13.041 1.00 0.00 O flip ATOM 2080 ND2 ASN B 13 53.993 -6.084 14.771 1.00 0.00 N flip ATOM 0 H ASN B 13 56.334 -3.329 11.822 1.00 0.00 H new ATOM 0 HA ASN B 13 56.226 -4.959 14.170 1.00 0.00 H new ATOM 0 HB2 ASN B 13 54.274 -3.743 13.206 1.00 0.00 H new ATOM 0 HB3 ASN B 13 54.304 -4.792 11.802 1.00 0.00 H new ATOM 0 HD21 ASN B 13 54.782 -5.633 15.234 1.00 0.00 H new ATOM 0 HD22 ASN B 13 53.442 -6.783 15.269 1.00 0.00 H new ATOM 2087 N VAL B 14 56.568 -6.535 11.309 1.00 0.00 N ATOM 2088 CA VAL B 14 56.896 -7.866 10.724 1.00 0.00 C ATOM 2089 C VAL B 14 58.391 -8.182 10.885 1.00 0.00 C ATOM 2090 O VAL B 14 58.769 -9.311 11.108 1.00 0.00 O ATOM 2091 CB VAL B 14 56.517 -7.868 9.234 1.00 0.00 C ATOM 2092 CG1 VAL B 14 55.004 -8.100 9.087 1.00 0.00 C ATOM 2093 CG2 VAL B 14 56.914 -6.519 8.582 1.00 0.00 C ATOM 0 H VAL B 14 56.520 -5.768 10.639 1.00 0.00 H new ATOM 0 HA VAL B 14 56.330 -8.633 11.252 1.00 0.00 H new ATOM 0 HB VAL B 14 57.053 -8.671 8.729 1.00 0.00 H new ATOM 0 HG11 VAL B 14 54.737 -8.101 8.030 1.00 0.00 H new ATOM 0 HG12 VAL B 14 54.738 -9.060 9.529 1.00 0.00 H new ATOM 0 HG13 VAL B 14 54.462 -7.303 9.597 1.00 0.00 H new ATOM 0 HG21 VAL B 14 56.641 -6.531 7.527 1.00 0.00 H new ATOM 0 HG22 VAL B 14 56.391 -5.705 9.083 1.00 0.00 H new ATOM 0 HG23 VAL B 14 57.990 -6.372 8.677 1.00 0.00 H new ATOM 2103 N PHE B 15 59.247 -7.206 10.748 1.00 0.00 N ATOM 2104 CA PHE B 15 60.712 -7.479 10.868 1.00 0.00 C ATOM 2105 C PHE B 15 61.049 -8.049 12.249 1.00 0.00 C ATOM 2106 O PHE B 15 61.733 -9.043 12.371 1.00 0.00 O ATOM 2107 CB PHE B 15 61.483 -6.168 10.690 1.00 0.00 C ATOM 2108 CG PHE B 15 62.950 -6.413 10.952 1.00 0.00 C ATOM 2109 CD1 PHE B 15 63.744 -7.010 9.968 1.00 0.00 C ATOM 2110 CD2 PHE B 15 63.510 -6.057 12.186 1.00 0.00 C ATOM 2111 CE1 PHE B 15 65.100 -7.251 10.217 1.00 0.00 C ATOM 2112 CE2 PHE B 15 64.865 -6.294 12.434 1.00 0.00 C ATOM 2113 CZ PHE B 15 65.660 -6.892 11.450 1.00 0.00 C ATOM 0 H PHE B 15 58.999 -6.235 10.559 1.00 0.00 H new ATOM 0 HA PHE B 15 60.990 -8.203 10.102 1.00 0.00 H new ATOM 0 HB2 PHE B 15 61.341 -5.784 9.680 1.00 0.00 H new ATOM 0 HB3 PHE B 15 61.101 -5.412 11.375 1.00 0.00 H new ATOM 0 HD1 PHE B 15 63.312 -7.285 9.017 1.00 0.00 H new ATOM 0 HD2 PHE B 15 62.894 -5.599 12.946 1.00 0.00 H new ATOM 0 HE1 PHE B 15 65.715 -7.714 9.459 1.00 0.00 H new ATOM 0 HE2 PHE B 15 65.298 -6.016 13.384 1.00 0.00 H new ATOM 0 HZ PHE B 15 66.707 -7.077 11.641 1.00 0.00 H new ATOM 2123 N HIS B 16 60.589 -7.409 13.281 1.00 0.00 N ATOM 2124 CA HIS B 16 60.889 -7.873 14.664 1.00 0.00 C ATOM 2125 C HIS B 16 60.108 -9.142 14.984 1.00 0.00 C ATOM 2126 O HIS B 16 60.466 -9.882 15.878 1.00 0.00 O ATOM 2127 CB HIS B 16 60.502 -6.778 15.669 1.00 0.00 C ATOM 2128 CG HIS B 16 61.556 -5.700 15.704 1.00 0.00 C ATOM 2129 ND1 HIS B 16 62.875 -5.936 15.343 1.00 0.00 N ATOM 2130 CD2 HIS B 16 61.501 -4.380 16.081 1.00 0.00 C ATOM 2131 CE1 HIS B 16 63.554 -4.786 15.510 1.00 0.00 C ATOM 2132 NE2 HIS B 16 62.762 -3.809 15.957 1.00 0.00 N ATOM 0 H HIS B 16 60.009 -6.572 13.227 1.00 0.00 H new ATOM 0 HA HIS B 16 61.956 -8.085 14.735 1.00 0.00 H new ATOM 0 HB2 HIS B 16 59.540 -6.346 15.393 1.00 0.00 H new ATOM 0 HB3 HIS B 16 60.384 -7.212 16.662 1.00 0.00 H new ATOM 0 HD2 HIS B 16 60.615 -3.865 16.421 1.00 0.00 H new ATOM 0 HE1 HIS B 16 64.608 -4.668 15.308 1.00 0.00 H new ATOM 0 HE2 HIS B 16 63.027 -2.846 16.164 1.00 0.00 H new ATOM 2141 N ALA B 17 59.029 -9.398 14.302 1.00 0.00 N ATOM 2142 CA ALA B 17 58.239 -10.613 14.635 1.00 0.00 C ATOM 2143 C ALA B 17 58.874 -11.867 14.025 1.00 0.00 C ATOM 2144 O ALA B 17 59.277 -12.766 14.736 1.00 0.00 O ATOM 2145 CB ALA B 17 56.822 -10.448 14.091 1.00 0.00 C ATOM 0 H ALA B 17 58.664 -8.828 13.539 1.00 0.00 H new ATOM 0 HA ALA B 17 58.220 -10.731 15.718 1.00 0.00 H new ATOM 0 HB1 ALA B 17 56.235 -11.335 14.330 1.00 0.00 H new ATOM 0 HB2 ALA B 17 56.358 -9.572 14.544 1.00 0.00 H new ATOM 0 HB3 ALA B 17 56.860 -10.319 13.009 1.00 0.00 H new ATOM 2151 N HIS B 18 58.920 -11.975 12.726 1.00 0.00 N ATOM 2152 CA HIS B 18 59.479 -13.219 12.120 1.00 0.00 C ATOM 2153 C HIS B 18 60.974 -13.376 12.439 1.00 0.00 C ATOM 2154 O HIS B 18 61.453 -14.465 12.683 1.00 0.00 O ATOM 2155 CB HIS B 18 59.278 -13.177 10.602 1.00 0.00 C ATOM 2156 CG HIS B 18 57.818 -13.364 10.279 1.00 0.00 C ATOM 2157 ND1 HIS B 18 56.928 -12.300 10.216 1.00 0.00 N ATOM 2158 CD2 HIS B 18 57.078 -14.487 10.001 1.00 0.00 C ATOM 2159 CE1 HIS B 18 55.715 -12.801 9.912 1.00 0.00 C ATOM 2160 NE2 HIS B 18 55.755 -14.127 9.771 1.00 0.00 N ATOM 0 H HIS B 18 58.600 -11.267 12.065 1.00 0.00 H new ATOM 0 HA HIS B 18 58.953 -14.074 12.545 1.00 0.00 H new ATOM 0 HB2 HIS B 18 59.629 -12.225 10.205 1.00 0.00 H new ATOM 0 HB3 HIS B 18 59.869 -13.959 10.125 1.00 0.00 H new ATOM 0 HD2 HIS B 18 57.464 -15.495 9.966 1.00 0.00 H new ATOM 0 HE1 HIS B 18 54.822 -12.204 9.797 1.00 0.00 H new ATOM 0 HE2 HIS B 18 54.978 -14.747 9.542 1.00 0.00 H new ATOM 2169 N SER B 19 61.718 -12.298 12.408 1.00 0.00 N ATOM 2170 CA SER B 19 63.189 -12.367 12.673 1.00 0.00 C ATOM 2171 C SER B 19 63.466 -12.715 14.131 1.00 0.00 C ATOM 2172 O SER B 19 64.575 -13.050 14.495 1.00 0.00 O ATOM 2173 CB SER B 19 63.802 -10.993 12.388 1.00 0.00 C ATOM 2174 OG SER B 19 63.304 -10.505 11.152 1.00 0.00 O ATOM 0 H SER B 19 61.365 -11.362 12.208 1.00 0.00 H new ATOM 0 HA SER B 19 63.621 -13.137 12.034 1.00 0.00 H new ATOM 0 HB2 SER B 19 63.557 -10.299 13.192 1.00 0.00 H new ATOM 0 HB3 SER B 19 64.889 -11.067 12.352 1.00 0.00 H new ATOM 0 HG SER B 19 62.783 -9.690 11.308 1.00 0.00 H new ATOM 2180 N GLY B 20 62.478 -12.617 14.970 1.00 0.00 N ATOM 2181 CA GLY B 20 62.677 -12.911 16.421 1.00 0.00 C ATOM 2182 C GLY B 20 62.127 -14.294 16.765 1.00 0.00 C ATOM 2183 O GLY B 20 61.984 -14.632 17.923 1.00 0.00 O ATOM 0 H GLY B 20 61.529 -12.343 14.714 1.00 0.00 H new ATOM 0 HA2 GLY B 20 63.738 -12.864 16.666 1.00 0.00 H new ATOM 0 HA3 GLY B 20 62.176 -12.153 17.024 1.00 0.00 H new ATOM 2187 N LYS B 21 61.831 -15.116 15.791 1.00 0.00 N ATOM 2188 CA LYS B 21 61.318 -16.477 16.128 1.00 0.00 C ATOM 2189 C LYS B 21 62.520 -17.372 16.390 1.00 0.00 C ATOM 2190 O LYS B 21 62.737 -17.828 17.496 1.00 0.00 O ATOM 2191 CB LYS B 21 60.490 -17.039 14.970 1.00 0.00 C ATOM 2192 CG LYS B 21 59.317 -16.105 14.645 1.00 0.00 C ATOM 2193 CD LYS B 21 58.239 -16.199 15.735 1.00 0.00 C ATOM 2194 CE LYS B 21 56.973 -15.462 15.278 1.00 0.00 C ATOM 2195 NZ LYS B 21 55.831 -15.861 16.148 1.00 0.00 N ATOM 0 H LYS B 21 61.920 -14.910 14.796 1.00 0.00 H new ATOM 0 HA LYS B 21 60.675 -16.429 17.007 1.00 0.00 H new ATOM 0 HB2 LYS B 21 61.121 -17.160 14.089 1.00 0.00 H new ATOM 0 HB3 LYS B 21 60.113 -18.028 15.231 1.00 0.00 H new ATOM 0 HG2 LYS B 21 59.673 -15.078 14.565 1.00 0.00 H new ATOM 0 HG3 LYS B 21 58.890 -16.371 13.678 1.00 0.00 H new ATOM 0 HD2 LYS B 21 58.008 -17.244 15.942 1.00 0.00 H new ATOM 0 HD3 LYS B 21 58.609 -15.764 16.664 1.00 0.00 H new ATOM 0 HE2 LYS B 21 57.126 -14.384 15.331 1.00 0.00 H new ATOM 0 HE3 LYS B 21 56.754 -15.702 14.