USER MOD reduce.3.24.130724 H: found=0, std=0, add=1462, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1460 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: C 79 TYR OH : rot -137:sc= -0.426! USER MOD Set 1.2: C 83 TYR OH : rot 47:sc= 0.278 USER MOD Set 2.1: C 39 SER OG : rot -67:sc= -0.832! USER MOD Set 2.2: C 41 THR OG1 : rot 75:sc= -7.59! USER MOD Set 3.1: C 35 HIS : no HE2:sc= -18.5! C(o=-21!,f=-32!) USER MOD Set 3.2: C 78 THR OG1 : rot -83:sc= -2.75! USER MOD Set 4.1: B 6 MET CE :methyl -149:sc= -0.292 (180deg=-1.44!) USER MOD Set 4.2: B 74 THR OG1 : rot 140:sc= -0.103 USER MOD Set 5.1: B 55 LYS NZ :NH3+ -170:sc= 1.32 (180deg=-0.0248) USER MOD Set 5.2: B 60 CYS SG : rot -109:sc= -2.81! USER MOD Set 6.1: B 16 THR OG1 : rot 5:sc= -5.59! USER MOD Set 6.2: C 18 TYR OH : rot 130:sc= -0.768! USER MOD Set 7.1: A 3 THR OG1 : rot -100:sc= -0.177 USER MOD Set 7.2: A 5 GLN : amide:sc= 0.503 K(o=-1.5,f=-3.2) USER MOD Set 7.3: C 108 ASN : amide:sc= -2.11! C(o=-1.5!,f=-9.2!) USER MOD Set 7.4: C 112 CYS SG : rot -38:sc= 0.318 USER MOD Single : A 1 VAL N :NH3+ 140:sc= -0.0884 (180deg=-0.819) USER MOD Single : A 6 HIS : no HD1:sc= -0.148 K(o=-0.15,f=-0.97) USER MOD Single : A 8 CYS SG : rot -34:sc= -9.83! USER MOD Single : A 10 LYS NZ :NH3+ -117:sc= 0.167 (180deg=-0.118) USER MOD Single : A 11 THR OG1 : rot 124:sc= -4.98! USER MOD Single : A 13 ASN : amide:sc= -1.54! C(o=-1.5!,f=-4.5!) USER MOD Single : A 15 HIS : no HD1:sc= -0.0828 X(o=-0.083,f=-0.35) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 HIS :FLIP no HD1:sc= -4.96! C(o=-6.9!,f=-5!) USER MOD Single : B 11 LYS NZ :NH3+ 139:sc= -0.311 (180deg=-1.78!) USER MOD Single : B 12 THR OG1 : rot 60:sc= -2.91! USER MOD Single : B 13 THR OG1 : rot 162:sc= -3.94! USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= 0.149 USER MOD Single : B 22 SER OG : rot -160:sc= -1.22 USER MOD Single : B 23 THR OG1 : rot -37:sc= -5.09! USER MOD Single : B 28 LYS NZ :NH3+ 173:sc= 0.0756 (180deg=0.0663) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 GLN :FLIP amide:sc= -7.92! C(o=-8.7!,f=-7.9!) USER MOD Single : B 45 TYR OH : rot 180:sc= 0 USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.0024) USER MOD Single : B 56 THR OG1 : rot 180:sc= -0.795 USER MOD Single : B 63 THR OG1 : rot -146:sc= 0.0242! USER MOD Single : B 64 SER OG : rot -63:sc= 1.03 USER MOD Single : B 65 GLN : amide:sc= -3.43! C(o=-3.4!,f=-3.9!) USER MOD Single : B 66 THR OG1 : rot 180:sc= -0.636 USER MOD Single : B 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 89 CYS SG : rot 180:sc= -0.0379 USER MOD Single : C 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 23 SER OG : rot 95:sc= -3.89! USER MOD Single : C 24 SER OG : rot 119:sc= 0.321 USER MOD