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 54.971 -15.364 15.841 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 55.682 -16.888 16.076 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 56.043 -15.611 17.135 1.00 0.00 H new ATOM 2265 N TYR B 26 68.390 -9.499 17.043 1.00 0.00 N ATOM 2266 CA TYR B 26 68.549 -8.383 16.055 1.00 0.00 C ATOM 2267 C TYR B 26 69.405 -8.728 14.827 1.00 0.00 C ATOM 2268 O TYR B 26 69.998 -7.842 14.244 1.00 0.00 O ATOM 2269 CB TYR B 26 69.157 -7.156 16.752 1.00 0.00 C ATOM 2270 CG TYR B 26 68.629 -7.064 18.166 1.00 0.00 C ATOM 2271 CD1 TYR B 26 67.254 -6.923 18.390 1.00 0.00 C ATOM 2272 CD2 TYR B 26 69.514 -7.112 19.252 1.00 0.00 C ATOM 2273 CE1 TYR B 26 66.763 -6.828 19.697 1.00 0.00 C ATOM 2274 CE2 TYR B 26 69.023 -7.019 20.559 1.00 0.00 C ATOM 2275 CZ TYR B 26 67.648 -6.877 20.783 1.00 0.00 C ATOM 2276 OH TYR B 26 67.164 -6.779 22.072 1.00 0.00 O ATOM 0 HA TYR B 26 67.544 -8.181 15.683 1.00 0.00 H new ATOM 0 HB2 TYR B 26 70.244 -7.233 16.763 1.00 0.00 H new ATOM 0 HB3 TYR B 26 68.907 -6.250 16.200 1.00 0.00 H new ATOM 0 HD1 TYR B 26 66.572 -6.888 17.553 1.00 0.00 H new ATOM 0 HD2 TYR B 26 70.575 -7.221 19.080 1.00 0.00 H new ATOM 0 HE1 TYR B 26 65.703 -6.717 19.869 1.00 0.00 H new ATOM 0 HE2 TYR B 26 69.705 -7.057 21.396 1.00 0.00 H new ATOM 0 HH TYR B 26 67.909 -6.832 22.706 1.00 0.00 H new ATOM 2286 N LYS B 27 69.446 -9.958 14.376 1.00 0.00 N ATOM 2287 CA LYS B 27 70.227 -10.272 13.127 1.00 0.00 C ATOM 2288 C LYS B 27 69.334 -11.141 12.247 1.00 0.00 C ATOM 2289 O LYS B 27 68.654 -12.022 12.736 1.00 0.00 O ATOM 2290 CB LYS B 27 71.512 -11.034 13.458 1.00 0.00 C ATOM 2291 CG LYS B 27 72.419 -11.069 12.213 1.00 0.00 C ATOM 2292 CD LYS B 27 73.082 -9.679 11.974 1.00 0.00 C ATOM 2293 CE LYS B 27 74.612 -9.800 12.021 1.00 0.00 C ATOM 2294 NZ LYS B 27 75.074 -10.657 10.896 1.00 0.00 N ATOM 0 H LYS B 27 68.979 -10.754 14.810 1.00 0.00 H new ATOM 0 HA LYS B 27 70.511 -9.348 12.623 1.00 0.00 H new ATOM 0 HB2 LYS B 27 72.031 -10.552 14.287 1.00 0.00 H new ATOM 0 HB3 LYS B 27 71.275 -12.049 13.778 1.00 0.00 H new ATOM 0 HG2 LYS B 27 73.191 -11.828 12.341 1.00 0.00 H new ATOM 0 HG3 LYS B 27 71.834 -11.353 11.339 1.00 0.00 H new ATOM 0 HD2 LYS B 27 72.772 -9.283 11.007 1.00 0.00 H new ATOM 0 HD3 LYS B 27 72.743 -8.972 12.732 1.00 0.00 H new ATOM 0 HE2 LYS B 27 75.068 -8.813 11.952 1.00 0.00 H new ATOM 0 HE3 LYS B 27 74.925 -10.230 12.973 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 76.004 -10.327 10.568 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 75.150 -11.643 11.219 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 74.391 -10.601 10.114 1.00 0.00 H new ATOM 2308 N LEU B 28 69.310 -10.908 10.957 1.00 0.00 N ATOM 2309 CA LEU B 28 68.442 -11.725 10.073 1.00 0.00 C ATOM 2310 C LEU B 28 69.293 -12.861 9.504 1.00 0.00 C ATOM 2311 O LEU B 28 70.502 -12.788 9.497 1.00 0.00 O ATOM 2312 CB LEU B 28 67.901 -10.807 8.958 1.00 0.00 C ATOM 2313 CG LEU B 28 66.505 -11.242 8.502 1.00 0.00 C ATOM 2314 CD1 LEU B 28 65.460 -11.023 9.616 1.00 0.00 C ATOM 2315 CD2 LEU B 28 66.117 -10.421 7.269 1.00 0.00 C ATOM 0 H LEU B 28 69.856 -10.187 10.485 1.00 0.00 H new ATOM 0 HA LEU B 28 67.596 -12.156 10.608 1.00 0.00 H new ATOM 0 HB2 LEU B 28 67.864 -9.779 9.318 1.00 0.00 H new ATOM 0 HB3 LEU B 28 68.584 -10.823 8.109 1.00 0.00 H new ATOM 0 HG LEU B 28 66.526 -12.306 8.265 1.00 0.00 H new ATOM 0 HD11 LEU B 28 64.479 -11.341 9.262 1.00 0.00 H new ATOM 0 HD12 LEU B 28 65.736 -11.607 10.494 1.00 0.00 H new ATOM 0 HD13 LEU B 28 65.425 -9.966 9.880 1.00 0.00 H new ATOM 0 HD21 LEU B 28 65.124 -10.719 6.931 1.00 0.00 H new ATOM 0 HD22 LEU B 28 66.111 -9.361 7.525 1.00 0.00 H new ATOM 0 HD23 LEU B 28 66.840 -10.598 6.472 1.00 0.00 H new ATOM 2327 N SER B 29 68.674 -13.927 9.079 1.00 0.00 N ATOM 2328 CA SER B 29 69.443 -15.094 8.546 1.00 0.00 C ATOM 2329 C SER B 29 68.766 -15.632 7.284 1.00 0.00 C ATOM 2330 O SER B 29 67.632 -15.311 6.989 1.00 0.00 O ATOM 2331 CB SER B 29 69.487 -16.190 9.612 1.00 0.00 C ATOM 2332 OG SER B 29 70.168 -17.324 9.094 1.00 0.00 O ATOM 0 H SER B 29 67.661 -14.044 9.077 1.00 0.00 H new ATOM 0 HA SER B 29 70.456 -14.779 8.297 1.00 0.00 H new ATOM 0 HB2 SER B 29 69.994 -15.824 10.505 1.00 0.00 H new ATOM 0 HB3 SER B 29 68.475 -16.464 9.910 1.00 0.00 H new ATOM 0 HG SER B 29 70.616 -17.799 9.825 1.00 0.00 H new ATOM 2338 N LYS B 30 69.459 -16.446 6.531 1.00 0.00 N ATOM 2339 CA LYS B 30 68.861 -17.006 5.278 1.00 0.00 C ATOM 2340 C LYS B 30 67.434 -17.537 5.514 1.00 0.00 C ATOM 2341 O LYS B 30 66.535 -17.266 4.747 1.00 0.00 O ATOM 2342 CB LYS B 30 69.765 -18.147 4.792 1.00 0.00 C ATOM 2343 CG LYS B 30 69.088 -18.926 3.660 1.00 0.00 C ATOM 2344 CD LYS B 30 70.096 -19.886 3.031 1.00 0.00 C ATOM 2345 CE LYS B 30 69.370 -20.828 2.073 1.00 0.00 C ATOM 2346 NZ LYS B 30 68.676 -21.894 2.852 1.00 0.00 N ATOM 0 H LYS B 30 70.413 -16.748 6.728 1.00 0.00 H new ATOM 0 HA LYS B 30 68.792 -16.215 4.532 1.00 0.00 H new ATOM 0 HB2 LYS B 30 70.716 -17.742 4.444 1.00 0.00 H new ATOM 0 HB3 LYS B 30 69.989 -18.819 5.620 1.00 0.00 H new ATOM 0 HG2 LYS B 30 68.233 -19.481 4.046 1.00 0.00 H new ATOM 0 HG3 LYS B 30 68.707 -18.237 2.907 1.00 0.00 H new ATOM 0 HD2 LYS B 30 70.863 -19.326 2.496 1.00 0.00 H new ATOM 0 HD3 LYS B 30 70.603 -20.459 3.808 1.00 0.00 H new ATOM 0 HE2 LYS B 30 68.648 -20.271 1.476 1.00 0.00 H new ATOM 0 HE3 LYS B 30 70.081 -21.275 1.378 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 68.371 -22.652 2.208 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 69.327 -22.285 3.562 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 67.845 -21.490 3.330 1.00 0.00 H new ATOM 2360 N LYS B 31 67.218 -18.317 6.529 1.00 0.00 N ATOM 2361 CA LYS B 31 65.845 -18.874 6.753 1.00 0.00 C ATOM 2362 C LYS B 31 64.859 -17.789 7.224 1.00 0.00 C ATOM 2363 O LYS B 31 63.663 -17.902 7.030 1.00 0.00 O ATOM 2364 CB LYS B 31 65.922 -19.988 7.800 1.00 0.00 C ATOM 2365 CG LYS B 31 66.630 -19.461 9.052 1.00 0.00 C ATOM 2366 CD LYS B 31 66.742 -20.577 10.090 1.00 0.00 C ATOM 2367 CE LYS B 31 67.428 -20.034 11.344 1.00 0.00 C ATOM 2368 NZ LYS B 31 68.828 -19.641 11.014 1.00 0.00 N ATOM 0 H LYS B 31 67.921 -18.596 7.213 1.00 0.00 H new ATOM 0 HA LYS B 31 65.477 -19.267 5.805 1.00 0.00 H new ATOM 0 HB2 LYS B 31 64.920 -20.334 8.054 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.462 -20.845 7.397 1.00 0.00 H new ATOM 0 HG2 LYS B 31 67.622 -19.092 8.792 1.00 0.00 H new ATOM 0 HG3 LYS B 31 66.076 -18.619 9.467 1.00 0.00 H new ATOM 0 HD2 LYS B 31 65.752 -20.958 10.339 1.00 0.00 H new ATOM 0 HD3 LYS B 31 67.312 -21.412 9.683 1.00 0.00 H new ATOM 0 HE2 LYS B 31 66.879 -19.175 11.729 1.00 0.00 H new ATOM 0 HE3 LYS B 31 67.427 -20.790 12.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 69.387 -19.581 11.889 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 69.248 -20.352 10.382 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 68.826 -18.715 10.540 1.00 0.00 H new ATOM 2382 N GLU B 32 65.345 -16.745 7.832 1.00 0.00 N ATOM 2383 CA GLU B 32 64.419 -15.665 8.308 1.00 0.00 C ATOM 2384 C GLU B 32 63.929 -14.815 7.131 1.00 0.00 C ATOM 2385 O GLU B 32 62.789 -14.397 7.083 1.00 0.00 O ATOM 2386 CB GLU B 32 65.135 -14.763 9.310 1.00 0.00 C ATOM 2387 CG GLU B 32 65.348 -15.499 10.635 1.00 0.00 C ATOM 2388 CD GLU B 32 66.333 -14.704 11.493 1.00 0.00 C ATOM 2389 OE1 GLU B 32 65.947 -13.656 11.983 1.00 0.00 O ATOM 2390 OE2 GLU B 32 67.457 -15.155 11.648 1.00 0.00 O ATOM 0 H GLU B 32 66.335 -16.587 8.022 1.00 0.00 H new ATOM 0 HA GLU B 32 63.563 -16.140 8.787 1.00 0.00 H new ATOM 0 HB2 GLU B 32 66.096 -14.448 8.903 1.00 0.00 H new ATOM 0 HB3 GLU B 32 64.549 -13.860 9.479 1.00 0.00 H new ATOM 0 HG2 GLU B 32 64.399 -15.613 11.159 1.00 0.00 H new ATOM 0 HG3 GLU B 32 65.733 -16.502 10.451 1.00 0.00 H new ATOM 2397 N LEU B 33 64.795 -14.542 6.191 1.00 0.00 N ATOM 2398 CA LEU B 33 64.387 -13.703 5.023 1.00 0.00 C ATOM 2399 C LEU B 33 63.528 -14.509 4.039 1.00 0.00 C ATOM 2400 O LEU B 33 62.599 -13.986 3.460 1.00 0.00 O ATOM 2401 CB LEU B 33 65.622 -13.111 4.320 1.00 0.00 C ATOM 2402 CG LEU B 33 66.348 -14.171 3.453 1.00 0.00 C ATOM 2403 CD1 LEU B 33 65.859 -14.108 1.989 1.00 0.00 C ATOM 2404 CD2 LEU B 33 67.860 -13.901 3.476 1.00 0.00 C ATOM 0 H LEU B 33 65.764 -14.862 6.180 1.00 0.00 H new ATOM 0 HA LEU B 33 63.781 -12.877 5.395 1.00 0.00 H new ATOM 0 HB2 LEU B 33 65.317 -12.273 3.692 1.00 0.00 H new ATOM 0 HB3 LEU B 33 66.312 -12.716 5.066 1.00 0.00 H new ATOM 0 HG LEU B 33 66.130 -15.157 3.862 1.00 0.00 H new ATOM 0 HD11 LEU B 33 66.382 -14.860 1.398 1.00 0.00 H new ATOM 0 HD12 LEU B 33 64.787 -14.300 1.955 1.00 0.00 H new ATOM 0 HD13 LEU B 33 66.063 -13.119 1.579 1.00 0.00 H new ATOM 0 HD21 LEU B 33 68.372 -14.646 2.867 1.00 0.00 H new ATOM 0 HD22 LEU B 33 68.058 -12.907 3.076 1.00 0.00 H new ATOM 0 HD23 LEU B 33 68.224 -13.959 4.502 1.00 0.00 H new ATOM 2416 N LYS B 34 63.817 -15.771 3.839 1.00 0.00 N ATOM 2417 CA LYS B 34 63.003 -16.580 2.884 1.00 0.00 C ATOM 2418 C LYS B 34 61.530 -16.618 3.337 1.00 0.00 C ATOM 2419 O LYS B 34 60.623 -16.526 2.531 1.00 0.00 O ATOM 2420 CB LYS B 34 63.555 -18.011 2.856 1.00 0.00 C ATOM 2421 CG LYS B 34 62.818 -18.833 1.801 1.00 0.00 C ATOM 2422 CD LYS B 34 63.356 -20.264 1.803 1.00 0.00 C ATOM 2423 CE LYS B 34 62.628 -21.086 0.736 1.00 0.00 C ATOM 2424 NZ LYS B 34 63.289 -22.414 0.591 1.00 0.00 N ATOM 0 H LYS B 34 64.579 -16.273 4.295 1.00 0.00 H new ATOM 0 HA LYS B 34 63.058 -16.130 1.893 1.00 0.00 H new ATOM 0 HB2 LYS B 34 64.622 -17.994 2.636 1.00 0.00 H new ATOM 0 HB3 LYS B 34 63.439 -18.474 3.836 1.00 0.00 H new ATOM 0 HG2 LYS B 34 61.748 -18.835 2.008 1.00 0.00 H new ATOM 0 HG3 LYS B 34 62.951 -18.384 0.817 1.00 0.00 H new ATOM 0 HD2 LYS B 34 64.428 -20.261 1.606 1.00 0.00 H new ATOM 0 HD3 LYS B 34 63.214 -20.716 2.785 1.00 0.00 H new ATOM 0 HE2 LYS B 34 61.582 -21.217 1.014 1.00 0.00 H new ATOM 0 HE3 LYS B 34 62.640 -20.556 -0.217 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 62.793 -22.971 -0.134 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 64.280 -22.279 0.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 63.255 -22.920 1.499 1.00 0.00 H new ATOM 2438 N ASP B 35 61.291 -16.763 4.616 1.00 0.00 N ATOM 2439 CA ASP B 35 59.887 -16.826 5.131 1.00 0.00 C ATOM 2440 C ASP B 35 59.284 -15.422 5.239 1.00 0.00 C ATOM 2441 O ASP B 35 58.090 -15.232 5.110 1.00 0.00 O ATOM 2442 CB ASP B 35 59.892 -17.485 6.513 1.00 0.00 C ATOM 2443 CG ASP B 35 58.451 -17.746 6.959 1.00 0.00 C ATOM 2444 OD1 ASP B 35 57.559 -17.124 6.408 1.00 0.00 O ATOM 2445 OD2 ASP B 35 58.265 -18.570 7.838 1.00 0.00 O ATOM 0 H ASP B 35 62.013 -16.841 5.332 1.00 0.00 H new ATOM 0 HA ASP B 35 59.282 -17.409 4.436 1.00 0.00 H new ATOM 0 HB2 ASP B 35 60.449 -18.421 6.479 1.00 0.00 H new ATOM 0 HB3 ASP B 35 60.396 -16.840 7.233 1.00 0.00 H new ATOM 2450 N LEU B 36 60.093 -14.449 5.513 1.00 0.00 N ATOM 2451 CA LEU B 36 59.584 -13.056 5.682 1.00 0.00 C ATOM 2452 C LEU B 36 59.017 -12.461 4.376 1.00 0.00 C ATOM 2453 O LEU B 36 58.036 -11.751 4.391 1.00 0.00 O ATOM 2454 CB LEU B 36 60.733 -12.182 6.192 1.00 0.00 C ATOM 2455 CG LEU B 36 60.296 -10.714 6.318 1.00 0.00 C ATOM 2456 CD1 LEU B 36 59.056 -10.596 7.213 1.00 0.00 C ATOM 2457 CD2 LEU B 36 61.447 -9.918 6.939 1.00 0.00 C ATOM 0 H LEU B 36 61.101 -14.554 5.630 1.00 0.00 H new ATOM 0 HA LEU B 36 58.760 -13.082 6.395 1.00 0.00 H new ATOM 0 HB2 LEU B 36 61.071 -12.549 7.161 1.00 0.00 H new ATOM 0 HB3 LEU B 36 61.580 -12.255 5.510 1.00 0.00 H new ATOM 0 HG LEU B 36 60.048 -10.324 5.331 1.00 0.00 H new ATOM 0 HD11 LEU B 36 58.761 -9.549 7.290 1.00 0.00 H new ATOM 0 HD12 LEU B 36 58.238 -11.172 6.780 1.00 0.00 H new ATOM 0 HD13 LEU B 36 59.286 -10.983 8.206 1.00 0.00 H new ATOM 0 HD21 LEU B 36 61.155 -8.872 7.036 1.00 0.00 H new ATOM 0 HD22 LEU B 36 61.680 -10.323 7.924 1.00 0.00 H new ATOM 0 HD23 LEU B 36 62.327 -9.991 6.299 1.00 0.00 H new ATOM 2469 N LEU B 37 59.640 -12.701 3.258 1.00 0.00 N ATOM 2470 CA LEU B 37 59.138 -12.101 1.978 1.00 0.00 C ATOM 2471 C LEU B 37 58.048 -12.949 1.300 1.00 0.00 C ATOM 2472 O LEU B 37 57.109 -12.426 0.740 1.00 0.00 O ATOM 2473 CB LEU B 37 60.324 -11.940 1.021 1.00 0.00 C ATOM 2474 CG LEU B 37 60.979 -13.318 0.742 1.00 0.00 C ATOM 2475 CD1 LEU B 37 60.488 -13.877 -0.603 1.00 0.00 C ATOM 2476 CD2 LEU B 37 62.509 -13.181 0.687 1.00 0.00 C ATOM 0 H LEU B 37 60.472 -13.283 3.168 1.00 0.00 H new ATOM 0 HA LEU B 37 58.684 -11.140 2.219 1.00 0.00 H new ATOM 0 HB2 LEU B 37 59.988 -11.493 0.085 1.00 0.00 H new ATOM 0 HB3 LEU B 37 61.059 -11.261 1.452 1.00 0.00 H new ATOM 0 HG LEU B 37 60.699 -13.995 1.549 1.00 0.00 H new ATOM 0 HD11 LEU B 37 60.955 -14.844 -0.787 1.00 0.00 H new ATOM 0 HD12 LEU B 37 59.405 -13.997 -0.574 1.00 0.00 H new ATOM 0 HD13 LEU B 37 60.755 -13.187 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU B 37 62.955 -14.156 0.491 1.00 0.00 H new ATOM 0 HD22 LEU B 37 62.784 -12.489 -0.109 1.00 0.00 H new ATOM 0 HD23 LEU B 37 62.875 -12.800 1.641 1.00 0.00 H new ATOM 2488 N GLN B 38 58.182 -14.248 1.301 1.00 0.00 N ATOM 2489 CA GLN B 38 57.178 -15.106 0.608 1.00 0.00 C ATOM 2490 C GLN B 38 55.818 -14.991 1.278 1.00 0.00 C ATOM 2491 O GLN B 38 54.783 -14.964 0.639 1.00 0.00 O ATOM 2492 CB GLN B 38 57.663 -16.559 0.689 1.00 0.00 C ATOM 2493 CG GLN B 38 57.675 -17.035 2.141 1.00 0.00 C ATOM 2494 CD GLN B 38 58.414 -18.377 2.245 1.00 0.00 C ATOM 2495 OE1 GLN B 38 59.378 -18.656 1.411 1.00 0.00 O flip ATOM 2496 NE2 GLN B 38 58.110 -19.181 3.105 1.00 0.00 N flip ATOM 0 H GLN B 38 58.945 -14.753 1.753 1.00 0.00 H new ATOM 0 HA GLN B 38 57.075 -14.785 -0.429 1.00 0.00 H new ATOM 0 HB2 GLN B 38 57.012 -17.200 0.095 1.00 0.00 H new ATOM 0 HB3 GLN B 38 58.664 -16.639 0.265 1.00 0.00 H new ATOM 0 HG2 GLN B 38 58.162 -16.292 2.772 1.00 0.00 H new ATOM 0 HG3 GLN B 38 56.654 -17.143 2.506 1.00 0.00 H new ATOM 0 HE21 GLN B 38 57.357 -18.968 3.759 1.00 0.00 H new ATOM 0 HE22 GLN B 38 58.608 -20.069 3.172 1.00 0.00 H new ATOM 2505 N THR B 39 55.826 -14.963 2.574 1.00 0.00 N ATOM 2506 CA THR B 39 54.555 -14.895 3.328 1.00 0.00 C ATOM 2507 C THR B 39 53.887 -13.524 3.182 1.00 0.00 C ATOM 2508 O THR B 39 52.679 -13.423 3.080 1.00 0.00 O ATOM 2509 CB THR B 39 54.811 -15.204 4.804 1.00 0.00 C ATOM 2510 OG1 THR B 39 55.363 -16.508 4.920 1.00 0.00 O ATOM 2511 CG2 THR B 39 53.490 -15.142 5.573 1.00 0.00 C ATOM 0 H THR B 39 56.668 -14.985 3.149 1.00 0.00 H new ATOM 0 HA THR B 39 53.875 -15.640 2.914 1.00 0.00 H new ATOM 0 HB THR B 39 55.506 -14.473 5.216 1.00 0.00 H new ATOM 0 HG1 THR B 39 56.193 -16.467 5.440 1.00 0.00 H new ATOM 0 HG21 THR B 39 53.671 -15.362 6.625 1.00 0.00 H new ATOM 0 HG22 THR B 39 53.061 -14.144 5.479 1.00 0.00 H new ATOM 0 HG23 THR B 39 52.796 -15.875 5.163 1.00 0.00 H new ATOM 2519 N GLU B 40 54.651 -12.468 3.204 1.00 0.00 N ATOM 2520 CA GLU B 40 54.054 -11.102 3.101 1.00 0.00 C ATOM 2521 C GLU B 40 54.068 -10.592 1.652 1.00 0.00 C ATOM 2522 O GLU B 40 53.384 -9.642 1.324 1.00 0.00 O ATOM 2523 CB GLU B 40 54.869 -10.156 3.983 1.00 0.00 C ATOM 2524 CG GLU B 40 54.514 -10.380 5.464 1.00 0.00 C ATOM 2525 CD GLU B 40 54.993 -11.759 5.908 1.00 0.00 C ATOM 2526 OE1 GLU B 40 55.977 -12.220 5.366 1.00 0.00 O ATOM 2527 OE2 GLU B 40 54.368 -12.327 6.790 1.00 0.00 O ATOM 0 H GLU B 40 55.667 -12.490 3.289 1.00 0.00 H new ATOM 0 HA GLU B 40 53.015 -11.142 3.429 1.00 0.00 H new ATOM 0 HB2 GLU B 40 55.934 -10.326 3.826 1.00 0.00 H new ATOM 0 HB3 GLU B 40 54.667 -9.122 3.705 1.00 0.00 H new ATOM 0 HG2 GLU B 40 54.977 -9.609 6.079 1.00 0.00 H new ATOM 0 HG3 GLU B 40 53.437 -10.296 5.606 1.00 0.00 H new ATOM 2534 N LEU B 41 54.832 -11.202 0.784 1.00 0.00 N ATOM 2535 CA LEU B 41 54.880 -10.743 -0.643 1.00 0.00 C ATOM 2536 C LEU B 41 54.796 -11.967 -1.564 1.00 0.00 C ATOM 2537 O LEU B 41 55.769 -12.400 -2.147 1.00 0.00 O ATOM 2538 CB LEU B 41 56.194 -9.963 -0.881 1.00 0.00 C ATOM 2539 CG LEU B 41 55.968 -8.446 -0.685 1.00 0.00 C ATOM 2540 CD1 LEU B 41 57.300 -7.765 -0.350 1.00 0.00 C ATOM 2541 CD2 LEU B 41 55.411 -7.830 -1.977 1.00 0.00 C ATOM 0 H LEU B 41 55.428 -12.001 0.999 1.00 0.00 H new ATOM 0 HA LEU B 41 54.040 -10.083 -0.860 1.00 0.00 H new ATOM 0 HB2 LEU B 41 56.962 -10.314 -0.192 1.00 0.00 H new ATOM 0 HB3 LEU B 41 56.560 -10.155 -1.890 1.00 0.00 H new ATOM 0 HG LEU B 41 55.259 -8.298 0.130 1.00 0.00 H new