Single : C 27 HIS :FLIP no HD1:sc= -5.08! C(o=-6.4!,f=-5.1!) USER MOD Single : C 32 LYS NZ :NH3+ -162:sc=-0.00836 (180deg=-0.513) USER MOD Single : C 38 THR OG1 : rot 88:sc= -6.33! USER MOD Single : C 43 LYS NZ :NH3+ 177:sc= -4.02! (180deg=-4.32!) USER MOD Single : C 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 58 ASN : amide:sc=-0.00503 X(o=-0.005,f=0) USER MOD Single : C 61 ASN : amide:sc= -2.2! C(o=-2.2!,f=-3.5!) USER MOD Single : C 67 SER OG : rot -148:sc= -2.61! USER MOD Single : C 68 HIS : no HD1:sc= -0.548 X(o=-0.55,f=-0.23) USER MOD Single : C 71 SER OG : rot 180:sc= 0.141 USER MOD Single : C 72 LYS NZ :NH3+ -172:sc= -1.3! (180deg=-1.32!) USER MOD Single : C 74 CYS SG : rot 106:sc= -2.56! USER MOD Single : C 75 MET CE :methyl -175:sc= 0 (180deg=-0.0485) USER MOD Single : C 76 TYR OH : rot 180:sc= -0.0181 USER MOD Single : C 80 LYS NZ :NH3+ 150:sc= -0.182 (180deg=-1.52!) USER MOD Single : C 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 15.321 3.626 16.992 1.00 0.00 N ATOM 2 CA VAL A 1 14.782 4.143 15.701 1.00 0.00 C ATOM 3 C VAL A 1 13.829 5.288 15.919 1.00 0.00 C ATOM 4 O VAL A 1 13.040 5.331 16.842 1.00 0.00 O ATOM 5 CB VAL A 1 14.063 3.023 15.003 1.00 0.00 C ATOM 6 CG1 VAL A 1 12.898 2.575 15.868 1.00 0.00 C ATOM 7 CG2 VAL A 1 13.533 3.543 13.665 1.00 0.00 C ATOM 0 H1 VAL A 1 15.370 2.588 16.957 1.00 0.00 H new ATOM 0 H2 VAL A 1 16.273 4.013 17.150 1.00 0.00 H new ATOM 0 H3 VAL A 1 14.696 3.916 17.770 1.00 0.00 H new ATOM 0 HA VAL A 1 15.612 4.510 15.097 1.00 0.00 H new ATOM 0 HB VAL A 1 14.738 2.184 14.833 1.00 0.00 H new ATOM 0 HG11 VAL A 1 12.368 1.762 15.372 1.00 0.00 H new ATOM 0 HG12 VAL A 1 13.272 2.229 16.832 1.00 0.00 H new ATOM 0 HG13 VAL A 1 12.216 3.412 16.022 1.00 0.00 H new ATOM 0 HG21 VAL A 1 13.008 2.741 13.145 1.00 0.00 H new ATOM 0 HG22 VAL A 1 12.847 4.371 13.843 1.00 0.00 H new ATOM 0 HG23 VAL A 1 14.366 3.888 13.053 1.00 0.00 H new ATOM 19 N ALA A 2 13.939 6.214 15.054 1.00 0.00 N ATOM 20 CA ALA A 2 13.096 7.437 15.110 1.00 0.00 C ATOM 21 C ALA A 2 12.279 7.590 13.828 1.00 0.00 C ATOM 22 O ALA A 2 12.616 7.044 12.799 1.00 0.00 O ATOM 23 CB ALA A 2 14.108 8.564 15.210 1.00 0.00 C ATOM 0 H ALA A 2 14.597 6.191 14.275 1.00 0.00 H new ATOM 0 HA ALA A 2 12.384 7.417 15.935 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.585 9.519 15.257 1.00 0.00 H new ATOM 0 HB2 ALA A 2 14.709 8.434 16.110 1.00 0.00 H new ATOM 0 HB3 ALA A 2 14.757 8.549 14.335 1.00 0.00 H new ATOM 29 N THR A 3 11.220 8.345 13.875 1.00 0.00 N ATOM 30 CA THR A 3 10.408 8.545 12.645 1.00 0.00 C ATOM 31 C THR A 3 11.260 9.262 11.595 1.00 0.00 C ATOM 32 O THR A 3 12.450 9.438 11.764 1.00 0.00 O ATOM 33 CB THR A 3 9.231 9.420 13.077 1.00 0.00 C ATOM 34 OG1 THR A 3 