ATOM 0 HD11 LEU B 41 57.138 -6.696 -0.212 1.00 0.00 H new ATOM 0 HD12 LEU B 41 57.706 -8.191 0.567 1.00 0.00 H new ATOM 0 HD13 LEU B 41 58.005 -7.923 -1.166 1.00 0.00 H new ATOM 0 HD21 LEU B 41 55.254 -6.761 -1.832 1.00 0.00 H new ATOM 0 HD22 LEU B 41 56.121 -7.986 -2.790 1.00 0.00 H new ATOM 0 HD23 LEU B 41 54.463 -8.305 -2.227 1.00 0.00 H new ATOM 2553 N SER B 42 53.618 -12.511 -1.692 1.00 0.00 N ATOM 2554 CA SER B 42 53.401 -13.691 -2.557 1.00 0.00 C ATOM 2555 C SER B 42 53.157 -13.234 -3.990 1.00 0.00 C ATOM 2556 O SER B 42 52.488 -12.251 -4.235 1.00 0.00 O ATOM 2557 CB SER B 42 52.166 -14.449 -2.068 1.00 0.00 C ATOM 2558 OG SER B 42 51.056 -13.562 -2.015 1.00 0.00 O ATOM 0 H SER B 42 52.780 -12.174 -1.219 1.00 0.00 H new ATOM 0 HA SER B 42 54.279 -14.335 -2.519 1.00 0.00 H new ATOM 0 HB2 SER B 42 51.948 -15.281 -2.737 1.00 0.00 H new ATOM 0 HB3 SER B 42 52.353 -14.873 -1.082 1.00 0.00 H new ATOM 0 HG SER B 42 50.264 -14.048 -1.703 1.00 0.00 H new ATOM 2564 N SER B 43 53.680 -13.950 -4.930 1.00 0.00 N ATOM 2565 CA SER B 43 53.474 -13.594 -6.358 1.00 0.00 C ATOM 2566 C SER B 43 54.302 -12.357 -6.736 1.00 0.00 C ATOM 2567 O SER B 43 54.337 -11.959 -7.884 1.00 0.00 O ATOM 2568 CB SER B 43 51.981 -13.333 -6.616 1.00 0.00 C ATOM 2569 OG SER B 43 51.205 -14.110 -5.713 1.00 0.00 O ATOM 0 H SER B 43 54.251 -14.780 -4.773 1.00 0.00 H new ATOM 0 HA SER B 43 53.806 -14.427 -6.977 1.00 0.00 H new ATOM 0 HB2 SER B 43 51.758 -12.274 -6.487 1.00 0.00 H new ATOM 0 HB3 SER B 43 51.728 -13.589 -7.645 1.00 0.00 H new ATOM 0 HG SER B 43 50.253 -13.944 -5.874 1.00 0.00 H new ATOM 2575 N PHE B 44 54.994 -11.775 -5.792 1.00 0.00 N ATOM 2576 CA PHE B 44 55.855 -10.590 -6.096 1.00 0.00 C ATOM 2577 C PHE B 44 57.305 -11.048 -5.992 1.00 0.00 C ATOM 2578 O PHE B 44 58.021 -11.136 -6.969 1.00 0.00 O ATOM 2579 CB PHE B 44 55.593 -9.482 -5.074 1.00 0.00 C ATOM 2580 CG PHE B 44 54.190 -8.954 -5.257 1.00 0.00 C ATOM 2581 CD1 PHE B 44 53.927 -8.003 -6.250 1.00 0.00 C ATOM 2582 CD2 PHE B 44 53.154 -9.411 -4.435 1.00 0.00 C ATOM 2583 CE1 PHE B 44 52.630 -7.510 -6.423 1.00 0.00 C ATOM 2584 CE2 PHE B 44 51.855 -8.917 -4.606 1.00 0.00 C ATOM 2585 CZ PHE B 44 51.592 -7.967 -5.601 1.00 0.00 C ATOM 0 H PHE B 44 55.001 -12.071 -4.816 1.00 0.00 H new ATOM 0 HA PHE B 44 55.638 -10.200 -7.091 1.00 0.00 H new ATOM 0 HB2 PHE B 44 55.719 -9.868 -4.062 1.00 0.00 H new ATOM 0 HB3 PHE B 44 56.316 -8.676 -5.201 1.00 0.00 H new ATOM 0 HD1 PHE B 44 54.727 -7.650 -6.883 1.00 0.00 H new ATOM 0 HD2 PHE B 44 53.356 -10.145 -3.669 1.00 0.00 H new ATOM 0 HE1 PHE B 44 52.429 -6.777 -7.190 1.00 0.00 H new ATOM 0 HE2 PHE B 44 51.056 -9.269 -3.970 1.00 0.00 H new ATOM 0 HZ PHE B 44 50.590 -7.587 -5.734 1.00 0.00 H new ATOM 2595 N LEU B 45 57.722 -11.372 -4.800 1.00 0.00 N ATOM 2596 CA LEU B 45 59.108 -11.868 -4.577 1.00 0.00 C ATOM 2597 C LEU B 45 59.046 -13.401 -4.526 1.00 0.00 C ATOM 2598 O LEU B 45 58.122 -13.966 -3.976 1.00 0.00 O ATOM 2599 CB LEU B 45 59.632 -11.331 -3.240 1.00 0.00 C ATOM 2600 CG LEU B 45 60.041 -9.853 -3.363 1.00 0.00 C ATOM 2601 CD1 LEU B 45 61.328 -9.719 -4.190 1.00 0.00 C ATOM 2602 CD2 LEU B 45 58.920 -9.048 -4.030 1.00 0.00 C ATOM 0 H LEU B 45 57.151 -11.313 -3.957 1.00 0.00 H new ATOM 0 HA LEU B 45 59.772 -11.535 -5.374 1.00 0.00 H new ATOM 0 HB2 LEU B 45 58.863 -11.437 -2.475 1.00 0.00 H new ATOM 0 HB3 LEU B 45 60.488 -11.923 -2.916 1.00 0.00 H new ATOM 0 HG LEU B 45 60.219 -9.463 -2.361 1.00 0.00 H new ATOM 0 HD11 LEU B 45 61.603 -8.667 -4.267 1.00 0.00 H new ATOM 0 HD12 LEU B 45 62.133 -10.270 -3.703 1.00 0.00 H new ATOM 0 HD13 LEU B 45 61.163 -10.125 -5.188 1.00 0.00 H new ATOM 0 HD21 LEU B 45 59.221 -8.004 -4.112 1.00 0.00 H new ATOM 0 HD22 LEU B 45 58.727 -9.449 -5.025 1.00 0.00 H new ATOM 0 HD23 LEU B 45 58.014 -9.118 -3.428 1.00 0.00 H new ATOM 2614 N ASP B 46 60.002 -14.084 -5.107 1.00 0.00 N ATOM 2615 CA ASP B 46 59.990 -15.579 -5.109 1.00 0.00 C ATOM 2616 C ASP B 46 61.296 -16.093 -4.517 1.00 0.00 C ATOM 2617 O ASP B 46 62.321 -15.442 -4.566 1.00 0.00 O ATOM 2618 CB ASP B 46 59.863 -16.069 -6.552 1.00 0.00 C ATOM 2619 CG ASP B 46 58.586 -15.502 -7.174 1.00 0.00 C ATOM 2620 OD1 ASP B 46 57.790 -14.942 -6.437 1.00 0.00 O ATOM 2621 OD2 ASP B 46 58.426 -15.631 -8.375 1.00 0.00 O ATOM 0 H ASP B 46 60.799 -13.664 -5.585 1.00 0.00 H new ATOM 0 HA ASP B 46 59.152 -15.945 -4.516 1.00 0.00 H new ATOM 0 HB2 ASP B 46 60.732 -15.756 -7.131 1.00 0.00 H new ATOM 0 HB3 ASP B 46 59.839 -17.158 -6.576 1.00 0.00 H new ATOM 2626 N VAL B 47 61.255 -17.272 -3.965 1.00 0.00 N ATOM 2627 CA VAL B 47 62.471 -17.882 -3.362 1.00 0.00 C ATOM 2628 C VAL B 47 62.267 -19.385 -3.299 1.00 0.00 C ATOM 2629 O VAL B 47 63.176 -20.164 -3.473 1.00 0.00 O ATOM 2630 CB VAL B 47 62.673 -17.357 -1.936 1.00 0.00 C ATOM 2631 CG1 VAL B 47 63.093 -15.897 -1.985 1.00 0.00 C ATOM 2632 CG2 VAL B 47 61.365 -17.483 -1.142 1.00 0.00 C ATOM 0 H VAL B 47 60.416 -17.848 -3.905 1.00 0.00 H new ATOM 0 HA VAL B 47 63.343 -17.629 -3.965 1.00 0.00 H new ATOM 0 HB VAL B 47 63.450 -17.945 -1.447 1.00 0.00 H new ATOM 0 HG11 VAL B 47 63.236 -15.525 -0.970 1.00 0.00 H new ATOM 0 HG12 VAL B 47 64.027 -15.805 -2.540 1.00 0.00 H new ATOM 0 HG13 VAL B 47 62.318 -15.312 -2.480 1.00 0.00 H new ATOM 0 HG21 VAL B 47 61.516 -17.108 -0.130 1.00 0.00 H new ATOM 0 HG22 VAL B 47 60.585 -16.901 -1.632 1.00 0.00 H new ATOM 0 HG23 VAL B 47 61.064 -18.530 -1.100 1.00 0.00 H new ATOM 2642 N GLN B 48 61.069 -19.798 -3.038 1.00 0.00 N ATOM 2643 CA GLN B 48 60.795 -21.254 -2.939 1.00 0.00 C ATOM 2644 C GLN B 48 60.482 -21.826 -4.317 1.00 0.00 C ATOM 2645 O GLN B 48 60.599 -23.012 -4.550 1.00 0.00 O ATOM 2646 CB GLN B 48 59.614 -21.448 -2.003 1.00 0.00 C ATOM 2647 CG GLN B 48 58.359 -20.838 -2.624 1.00 0.00 C ATOM 2648 CD GLN B 48 57.236 -20.825 -1.587 1.00 0.00 C ATOM 2649 OE1 GLN B 48 57.434 -21.222 -0.455 1.00 0.00 O ATOM 2650 NE2 GLN B 48 56.056 -20.384 -1.923 1.00 0.00 N ATOM 0 H GLN B 48 60.263 -19.192 -2.888 1.00 0.00 H new ATOM 0 HA GLN B 48 61.669 -21.777 -2.551 1.00 0.00 H new ATOM 0 HB2 GLN B 48 59.458 -22.510 -1.814 1.00 0.00 H new ATOM 0 HB3 GLN B 48 59.820 -20.980 -1.041 1.00 0.00 H new ATOM 0 HG2 GLN B 48 58.565 -19.824 -2.966 1.00 0.00 H new ATOM 0 HG3 GLN B 48 58.055 -21.414 -3.498 1.00 0.00 H new ATOM 0 HE21 GLN B 48 55.887 -20.050 -2.872 1.00 0.00 H new ATOM 0 HE22 GLN B 48 55.301 -20.373 -1.237 1.00 0.00 H new ATOM 2659 N LYS B 49 60.097 -20.991 -5.236 1.00 0.00 N ATOM 2660 CA LYS B 49 59.786 -21.481 -6.603 1.00 0.00 C ATOM 2661 C LYS B 49 61.086 -21.936 -7.262 1.00 0.00 C ATOM 2662 O LYS B 49 61.127 -22.926 -7.967 1.00 0.00 O ATOM 2663 CB LYS B 49 59.177 -20.339 -7.413 1.00 0.00 C ATOM 2664 CG LYS B 49 57.948 -19.803 -6.672 1.00 0.00 C ATOM 2665 CD LYS B 49 57.355 -18.597 -7.430 1.00 0.00 C ATOM 2666 CE LYS B 49 56.708 -17.626 -6.437 1.00 0.00 C ATOM 2667 NZ LYS B 49 55.570 -18.297 -5.747 1.00 0.00 N ATOM 0 H LYS B 49 59.984 -19.987 -5.099 1.00 0.00 H new ATOM 0 HA LYS B 49 59.081 -22.311 -6.559 1.00 0.00 H new ATOM 0 HB2 LYS B 49 59.909 -19.544 -7.552 1.00 0.00 H new ATOM 0 HB3 LYS B 49 58.895 -20.690 -8.406 1.00 0.00 H new ATOM 0 HG2 LYS B 49 57.198 -20.589 -6.580 1.00 0.00 H new ATOM 0 HG3 LYS B 49 58.225 -19.506 -5.660 1.00 0.00 H new ATOM 0 HD2 LYS B 49 58.138 -18.088 -7.992 1.00 0.00 H new ATOM 0 HD3 LYS B 49 56.615 -18.939 -8.153 1.00 0.00 H new ATOM 0 HE2 LYS B 49 57.445 -17.294 -5.705 1.00 0.00 H new ATOM 0 HE3 LYS B 49 56.356 -16.737 -6.960 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 55.020 -17.591 -5.217 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 54.958 -18.755 -6.452 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 55.937 -19.014 -5.089 1.00 0.00 H new ATOM 2681 N ASP B 50 62.154 -21.210 -7.038 1.00 0.00 N ATOM 2682 CA ASP B 50 63.474 -21.582 -7.646 1.00 0.00 C ATOM 2683 C ASP B 50 64.552 -21.624 -6.565 1.00 0.00 C ATOM 2684 O ASP B 50 64.851 -20.631 -5.927 1.00 0.00 O ATOM 2685 CB ASP B 50 63.865 -20.544 -8.698 1.00 0.00 C ATOM 2686 CG ASP B 50 62.911 -20.636 -9.888 1.00 0.00 C ATOM 2687 OD1 ASP B 50 62.237 -21.647 -10.007 1.00 0.00 O ATOM 2688 OD2 ASP B 50 62.874 -19.696 -10.665 1.00 0.00 O ATOM 0 H ASP B 50 62.170 -20.371 -6.458 1.00 0.00 H new ATOM 0 HA ASP B 50 63.385 -22.564 -8.110 1.00 0.00 H new ATOM 0 HB2 ASP B 50 63.830 -19.543 -8.267 1.00 0.00 H new ATOM 0 HB3 ASP B 50 64.890 -20.713 -9.027 1.00 0.00 H new ATOM 2693 N ALA B 51 65.158 -22.762 -6.374 1.00 0.00 N ATOM 2694 CA ALA B 51 66.236 -22.864 -5.355 1.00 0.00 C ATOM 2695 C ALA B 51 67.447 -22.082 -5.857 1.00 0.00 C ATOM 2696 O ALA B 51 68.256 -21.611 -5.082 1.00 0.00 O ATOM 2697 CB ALA B 51 66.618 -24.333 -5.149 1.00 0.00 C ATOM 0 H ALA B 51 64.953 -23.624 -6.879 1.00 0.00 H new ATOM 0 HA ALA B 51 65.893 -22.455 -4.405 1.00 0.00 H new ATOM 0 HB1 ALA B 51 67.408 -24.402 -4.401 1.00 0.00 H new ATOM 0 HB2 ALA B 51 65.746 -24.891 -4.808 1.00 0.00 H new ATOM 0 HB3 ALA B 51 66.972 -24.752 -6.091 1.00 0.00 H new ATOM 2703 N ASP B 52 67.585 -21.942 -7.148 1.00 0.00 N ATOM 2704 CA ASP B 52 68.752 -21.195 -7.683 1.00 0.00 C ATOM 2705 C ASP B 52 68.600 -19.715 -7.325 1.00 0.00 C ATOM 2706 O ASP B 52 69.569 -18.997 -7.209 1.00 0.00 O ATOM 2707 CB ASP B 52 68.811 -21.361 -9.203 1.00 0.00 C ATOM 2708 CG ASP B 52 69.175 -22.808 -9.542 1.00 0.00 C ATOM 2709 OD1 ASP B 52 69.860 -23.427 -8.746 1.00 0.00 O ATOM 2710 OD2 ASP B 52 68.760 -23.271 -10.592 1.00 0.00 O ATOM 0 H ASP B 52 66.943 -22.311 -7.849 1.00 0.00 H new ATOM 0 HA ASP B 52 69.674 -21.582 -7.248 1.00 0.00 H new ATOM 0 HB2 ASP B 52 67.849 -21.103 -9.646 1.00 0.00 H new ATOM 0 HB3 ASP B 52 69.549 -20.680 -9.626 1.00 0.00 H new ATOM 2715 N ALA B 53 67.389 -19.258 -7.132 1.00 0.00 N ATOM 2716 CA ALA B 53 67.156 -17.829 -6.757 1.00 0.00 C ATOM 2717 C ALA B 53 67.568 -17.576 -5.305 1.00 0.00 C ATOM 2718 O ALA B 53 68.104 -16.538 -4.974 1.00 0.00 O ATOM 2719 CB ALA B 53 65.657 -17.508 -6.910 1.00 0.00 C ATOM 0 H ALA B 53 66.542 -19.820 -7.219 1.00 0.00 H new ATOM 0 HA ALA B 53 67.754 -17.194 -7.411 1.00 0.00 H new ATOM 0 HB1 ALA B 53 65.478 -16.468 -6.638 1.00 0.00 H new ATOM 0 HB2 ALA B 53 65.354 -17.670 -7.944 1.00 0.00 H new ATOM 0 HB3 ALA B 53 65.077 -18.159 -6.256 1.00 0.00 H new ATOM 2725 N VAL B 54 67.305 -18.508 -4.435 1.00 0.00 N ATOM 2726 CA VAL B 54 67.653 -18.323 -2.998 1.00 0.00 C ATOM 2727 C VAL B 54 69.154 -18.374 -2.764 1.00 0.00 C ATOM 2728 O VAL B 54 69.722 -17.498 -2.169 1.00 0.00 O ATOM 2729 CB VAL B 54 67.017 -19.447 -2.181 1.00 0.00 C ATOM 2730 CG1 VAL B 54 67.117 -19.102 -0.694 1.00 0.00 C ATOM 2731 CG2 VAL B 54 65.550 -19.616 -2.584 1.00 0.00 C ATOM 0 H VAL B 54 66.860 -19.398 -4.658 1.00 0.00 H new ATOM 0 HA VAL B 54 67.283 -17.344 -2.696 1.00 0.00 H new ATOM 0 HB VAL B 54 67.542 -20.383 -2.373 1.00 0.00 H new ATOM 0 HG11 VAL B 54 66.665 -19.900 -0.104 1.00 0.00 H new ATOM 0 HG12 VAL B 54 68.165 -18.994 -0.415 1.00 0.00 H new ATOM 0 HG13 VAL B 54 66.592 -18.166 -0.501 1.00 0.00 H new ATOM 0 HG21 VAL B 54 65.102 -20.419 -1.998 1.00 0.00 H new ATOM 0 HG22 VAL B 54 65.012 -18.687 -2.397 1.00 0.00 H new ATOM 0 HG23 VAL B 54 65.490 -19.863 -3.644 1.00 0.00 H new ATOM 2741 N ASP B 55 69.792 -19.418 -3.169 1.00 0.00 N ATOM 2742 CA ASP B 55 71.247 -19.536 -2.904 1.00 0.00 C ATOM 2743 C ASP B 55 72.026 -18.443 -3.625 1.00 0.00 C ATOM 2744 O ASP B 55 72.974 -17.908 -3.107 1.00 0.00 O ATOM 2745 CB ASP B 55 71.728 -20.901 -3.398 1.00 0.00 C ATOM 2746 CG ASP B 55 71.611 -20.971 -4.923 1.00 0.00 C ATOM 2747 OD1 ASP B 55 70.708 -20.350 -5.459 1.00 0.00 O ATOM 2748 OD2 ASP B 55 72.426 -21.648 -5.526 1.00 0.00 O ATOM 0 H ASP B 55 69.374 -20.200 -3.674 1.00 0.00 H new ATOM 0 HA ASP B 55 71.417 -19.431 -1.833 1.00 0.00 H new ATOM 0 HB2 ASP B 55 72.763 -21.064 -3.096 1.00 0.00 H new ATOM 0 HB3 ASP B 55 71.134 -21.693 -2.942 1.00 0.00 H new ATOM 2753 N LYS B 56 71.657 -18.133 -4.824 1.00 0.00 N ATOM 2754 CA LYS B 56 72.411 -17.103 -5.590 1.00 0.00 C ATOM 2755 C LYS B 56 72.203 -15.697 -5.013 1.00 0.00 C ATOM 2756 O LYS B 56 73.104 -14.885 -4.995 1.00 0.00 O ATOM 2757 CB LYS B 56 71.938 -17.136 -7.035 1.00 0.00 C ATOM 2758 CG LYS B 56 72.398 -18.443 -7.693 1.00 0.00 C ATOM 2759 CD LYS B 56 71.921 -18.478 -9.149 1.00 0.00 C ATOM 2760 CE LYS B 56 72.376 -19.781 -9.815 1.00 0.00 C ATOM 2761 NZ LYS B 56 73.861 -19.810 -9.891 1.00 0.00 N ATOM 0 H LYS B 56 70.864 -18.546 -5.315 1.00 0.00 H new ATOM 0 HA LYS B 56 73.475 -17.330 -5.524 1.00 0.00 H new ATOM 0 HB2 LYS B 56 70.851 -17.059 -7.075 1.00 0.00 H new ATOM 0 HB3 LYS B 56 72.339 -16.281 -7.580 1.00 0.00 H new ATOM 0 HG2 LYS B 56 73.485 -18.520 -7.653 1.00 0.00 H new ATOM 0 HG3 LYS B 56 71.998 -19.298 -7.147 1.00 0.00 H new ATOM 0 HD2 LYS B 56 70.834 -18.400 -9.187 1.00 0.00 H new ATOM 0 HD3 LYS B 56 72.321 -17.622 -9.693 1.00 0.00 H new ATOM 0 HE2 LYS B 56 72.014 -20.638 -9.246 1.00 0.00 H new ATOM 0 HE3 LYS B 56 71.949 -19.859 -10.815 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 74.159 -20.529 -10.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 74.212 -18.877 -10.189 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 74.252 -20.044 -8.956 1.00 0.00 H new ATOM 2775 N ILE B 57 71.010 -15.392 -4.583 1.00 0.00 N ATOM 2776 CA ILE B 57 70.729 -14.029 -4.057 1.00 0.00 C ATOM 2777 C ILE B 57 71.172 -13.919 -2.602 1.00 0.00 C ATOM 2778 O ILE B 57 71.923 -13.043 -2.227 1.00 0.00 O ATOM 2779 CB ILE B 57 69.223 -13.784 -4.170 1.00 0.00 C ATOM 2780 CG1 ILE B 57 68.849 -13.648 -5.647 1.00 0.00 C ATOM 2781 CG2 ILE B 57 68.825 -12.516 -3.421 1.00 0.00 C ATOM 2782 CD1 ILE B 57 67.327 -13.697 -5.804 1.00 0.00 C ATOM 0 H ILE B 57 70.215 -16.031 -4.574 1.00 0.00 H new ATOM 0 HA ILE B 57 71.279 -13.284 -4.631 1.00 0.00 H new ATOM 0 HB ILE B 57 68.692 -14.626 -3.726 1.00 0.00 H new ATOM 0 HG12 ILE B 57 69.235 -12.709 -6.044 1.00 0.00 H new ATOM 0 HG13 ILE B 57 69.309 -14.451 -6.223 1.00 0.00 H new ATOM 0 HG21 ILE B 57 67.750 -12.361 -3.514 1.00 0.00 H new ATOM 0 HG22 ILE B 57 69.087 -12.618 -2.368 1.00 0.00 H new ATOM 0 HG23 ILE B 57 69.353 -11.662 -3.845 1.00 0.00 H new ATOM 0 HD11 ILE B 57 67.067 -13.600 -6.858 1.00 0.00 H new ATOM 0 HD12 ILE B 57 66.952 -14.647 -5.424 1.00 0.00 H new ATOM 0 HD13 ILE B 57 66.877 -12.879 -5.242 1.00 0.00 H new ATOM 2794 N MET B 58 70.681 -14.790 -1.782 1.00 0.00 N ATOM 2795 CA MET B 58 71.020 -14.751 -0.342 1.00 0.00 C ATOM 2796 C MET B 58 72.529 -14.906 -0.099 1.00 0.00 C ATOM 2797 O MET B 58 73.105 -14.198 0.702 1.00 0.00 O ATOM 2798 CB MET B 58 70.276 -15.878 0.371 1.00 0.00 C ATOM 2799 CG MET B 58 70.694 -15.931 1.847 1.00 0.00 C ATOM 2800 SD MET B 58 72.136 -17.018 2.011 1.00 0.00 S ATOM 2801 CE MET B 58 72.908 -16.233 3.448 1.00 0.00 C ATOM 0 H MET B 58 70.047 -15.542 -2.052 1.00 0.00 H new ATOM 0 HA MET B 58 70.721 -13.778 0.049 1.00 0.00 H new ATOM 0 HB2 MET B 58 69.200 -15.720 0.295 1.00 0.00 H new ATOM 0 HB3 MET B 58 70.493 -16.831 -0.112 1.00 0.00 H new ATOM 0 HG2 MET B 58 70.933 -14.930 2.207 1.00 0.00 H new ATOM 0 HG3 MET B 58 69.871 -16.301 2.459 1.00 0.00 H new ATOM 0 HE1 MET B 58 73.238 -17.000 4.148 1.00 0.00 H new ATOM 0 HE2 MET B 58 73.766 -15.645 3.124 1.00 0.00 H new ATOM 0 HE3 MET B 58 72.185 -15.581 3.938 1.00 0.00 H new ATOM 2811 N LYS B 59 73.176 -15.831 -0.756 1.00 0.00 N ATOM 2812 CA LYS B 59 74.638 -16.005 -0.510 1.00 0.00 C ATOM 2813 C LYS B 59 75.381 -14.783 -1.037 1.00 0.00 C ATOM 2814 O LYS B 59 76.356 -14.340 -0.463 1.00 0.00 O ATOM 2815 CB LYS B 59 75.158 -17.264 -1.213 1.00 0.00 C ATOM 2816 CG LYS B 59 74.480 -18.504 -0.625 1.00 0.00 C ATOM 2817 CD LYS B 59 75.004 -19.760 -1.329 1.00 0.00 