9.267 9.605 14.485 1.00 0.00 O ATOM 35 CG2 THR A 3 7.917 8.741 12.684 1.00 0.00 C ATOM 0 H THR A 3 10.883 8.830 14.706 1.00 0.00 H new ATOM 0 HA THR A 3 10.064 7.608 12.207 1.00 0.00 H new ATOM 0 HB THR A 3 9.300 10.389 12.583 1.00 0.00 H new ATOM 0 HG1 THR A 3 8.629 8.995 14.911 1.00 0.00 H new ATOM 0 HG21 THR A 3 7.078 9.365 12.992 1.00 0.00 H new ATOM 0 HG22 THR A 3 7.888 8.602 11.603 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.847 7.771 13.176 1.00 0.00 H new ATOM 43 N LEU A 4 10.667 9.678 10.515 1.00 0.00 N ATOM 44 CA LEU A 4 11.450 10.385 9.461 1.00 0.00 C ATOM 45 C LEU A 4 11.618 11.860 9.826 1.00 0.00 C ATOM 46 O LEU A 4 12.376 12.581 9.208 1.00 0.00 O ATOM 47 CB LEU A 4 10.631 10.233 8.181 1.00 0.00 C ATOM 48 CG LEU A 4 10.916 8.870 7.565 1.00 0.00 C ATOM 49 CD1 LEU A 4 10.173 7.798 8.362 1.00 0.00 C ATOM 50 CD2 LEU A 4 10.434 8.865 6.114 1.00 0.00 C ATOM 0 H LEU A 4 9.674 9.561 10.314 1.00 0.00 H new ATOM 0 HA LEU A 4 12.453 9.973 9.348 1.00 0.00 H new ATOM 0 HB2 LEU A 4 9.568 10.331 8.401 1.00 0.00 H new ATOM 0 HB3 LEU A 4 10.885 11.025 7.476 1.00 0.00 H new ATOM 0 HG LEU A 4 11.986 8.664 7.590 1.00 0.00 H new ATOM 0 HD11 LEU A 4 10.372 6.818 7.927 1.00 0.00 H new ATOM 0 HD12 LEU A 4 10.515 7.812 9.397 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.102 7.998 8.331 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.635 7.891 5.667 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.362 9.063 6.086 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.960 9.637 5.553 1.00 0.00 H new ATOM 62 N GLN A 5 10.901 12.318 10.815 1.00 0.00 N ATOM 63 CA GLN A 5 11.003 13.753 11.205 1.00 0.00 C ATOM 64 C GLN A 5 12.444 14.097 11.591 1.00 0.00 C ATOM 65 O GLN A 5 12.942 15.159 11.275 1.00 0.00 O ATOM 66 CB GLN A 5 10.080 13.897 12.413 1.00 0.00 C ATOM 67 CG GLN A 5 10.178 15.322 12.956 1.00 0.00 C ATOM 68 CD GLN A 5 10.384 15.280 14.471 1.00 0.00 C ATOM 69 OE1 GLN A 5 11.148 14.478 14.970 1.00 0.00 O ATOM 70 NE2 GLN A 5 9.729 16.115 15.230 1.00 0.00 N ATOM 0 H GLN A 5 10.250 11.762 11.369 1.00 0.00 H new ATOM 0 HA GLN A 5 10.724 14.423 10.392 1.00 0.00 H new ATOM 0 HB2 GLN A 5 9.052 13.674 12.128 1.00 0.00 H new ATOM 0 HB3 GLN A 5 10.359 13.181 13.186 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.006 15.847 12.481 1.00 0.00 H new ATOM 0 HG3 GLN A 5 9.270 15.876 12.717 1.00 0.00 H new ATOM 0 HE21 GLN A 5 9.087 16.789 14.812 1.00 0.00 H new ATOM 0 HE22 GLN A 5 9.859 16.094 16.242 1.00 0.00 H new ATOM 79 N HIS A 6 13.117 13.209 12.267 1.00 0.00 N ATOM 80 CA HIS A 6 14.527 13.490 12.669 1.00 0.00 C ATOM 81 C HIS A 6 15.463 13.333 11.466 1.00 0.00 C ATOM 82 O HIS A 6 16.304 14.171 11.209 1.00 0.00 O ATOM 83 CB HIS A 6 14.849 12.446 13.739 1.00 0.00 C ATOM 