C ATOM 2818 CE LYS B 59 74.328 -21.000 -0.739 1.00 0.00 C ATOM 2819 NZ LYS B 59 74.828 -21.229 0.648 1.00 0.00 N ATOM 0 H LYS B 59 72.765 -16.464 -1.442 1.00 0.00 H new ATOM 0 HA LYS B 59 74.807 -16.112 0.561 1.00 0.00 H new ATOM 0 HB2 LYS B 59 74.959 -17.203 -2.283 1.00 0.00 H new ATOM 0 HB3 LYS B 59 76.239 -17.338 -1.093 1.00 0.00 H new ATOM 0 HG2 LYS B 59 74.678 -18.566 0.445 1.00 0.00 H new ATOM 0 HG3 LYS B 59 73.399 -18.431 -0.746 1.00 0.00 H new ATOM 0 HD2 LYS B 59 74.805 -19.699 -2.399 1.00 0.00 H new ATOM 0 HD3 LYS B 59 76.085 -19.832 -1.210 1.00 0.00 H new ATOM 0 HE2 LYS B 59 73.246 -20.867 -0.729 1.00 0.00 H new ATOM 0 HE3 LYS B 59 74.537 -21.871 -1.360 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 74.575 -22.190 0.954 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 75.862 -21.121 0.666 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 74.396 -20.536 1.292 1.00 0.00 H new ATOM 2833 N GLU B 60 74.928 -14.233 -2.128 1.00 0.00 N ATOM 2834 CA GLU B 60 75.604 -13.037 -2.700 1.00 0.00 C ATOM 2835 C GLU B 60 75.029 -11.776 -2.059 1.00 0.00 C ATOM 2836 O GLU B 60 75.621 -10.715 -2.140 1.00 0.00 O ATOM 2837 CB GLU B 60 75.378 -12.989 -4.213 1.00 0.00 C ATOM 2838 CG GLU B 60 75.992 -14.230 -4.871 1.00 0.00 C ATOM 2839 CD GLU B 60 77.510 -14.229 -4.665 1.00 0.00 C ATOM 2840 OE1 GLU B 60 78.066 -13.154 -4.509 1.00 0.00 O ATOM 2841 OE2 GLU B 60 78.088 -15.303 -4.667 1.00 0.00 O ATOM 0 H GLU B 60 74.116 -14.562 -2.650 1.00 0.00 H new ATOM 0 HA GLU B 60 76.674 -13.095 -2.498 1.00 0.00 H new ATOM 0 HB2 GLU B 60 74.311 -12.943 -4.429 1.00 0.00 H new ATOM 0 HB3 GLU B 60 75.827 -12.087 -4.628 1.00 0.00 H new ATOM 0 HG2 GLU B 60 75.558 -15.133 -4.441 1.00 0.00 H new ATOM 0 HG3 GLU B 60 75.760 -14.240 -5.936 1.00 0.00 H new ATOM 2848 N LEU B 61 73.877 -11.882 -1.409 1.00 0.00 N ATOM 2849 CA LEU B 61 73.292 -10.652 -0.764 1.00 0.00 C ATOM 2850 C LEU B 61 73.946 -10.527 0.614 1.00 0.00 C ATOM 2851 O LEU B 61 74.035 -9.455 1.179 1.00 0.00 O ATOM 2852 CB LEU B 61 71.765 -10.709 -0.701 1.00 0.00 C ATOM 2853 CG LEU B 61 71.206 -9.439 -0.050 1.00 0.00 C ATOM 2854 CD1 LEU B 61 71.466 -8.225 -0.951 1.00 0.00 C ATOM 2855 CD2 LEU B 61 69.702 -9.613 0.146 1.00 0.00 C ATOM 0 H LEU B 61 73.335 -12.740 -1.302 1.00 0.00 H new ATOM 0 HA LEU B 61 73.503 -9.762 -1.356 1.00 0.00 H new ATOM 0 HB2 LEU B 61 71.358 -10.819 -1.706 1.00 0.00 H new ATOM 0 HB3 LEU B 61 71.451 -11.584 -0.132 1.00 0.00 H new ATOM 0 HG LEU B 61 71.696 -9.275 0.910 1.00 0.00 H new ATOM 0 HD11 LEU B 61 71.065 -7.329 -0.478 1.00 0.00 H new ATOM 0 HD12 LEU B 61 72.539 -8.107 -1.101 1.00 0.00 H new ATOM 0 HD13 LEU B 61 70.979 -8.376 -1.915 1.00 0.00 H new ATOM 0 HD21 LEU B 61 69.289 -8.717 0.609 1.00 0.00 H new ATOM 0 HD22 LEU B 61 69.225 -9.775 -0.821 1.00 0.00 H new ATOM 0 HD23 LEU B 61 69.516 -10.472 0.790 1.00 0.00 H new ATOM 2867 N ASP B 62 74.522 -11.609 1.097 1.00 0.00 N ATOM 2868 CA ASP B 62 75.306 -11.550 2.370 1.00 0.00 C ATOM 2869 C ASP B 62 76.725 -11.266 1.897 1.00 0.00 C ATOM 2870 O ASP B 62 77.700 -11.812 2.344 1.00 0.00 O ATOM 2871 CB ASP B 62 75.224 -12.867 3.159 1.00 0.00 C ATOM 2872 CG ASP B 62 74.085 -12.796 4.183 1.00 0.00 C ATOM 2873 OD1 ASP B 62 73.722 -11.702 4.566 1.00 0.00 O ATOM 2874 OD2 ASP B 62 73.597 -13.842 4.571 1.00 0.00 O ATOM 0 H ASP B 62 74.480 -12.530 0.660 1.00 0.00 H new ATOM 0 HA ASP B 62 74.929 -10.795 3.060 1.00 0.00 H new ATOM 0 HB2 ASP B 62 75.058 -13.700 2.476 1.00 0.00 H new ATOM 0 HB3 ASP B 62 76.170 -13.055 3.667 1.00 0.00 H new ATOM 2879 N GLU B 63 76.744 -10.405 0.936 1.00 0.00 N ATOM 2880 CA GLU B 63 77.989 -9.959 0.262 1.00 0.00 C ATOM 2881 C GLU B 63 79.142 -9.844 1.264 1.00 0.00 C ATOM 2882 O GLU B 63 80.297 -9.883 0.890 1.00 0.00 O ATOM 2883 CB GLU B 63 77.735 -8.609 -0.384 1.00 0.00 C ATOM 2884 CG GLU B 63 77.478 -7.555 0.694 1.00 0.00 C ATOM 2885 CD GLU B 63 76.932 -6.283 0.043 1.00 0.00 C ATOM 2886 OE1 GLU B 63 77.729 -5.505 -0.454 1.00 0.00 O ATOM 2887 OE2 GLU B 63 75.725 -6.111 0.051 1.00 0.00 O ATOM 0 H GLU B 63 75.901 -9.965 0.567 1.00 0.00 H new ATOM 0 HA GLU B 63 78.269 -10.693 -0.493 1.00 0.00 H new ATOM 0 HB2 GLU B 63 78.593 -8.319 -0.991 1.00 0.00 H new ATOM 0 HB3 GLU B 63 76.878 -8.673 -1.054 1.00 0.00 H new ATOM 0 HG2 GLU B 63 76.767 -7.935 1.427 1.00 0.00 H new ATOM 0 HG3 GLU B 63 78.401 -7.335 1.230 1.00 0.00 H new ATOM 2894 N ASN B 64 78.857 -9.728 2.533 1.00 0.00 N ATOM 2895 CA ASN B 64 79.961 -9.641 3.535 1.00 0.00 C ATOM 2896 C ASN B 64 80.380 -11.067 3.874 1.00 0.00 C ATOM 2897 O ASN B 64 81.206 -11.310 4.731 1.00 0.00 O ATOM 2898 CB ASN B 64 79.467 -8.929 4.797 1.00 0.00 C ATOM 2899 CG ASN B 64 79.236 -7.447 4.495 1.00 0.00 C ATOM 2900 OD1 ASN B 64 79.820 -6.903 3.579 1.00 0.00 O ATOM 2901 ND2 ASN B 64 78.393 -6.770 5.227 1.00 0.00 N ATOM 0 H ASN B 64 77.914 -9.690 2.919 1.00 0.00 H new ATOM 0 HA ASN B 64 80.802 -9.076 3.133 1.00 0.00 H new ATOM 0 HB2 ASN B 64 78.542 -9.387 5.147 1.00 0.00 H new ATOM 0 HB3 ASN B 64 80.199 -9.037 5.598 1.00 0.00 H new ATOM 0 HD21 ASN B 64 78.224 -5.784 5.030 1.00 0.00 H new ATOM 0 HD22 ASN B 64 77.903 -7.228 5.996 1.00 0.00 H new ATOM 2908 N GLY B 65 79.806 -12.006 3.184 1.00 0.00 N ATOM 2909 CA GLY B 65 80.144 -13.439 3.416 1.00 0.00 C ATOM 2910 C GLY B 65 79.858 -13.829 4.874 1.00 0.00 C ATOM 2911 O GLY B 65 80.571 -14.622 5.456 1.00 0.00 O ATOM 0 H GLY B 65 79.107 -11.843 2.459 1.00 0.00 H new ATOM 0 HA2 GLY B 65 79.562 -14.070 2.744 1.00 0.00 H new ATOM 0 HA3 GLY B 65 81.195 -13.613 3.186 1.00 0.00 H new ATOM 2915 N ASP B 66 78.830 -13.276 5.475 1.00 0.00 N ATOM 2916 CA ASP B 66 78.511 -13.615 6.903 1.00 0.00 C ATOM 2917 C ASP B 66 77.362 -14.631 6.968 1.00 0.00 C ATOM 2918 O ASP B 66 77.143 -15.264 7.983 1.00 0.00 O ATOM 2919 CB ASP B 66 78.110 -12.336 7.646 1.00 0.00 C ATOM 2920 CG ASP B 66 76.880 -11.721 6.978 1.00 0.00 C ATOM 2921 OD1 ASP B 66 76.556 -12.139 5.880 1.00 0.00 O ATOM 2922 OD2 ASP B 66 76.285 -10.838 7.574 1.00 0.00 O ATOM 0 H ASP B 66 78.197 -12.605 5.040 1.00 0.00 H new ATOM 0 HA ASP B 66 79.392 -14.055 7.371 1.00 0.00 H new ATOM 0 HB2 ASP B 66 77.895 -12.562 8.690 1.00 0.00 H new ATOM 0 HB3 ASP B 66 78.935 -11.624 7.638 1.00 0.00 H new ATOM 2927 N GLY B 67 76.626 -14.799 5.906 1.00 0.00 N ATOM 2928 CA GLY B 67 75.500 -15.781 5.936 1.00 0.00 C ATOM 2929 C GLY B 67 74.322 -15.173 6.698 1.00 0.00 C ATOM 2930 O GLY B 67 73.193 -15.674 6.657 1.00 0.00 O ATOM 0 H GLY B 67 76.751 -14.304 5.023 1.00 0.00 H new ATOM 0 HA2 GLY B 67 75.198 -16.037 4.920 1.00 0.00 H new ATOM 0 HA3 GLY B 67 75.821 -16.706 6.416 1.00 0.00 H new ATOM 2934 N GLU B 68 74.575 -14.074 7.385 1.00 0.00 N ATOM 2935 CA GLU B 68 73.510 -13.390 8.149 1.00 0.00 C ATOM 2936 C GLU B 68 73.189 -12.119 7.375 1.00 0.00 C ATOM 2937 O GLU B 68 74.079 -11.442 6.896 1.00 0.00 O ATOM 2938 CB GLU B 68 74.053 -13.052 9.533 1.00 0.00 C ATOM 2939 CG GLU B 68 74.250 -14.344 10.324 1.00 0.00 C ATOM 2940 CD GLU B 68 74.826 -14.019 11.702 1.00 0.00 C ATOM 2941 OE1 GLU B 68 75.217 -12.882 11.908 1.00 0.00 O ATOM 2942 OE2 GLU B 68 74.871 -14.914 12.527 1.00 0.00 O ATOM 0 H GLU B 68 75.491 -13.629 7.439 1.00 0.00 H new ATOM 0 HA GLU B 68 72.617 -14.003 8.270 1.00 0.00 H new ATOM 0 HB2 GLU B 68 74.999 -12.517 9.445 1.00 0.00 H new ATOM 0 HB3 GLU B 68 73.361 -12.392 10.057 1.00 0.00 H new ATOM 0 HG2 GLU B 68 73.299 -14.866 10.430 1.00 0.00 H new ATOM 0 HG3 GLU B 68 74.922 -15.013 9.786 1.00 0.00 H new ATOM 2949 N VAL B 69 71.951 -11.808 7.210 1.00 0.00 N ATOM 2950 CA VAL B 69 71.566 -10.611 6.422 1.00 0.00 C ATOM 2951 C VAL B 69 71.177 -9.469 7.349 1.00 0.00 C ATOM 2952 O VAL B 69 70.539 -9.664 8.363 1.00 0.00 O ATOM 2953 CB VAL B 69 70.391 -11.040 5.569 1.00 0.00 C ATOM 2954 CG1 VAL B 69 69.769 -9.840 4.854 1.00 0.00 C ATOM 2955 CG2 VAL B 69 70.901 -12.046 4.531 1.00 0.00 C ATOM 0 H VAL B 69 71.168 -12.338 7.592 1.00 0.00 H new ATOM 0 HA VAL B 69 72.390 -10.249 5.807 1.00 0.00 H new ATOM 0 HB VAL B 69 69.626 -11.489 6.203 1.00 0.00 H new ATOM 0 HG11 VAL B 69 68.927 -10.174 4.248 1.00 0.00 H new ATOM 0 HG12 VAL B 69 69.421 -9.117 5.592 1.00 0.00 H new ATOM 0 HG13 VAL B 69 70.515 -9.372 4.212 1.00 0.00 H new ATOM 0 HG21 VAL B 69 70.072 -12.372 3.902 1.00 0.00 H new ATOM 0 HG22 VAL B 69 71.663 -11.574 3.911 1.00 0.00 H new ATOM 0 HG23 VAL B 69 71.330 -12.909 5.041 1.00 0.00 H new ATOM 2965 N ASP B 70 71.572 -8.270 7.010 1.00 0.00 N ATOM 2966 CA ASP B 70 71.238 -7.100 7.867 1.00 0.00 C ATOM 2967 C ASP B 70 70.006 -6.390 7.298 1.00 0.00 C ATOM 2968 O ASP B 70 70.001 -5.987 6.152 1.00 0.00 O ATOM 2969 CB ASP B 70 72.418 -6.125 7.864 1.00 0.00 C ATOM 2970 CG ASP B 70 73.593 -6.732 8.635 1.00 0.00 C ATOM 2971 OD1 ASP B 70 73.350 -7.587 9.470 1.00 0.00 O ATOM 2972 OD2 ASP B 70 74.714 -6.325 8.380 1.00 0.00 O ATOM 0 H ASP B 70 72.113 -8.052 6.173 1.00 0.00 H new ATOM 0 HA ASP B 70 71.034 -7.437 8.883 1.00 0.00 H new ATOM 0 HB2 ASP B 70 72.718 -5.906 6.839 1.00 0.00 H new ATOM 0 HB3 ASP B 70 72.122 -5.180 8.319 1.00 0.00 H new ATOM 2977 N PHE B 71 68.971 -6.255 8.088 1.00 0.00 N ATOM 2978 CA PHE B 71 67.705 -5.577 7.631 1.00 0.00 C ATOM 2979 C PHE B 71 67.971 -4.544 6.523 1.00 0.00 C ATOM 2980 O PHE B 71 67.179 -4.384 5.619 1.00 0.00 O ATOM 2981 CB PHE B 71 67.094 -4.842 8.817 1.00 0.00 C ATOM 2982 CG PHE B 71 68.058 -3.787 9.297 1.00 0.00 C ATOM 2983 CD1 PHE B 71 68.011 -2.494 8.756 1.00 0.00 C ATOM 2984 CD2 PHE B 71 69.005 -4.104 10.276 1.00 0.00 C ATOM 2985 CE1 PHE B 71 68.914 -1.519 9.201 1.00 0.00 C ATOM 2986 CE2 PHE B 71 69.907 -3.130 10.720 1.00 0.00 C ATOM 2987 CZ PHE B 71 69.861 -1.838 10.182 1.00 0.00 C ATOM 0 H PHE B 71 68.944 -6.591 9.051 1.00 0.00 H new ATOM 0 HA PHE B 71 67.038 -6.344 7.237 1.00 0.00 H new ATOM 0 HB2 PHE B 71 66.149 -4.383 8.528 1.00 0.00 H new ATOM 0 HB3 PHE B 71 66.875 -5.544 9.621 1.00 0.00 H new ATOM 0 HD1 PHE B 71 67.281 -2.250 7.998 1.00 0.00 H new ATOM 0 HD2 PHE B 71 69.040 -5.101 10.690 1.00 0.00 H new ATOM 0 HE1 PHE B 71 68.880 -0.522 8.787 1.00 0.00 H new ATOM 0 HE2 PHE B 71 70.638 -3.375 11.477 1.00 0.00 H new ATOM 0 HZ PHE B 71 70.557 -1.086 10.524 1.00 0.00 H new ATOM 2997 N GLN B 72 69.060 -3.828 6.595 1.00 0.00 N ATOM 2998 CA GLN B 72 69.351 -2.800 5.547 1.00 0.00 C ATOM 2999 C GLN B 72 69.449 -3.468 4.169 1.00 0.00 C ATOM 3000 O GLN B 72 68.958 -2.960 3.184 1.00 0.00 O ATOM 3001 CB GLN B 72 70.679 -2.115 5.879 1.00 0.00 C ATOM 3002 CG GLN B 72 70.998 -1.052 4.825 1.00 0.00 C ATOM 3003 CD GLN B 72 72.274 -0.314 5.226 1.00 0.00 C ATOM 3004 OE1 GLN B 72 72.773 -0.497 6.319 1.00 0.00 O ATOM 3005 NE2 GLN B 72 72.816 0.533 4.394 1.00 0.00 N ATOM 0 H GLN B 72 69.761 -3.908 7.331 1.00 0.00 H new ATOM 0 HA GLN B 72 68.547 -2.064 5.526 1.00 0.00 H new ATOM 0 HB2 GLN B 72 70.624 -1.655 6.866 1.00 0.00 H new ATOM 0 HB3 GLN B 72 71.479 -2.854 5.916 1.00 0.00 H new ATOM 0 HG2 GLN B 72 71.125 -1.518 3.848 1.00 0.00 H new ATOM 0 HG3 GLN B 72 70.169 -0.349 4.738 1.00 0.00 H new ATOM 0 HE21 GLN B 72 72.397 0.686 3.477 1.00 0.00 H new ATOM 0 HE22 GLN B 72 73.659 1.042 4.661 1.00 0.00 H new ATOM 3014 N GLU B 73 70.086 -4.601 4.096 1.00 0.00 N ATOM 3015 CA GLU B 73 70.224 -5.306 2.789 1.00 0.00 C ATOM 3016 C GLU B 73 68.849 -5.785 2.313 1.00 0.00 C ATOM 3017 O GLU B 73 68.523 -5.741 1.143 1.00 0.00 O ATOM 3018 CB GLU B 73 71.117 -6.525 3.003 1.00 0.00 C ATOM 3019 CG GLU B 73 72.550 -6.071 3.285 1.00 0.00 C ATOM 3020 CD GLU B 73 73.410 -7.285 3.636 1.00 0.00 C ATOM 3021 OE1 GLU B 73 72.873 -8.381 3.660 1.00 0.00 O ATOM 3022 OE2 GLU B 73 74.590 -7.099 3.882 1.00 0.00 O ATOM 0 H GLU B 73 70.520 -5.073 4.889 1.00 0.00 H new ATOM 0 HA GLU B 73 70.651 -4.633 2.045 1.00 0.00 H new ATOM 0 HB2 GLU B 73 70.743 -7.120 3.836 1.00 0.00 H new ATOM 0 HB3 GLU B 73 71.095 -7.164 2.120 1.00 0.00 H new ATOM 0 HG2 GLU B 73 72.960 -5.562 2.413 1.00 0.00 H new ATOM 0 HG3 GLU B 73 72.561 -5.355 4.106 1.00 0.00 H new ATOM 3029 N PHE B 74 68.063 -6.266 3.233 1.00 0.00 N ATOM 3030 CA PHE B 74 66.703 -6.791 2.913 1.00 0.00 C ATOM 3031 C PHE B 74 65.795 -5.727 2.284 1.00 0.00 C ATOM 3032 O PHE B 74 65.036 -6.011 1.383 1.00 0.00 O ATOM 3033 CB PHE B 74 66.081 -7.273 4.230 1.00 0.00 C ATOM 3034 CG PHE B 74 64.690 -7.798 3.995 1.00 0.00 C ATOM 3035 CD1 PHE B 74 63.599 -6.927 4.079 1.00 0.00 C ATOM 3036 CD2 PHE B 74 64.486 -9.154 3.711 1.00 0.00 C ATOM 3037 CE1 PHE B 74 62.302 -7.410 3.876 1.00 0.00 C ATOM 3038 CE2 PHE B 74 63.190 -9.637 3.507 1.00 0.00 C ATOM 3039 CZ PHE B 74 62.097 -8.764 3.589 1.00 0.00 C ATOM 0 H PHE B 74 68.312 -6.319 4.221 1.00 0.00 H new ATOM 0 HA PHE B 74 66.798 -7.596 2.184 1.00 0.00 H new ATOM 0 HB2 PHE B 74 66.702 -8.055 4.668 1.00 0.00 H new ATOM 0 HB3 PHE B 74 66.050 -6.452 4.946 1.00 0.00 H new ATOM 0 HD1 PHE B 74 63.758 -5.882 4.300 1.00 0.00 H new ATOM 0 HD2 PHE B 74 65.329 -9.826 3.650 1.00 0.00 H new ATOM 0 HE1 PHE B 74 61.459 -6.738 3.941 1.00 0.00 H new ATOM 0 HE2 PHE B 74 63.031 -10.682 3.286 1.00 0.00 H new ATOM 0 HZ PHE B 74 61.096 -9.136 3.431 1.00 0.00 H new ATOM 3049 N VAL B 75 65.848 -4.518 2.759 1.00 0.00 N ATOM 3050 CA VAL B 75 64.955 -3.457 2.198 1.00 0.00 C ATOM 3051 C VAL B 75 65.398 -3.042 0.781 1.00 0.00 C ATOM 3052 O VAL B 75 64.578 -2.740 -0.066 1.00 0.00 O ATOM 3053 CB VAL B 75 64.938 -2.240 3.150 1.00 0.00 C ATOM 3054 CG1 VAL B 75 66.120 -1.301 2.865 1.00 0.00 C ATOM 3055 CG2 VAL B 75 63.620 -1.470 2.984 1.00 0.00 C ATOM 0 H VAL B 75 66.468 -4.213 3.510 1.00 0.00 H new ATOM 0 HA VAL B 75 63.945 -3.859 2.115 1.00 0.00 H new ATOM 0 HB VAL B 75 65.026 -2.606 4.173 1.00 0.00 H new ATOM 0 HG11 VAL B 75 66.084 -0.453 3.549 1.00 0.00 H new ATOM 0 HG12 VAL B 75 67.056 -1.841 3.006 1.00 0.00 H new ATOM 0 HG13 VAL B 75 66.060 -0.941 1.838 1.00 0.00 H new ATOM 0 HG21 VAL B 75 63.612 -0.613 3.657 1.00 0.00 H new ATOM 0 HG22 VAL B 75 63.528 -1.124 1.955 1.00 0.00 H new ATOM 0 HG23 VAL B 75 62.783 -2.126 3.222 1.00 0.00 H new ATOM 3065 N VAL B 76 66.677 -3.002 0.520 1.00 0.00 N ATOM 3066 CA VAL B 76 67.143 -2.576 -0.836 1.00 0.00 C ATOM 3067 C VAL B 76 66.761 -3.611 -1.908 1.00 0.00 C ATOM 3068 O VAL B 76 66.125 -3.288 -2.887 1.00 0.00 O ATOM 3069 CB VAL B 76 68.669 -2.420 -0.823 1.00 0.00 C ATOM 3070 CG1 VAL B 76 69.184 -2.192 -2.254 1.00 0.00 C ATOM 3071 CG2 VAL B 76 69.047 -1.223 0.052 1.00 0.00 C ATOM 0 H VAL B 76 67.416 -3.243 1.180 1.00 0.00 H new ATOM 0 HA VAL B 76 66.662 -1.628 -1.078 1.00 0.00 H new ATOM 0 HB VAL B 76 69.121 -3.327 -0.421 1.00 0.00 H new ATOM 0 HG11 VAL B 76 70.268 -2.082 -2.237 1.00 0.00 H new ATOM 0 HG12 VAL B 76 68.915 -3.045 -2.878 1.00 0.00 H new ATOM 0 HG13 VAL B 76 68.734 -1.287 -2.663 1.00 0.00 H new ATOM 0 HG21 VAL B 76 70.131 -1.109 0.064 1.00 0.00 H new ATOM 0 HG22 VAL B 76 68.591 -0.319 -0.352 1.00 0.00 H new ATOM 0 HG23 VAL B 76 68.688 -1.387 1.068 1.00 0.00 H new ATOM 3081 N LEU B 77 67.201 -4.833 -1.767 1.00 0.00 N ATOM 3082 CA LEU B 77 66.913 -5.858 -2.823 1.00 0.00 C ATOM 3083 C LEU B 77 65.431 -6.267 -2.871 1.00 0.00 C ATOM 3084 O LEU B 77 64.860 -6.399 -3.936 1.00 0.00 O ATOM 3085 CB LEU B 77 67.801 -7.089 -2.573 1.00 0.00 C ATOM 3086 CG LEU B 77 67.508 -8.203 -3.615 1.00 0.00 C ATOM 3087 CD1 LEU B 77 68.812 -8.904 -4.021 1.00 0.00 C ATOM 3088 CD2 LEU B 77 66.563 -9.262 -3.023 1.00 0.00 C ATOM 0 H LEU B 77 67.745 -5.169 -0.972 1.00 0.00 H new ATOM 0 HA LEU B 77 67.138 -5.414 -3.793 1.00 0.00 H new ATOM 0 HB2 LEU B 77 68.851 -6.802 -2.627 1.00 0.00 H new ATOM 0 HB3 LEU B 77 67.626 -7.471 -1.567 1.00 0.00 H new ATOM 0 HG LEU B 77 67.044 -7.734 -4.482 1.00 0.00 H new ATOM 0 HD11 LEU B 77 68.594 -9.683 -4.752 1.00 0.00 H new ATOM 0 HD12 LEU B 77 69.495 -8.176 -4.459 1.00 0.00 H new ATOM 0 HD13 LEU B 77 69.274 -9.351 -3.141 1.00 0.00 H new ATOM 0 HD21 LEU B 77 66.369 -10.034 -3.768 1.00 0.00 H new ATOM 0 HD22 LEU B 77 67.026 -9.713 -2.145 1.00 0.00 H new ATOM 0 HD23 LEU B 77 65.623 -8.791 -2.736 1.00 0.00 H new ATOM 3100 N VAL B 78 64.811 -6.504 -1.754 1.00 0.00 N ATOM 3101 CA VAL B 78 63.382 -6.945 -1.779 1.00 0.00 C ATOM 3102 C VAL B 78 62.485 -5.834 -2.336 1.00 0.00 C ATOM 3103 O VAL B 78 61.551 -6.090 -3.069 1.00 0.00 O ATOM 3104 CB VAL B 78 62.949 -7.331 -0.356 1.00 0.00 C ATOM 3105 CG1 VAL B 78 61.480 -7.823 -0.328 1.00 0.00 C ATOM 3106 CG2 VAL B 78 63.870 -8.449 0.154 1.00 0.00 C ATOM 0 H VAL B 78 65.224 -6.414 -0.826 1.00 0.00 H new ATOM 0 HA VAL B 78 63.282 -7.812 -2.432 1.00 0.00 H new ATOM 0 HB VAL B 78 63.023 -6.451 0.282 1.00 0.00 H new ATOM 0 HG11 VAL B 78 61.205 -8.088 0.693 1.00 0.00 H new ATOM 0 HG12 VAL B 78 60.824 -7.030 -0.687 1.00 0.00 H new ATOM 0 HG13 VAL B 78 61.377 -8.697 -0.971 1.00 0.00 H new ATOM 0 HG21 VAL B 78 63.573 -8.733 1.164 1.00 0.00 H new ATOM 0 HG22 VAL B 78 63.791 -9.314 -0.504 1.00 0.00 H new ATOM 0 HG23 VAL B 78 64.901 -8.095 0.165 1.00 0.00 H new ATOM 3116 N ALA B 79 62.749 -4.607 -1.988 1.00 0.00 N ATOM 3117 CA ALA B 79 61.894 -3.491 -2.497 1.00 0.00 C ATOM 3118 C ALA B 79 62.270 -3.153 -3.949 1.00 0.00 C ATOM 3119 O ALA B 79 61.464 -2.659 -4.709 1.00 0.00 O ATOM 3120 CB ALA B 79 62.059 -2.261 -1.599 1.00 0.00 C ATOM 0 H ALA B 79 63.515 -4.325 -1.376 1.00 0.00 H new ATOM 0 HA ALA B 79 60.850 -3.803 -2.477 1.00 0.00 H new ATOM 0 HB1 ALA B 79 61.434 -1.450 -1.974 1.00 0.00 H new ATOM 0 HB2 ALA B 79 61.758 -2.510 -0.581 1.00 0.00 H new ATOM 0 HB3 ALA B 79 63.102 -1.946 -1.602 1.00 0.00 H new ATOM 3126 N ALA B 80 63.483 -3.409 -4.341 1.00 0.00 N ATOM 3127 CA ALA B 80 63.900 -3.100 -5.742 1.00 0.00 C ATOM 3128 C ALA B 80 63.086 -3.940 -6.717 1.00 0.00 C ATOM 3129 O ALA B 80 62.929 -3.595 -7.871 1.00 0.00 O ATOM 3130 CB ALA B 80 65.380 -3.446 -5.936 1.00 0.00 C ATOM 0 H ALA B 80 64.209 -3.820 -3.754 1.00 0.00 H new ATOM 0 HA ALA B 80 63.736 -2.038 -5.926 1.00 0.00 H new ATOM 0 HB1 ALA B 80 65.676 -3.218 -6.960 1.00 0.00 H new ATOM 0 HB2 ALA B 80 65.985 -2.859 -5.244 1.00 0.00 H new ATOM 0 HB3 ALA B 80 65.534 -4.507 -5.742 1.00 0.00 H new ATOM 3136 N LEU B 81 62.540 -5.024 -6.254 1.00 0.00 N ATOM 3137 CA LEU B 81 61.711 -5.893 -7.139 1.00 0.00 C ATOM 3138 C LEU B 81 60.231 -5.546 -6.963 1.00 0.00 C ATOM 3139 O LEU B 81 59.421 -5.794 -7.830 1.00 0.00 O ATOM 3140 CB LEU B 81 61.960 -7.354 -6.759 1.00 0.00 C ATOM 3141 CG LEU B 81 63.449 -7.696 -6.957 1.00 0.00 C ATOM 3142 CD1 LEU B 81 63.817 -8.942 -6.146 1.00 0.00 C ATOM 3143 CD2 LEU B 81 63.730 -7.976 -8.438 1.00 0.00 C ATOM 0 H LEU B 81 62.631 -5.352 -5.292 1.00 0.00 H new ATOM 0 HA LEU B 81 61.982 -5.734 -8.183 1.00 0.00 H new ATOM 0 HB2 LEU B 81 61.673 -7.524 -5.721 1.00 0.00 H new ATOM 0 HB3 LEU B 81 61.342 -8.010 -7.372 1.00 0.00 H new ATOM 0 HG LEU B 81 64.044 -6.847 -6.620 1.00 0.00 H new ATOM 0 HD11 LEU B 81 64.872 -9.174 -6.294 1.00 0.00 H new ATOM 0 HD12 LEU B 81 63.631 -8.756 -5.088 1.00 0.00 H new ATOM 0 HD13 LEU B 81 63.210 -9.784 -6.478 1.00 0.00 H new ATOM 0 HD21 LEU B 81 64.785 -8.217 -8.569 1.00 0.00 H new ATOM 0 HD22 LEU B 81 63.122 -8.817 -8.771 1.00 0.00 H new ATOM 0 HD23 LEU B 81 63.483 -7.093 -9.028 1.00 0.00 H new ATOM 3155 N THR B 82 59.869 -5.007 -5.830 1.00 0.00 N ATOM 3156 CA THR B 82 58.428 -4.689 -5.606 1.00 0.00 C ATOM 3157 C THR B 82 58.002 -3.515 -6.512 1.00 0.00 C ATOM 3158 O THR B 82 57.041 -3.608 -7.256 1.00 0.00 O ATOM 3159 CB THR B 82 58.170 -4.406 -4.108 1.00 0.00 C ATOM 3160 OG1 THR B 82 56.866 -4.856 -3.769 1.00 0.00 O ATOM 3161 CG2 THR B 82 58.284 -2.914 -3.772 1.00 0.00 C ATOM 0 H THR B 82 60.497 -4.776 -5.060 1.00 0.00 H new ATOM 0 HA THR B 82 57.814 -5.548 -5.878 1.00 0.00 H new ATOM 0 HB THR B 82 58.930 -4.937 -3.534 1.00 0.00 H new ATOM 0 HG1 THR B 82 56.331 -4.099 -3.453 1.00 0.00 H new ATOM 0 HG21 THR B 82 58.095 -2.765 -2.709 1.00 0.00 H new ATOM 0 HG22 THR B 82 59.287 -2.562 -4.015 1.00 0.00 H new ATOM 0 HG23 THR B 82 57.552 -2.353 -4.353 1.00 0.00 H new ATOM 3169 N VAL B 83 58.718 -2.416 -6.473 1.00 0.00 N ATOM 3170 CA VAL B 83 58.350 -1.260 -7.342 1.00 0.00 C ATOM 3171 C VAL B 83 58.741 -1.560 -8.786 1.00 0.00 C ATOM 3172 O VAL B 83 58.049 -1.203 -9.718 1.00 0.00 O ATOM 3173 CB VAL B 83 59.077 0.024 -6.896 1.00 0.00 C ATOM 3174 CG1 VAL B 83 58.305 1.247 -7.399 1.00 0.00 C ATOM 3175 CG2 VAL B 83 59.178 0.074 -5.372 1.00 0.00 C ATOM 0 H VAL B 83 59.536 -2.273 -5.880 1.00 0.00 H new ATOM 0 HA VAL B 83 57.274 -1.107 -7.259 1.00 0.00 H new ATOM 0 HB VAL B 83 60.083 0.026 -7.316 1.00 0.00 H new ATOM 0 HG11 VAL B 83 58.818 2.156 -7.084 1.00 0.00 H new ATOM 0 HG12 VAL B 83 58.250 1.220 -8.487 1.00 0.00 H new ATOM 0 HG13 VAL B 83 57.297 1.237 -6.984 1.00 0.00 H new ATOM 0 HG21 VAL B 83 59.694 0.986 -5.071 1.00 0.00 H new ATOM 0 HG22 VAL B 83 58.177 0.064 -4.940 1.00 0.00 H new ATOM 0 HG23 VAL B 83 59.735 -0.792 -5.016 1.00 0.00 H new ATOM 3185 N ALA B 84 59.869 -2.182 -8.982 1.00 0.00 N ATOM 3186 CA ALA B 84 60.316 -2.467 -10.362 1.00 0.00 C ATOM 3187 C ALA B 84 59.282 -3.340 -11.069 1.00 0.00 C ATOM 3188 O ALA B 84 59.034 -3.194 -12.249 1.00 0.00 O ATOM 3189 CB ALA B 84 61.657 -3.198 -10.331 1.00 0.00 C ATOM 0 H ALA B 84 60.496 -2.503 -8.244 1.00 0.00 H new ATOM 0 HA ALA B 84 60.428 -1.526 -10.901 1.00 0.00 H new ATOM 0 HB1 ALA B 84 61.982 -3.406 -11.351 1.00 0.00 H new ATOM 0 HB2 ALA B 84 62.400 -2.575 -9.833 1.00 0.00 H new ATOM 0 HB3 ALA B 84 61.548 -4.136 -9.787 1.00 0.00 H new ATOM 3195 N CYS B 85 58.665 -4.237 -10.355 1.00 0.00 N ATOM 3196 CA CYS B 85 57.638 -5.110 -10.984 1.00 0.00 C ATOM 3197 C CYS B 85 56.475 -4.254 -11.475 1.00 0.00 C ATOM 3198 O CYS B 85 55.932 -4.486 -12.533 1.00 0.00 O ATOM 3199 CB CYS B 85 57.126 -6.126 -9.959 1.00 0.00 C ATOM 3200 SG CYS B 85 58.372 -7.417 -9.716 1.00 0.00 S ATOM 0 H CYS B 85 58.828 -4.404 -9.362 1.00 0.00 H new ATOM 0 HA CYS B 85 58.082 -5.640 -11.826 1.00 0.00 H new ATOM 0 HB2 CYS B 85 56.913 -5.628 -9.013 1.00 0.00 H new ATOM 0 HB3 CYS B 85 56.191 -6.568 -10.304 1.00 0.00 H new ATOM 0 HG CYS B 85 59.206 -7.046 -8.790 1.00 0.00 H new ATOM 3206 N ASN B 86 56.090 -3.263 -10.715 1.00 0.00 N ATOM 3207 CA ASN B 86 54.961 -2.391 -11.148 1.00 0.00 C ATOM 3208 C ASN B 86 55.321 -1.702 -12.462 1.00 0.00 C ATOM 3209 O ASN B 86 54.494 -1.535 -13.336 1.00 0.00 O ATOM 3210 CB ASN B 86 54.694 -1.327 -10.083 1.00 0.00 C ATOM 3211 CG ASN B 86 54.090 -1.982 -8.843 1.00 0.00 C ATOM 3212 OD1 ASN B 86 54.494 -1.696 -7.733 1.00 0.00 O ATOM 3213 ND2 ASN B 86 53.127 -2.853 -8.986 1.00 0.00 N ATOM 0 H ASN B 86 56.507 -3.021 -9.816 1.00 0.00 H new ATOM 0 HA ASN B 86 54.070 -3.003 -11.286 1.00 0.00 H new ATOM 0 HB2 ASN B 86 55.622 -0.818 -9.822 1.00 0.00 H new ATOM 0 HB3 ASN B 86 54.015 -0.570 -10.474 1.00 0.00 H new ATOM 0 HD21 ASN B 86 52.713 -3.294 -8.165 1.00 0.00 H new ATOM 0 HD22 ASN B 86 52.789 -3.092 -9.918 1.00 0.00 H new ATOM 3220 N ASN B 87 56.543 -1.272 -12.590 1.00 0.00 N ATOM 3221 CA ASN B 87 56.962 -0.567 -13.832 1.00 0.00 C ATOM 3222 C ASN B 87 56.779 -1.474 -15.052 1.00 0.00 C ATOM 3223 O ASN B 87 56.306 -1.045 -16.085 1.00 0.00 O ATOM 3224 CB ASN B 87 58.431 -0.163 -13.712 1.00 0.00 C ATOM 3225 CG ASN B 87 58.859 0.574 -14.980 1.00 0.00 C ATOM 3226 OD1 ASN B 87 58.033 1.101 -15.699 1.00 0.00 O ATOM 3227 ND2 ASN B 87 60.124 0.633 -15.290 1.00 0.00 N ATOM 0 H ASN B 87 57.273 -1.379 -11.886 1.00 0.00 H new ATOM 0 HA ASN B 87 56.342 0.320 -13.961 1.00 0.00 H new ATOM 0 HB2 ASN B 87 58.574 0.476 -12.841 1.00 0.00 H new ATOM 0 HB3 ASN B 87 59.052 -1.047 -13.564 1.00 0.00 H new ATOM 0 HD21 ASN B 87 60.420 1.121 -16.135 1.00 0.00 H new ATOM 0 HD22 ASN B 87 60.818 0.191 -14.687 1.00 0.00 H new