84 CG HIS A 6 15.954 12.957 14.622 1.00 0.00 C ATOM 85 ND1 HIS A 6 17.095 13.552 14.109 1.00 0.00 N ATOM 86 CD2 HIS A 6 16.107 12.968 15.986 1.00 0.00 C ATOM 87 CE1 HIS A 6 17.878 13.893 15.150 1.00 0.00 C ATOM 88 NE2 HIS A 6 17.322 13.560 16.317 1.00 0.00 N ATOM 0 H HIS A 6 12.754 12.302 12.559 1.00 0.00 H new ATOM 0 HA HIS A 6 14.656 14.507 13.040 1.00 0.00 H new ATOM 0 HB2 HIS A 6 13.961 12.235 14.335 1.00 0.00 H new ATOM 0 HB3 HIS A 6 15.148 11.509 13.270 1.00 0.00 H new ATOM 0 HD2 HIS A 6 15.393 12.576 16.695 1.00 0.00 H new ATOM 0 HE1 HIS A 6 18.839 14.377 15.053 1.00 0.00 H new ATOM 0 HE2 HIS A 6 17.705 13.708 17.251 1.00 0.00 H new ATOM 96 N LEU A 7 15.325 12.264 10.729 1.00 0.00 N ATOM 97 CA LEU A 7 16.209 12.051 9.546 1.00 0.00 C ATOM 98 C LEU A 7 15.882 13.062 8.443 1.00 0.00 C ATOM 99 O LEU A 7 16.763 13.627 7.826 1.00 0.00 O ATOM 100 CB LEU A 7 15.904 10.629 9.077 1.00 0.00 C ATOM 101 CG LEU A 7 17.168 9.774 9.192 1.00 0.00 C ATOM 102 CD1 LEU A 7 18.218 10.279 8.201 1.00 0.00 C ATOM 103 CD2 LEU A 7 17.722 9.873 10.615 1.00 0.00 C ATOM 0 H LEU A 7 14.638 11.528 10.895 1.00 0.00 H new ATOM 0 HA LEU A 7 17.263 12.185 9.791 1.00 0.00 H new ATOM 0 HB2 LEU A 7 15.105 10.199 9.680 1.00 0.00 H new ATOM 0 HB3 LEU A 7 15.553 10.642 8.045 1.00 0.00 H new ATOM 0 HG LEU A 7 16.926 8.735 8.967 1.00 0.00 H new ATOM 0 HD11 LEU A 7 19.118 9.670 8.283 1.00 0.00 H new ATOM 0 HD12 LEU A 7 17.824 10.210 7.187 1.00 0.00 H new ATOM 0 HD13 LEU A 7 18.461 11.318 8.426 1.00 0.00 H new ATOM 0 HD21 LEU A 7 18.622 9.264 10.698 1.00 0.00 H new ATOM 0 HD22 LEU A 7 17.964 10.912 10.840 1.00 0.00 H new ATOM 0 HD23 LEU A 7 16.975 9.514 11.322 1.00 0.00 H new ATOM 115 N CYS A 8 14.624 13.292 8.185 1.00 0.00 N ATOM 116 CA CYS A 8 14.243 14.257 7.121 1.00 0.00 C ATOM 117 C CYS A 8 14.822 15.643 7.425 1.00 0.00 C ATOM 118 O CYS A 8 15.183 16.385 6.533 1.00 0.00 O ATOM 119 CB CYS A 8 12.717 14.285 7.165 1.00 0.00 C ATOM 120 SG CYS A 8 12.165 15.246 8.598 1.00 0.00 S ATOM 0 H CYS A 8 13.842 12.850 8.669 1.00 0.00 H new ATOM 0 HA CYS A 8 14.623 13.973 6.140 1.00 0.00 H new ATOM 0 HB2 CYS A 8 12.325 14.724 6.248 1.00 0.00 H new ATOM 0 HB3 CYS A 8 12.327 13.269 7.224 1.00 0.00 H new ATOM 0 HG CYS A 8 12.999 15.077 9.581 1.00 0.00 H new ATOM 126 N ARG A 9 14.912 15.997 8.679 1.00 0.00 N ATOM 127 CA ARG A 9 15.464 17.334 9.039 1.00 0.00 C ATOM 128 C ARG A 9 16.946 17.418 8.663 1.00 0.00 C ATOM 129 O ARG A 9 17.399 18.397 8.101 1.00 0.00 O ATOM 130 CB ARG A 9 15.291 17.438 10.555 1.00 0.00 C ATOM 131 CG ARG A 9 13.827 17.738 10.882 1.00 0.00 C ATOM 132 CD ARG A 9 13.602 17.610 12.390 1.00 0.00 C ATOM 133 NE ARG A 9 12.223 18.123 12.617 1.00 0.00 N ATOM 134 CZ ARG A 9 11.816 18.391 13.828 1.00 0.00 C ATOM 135 NH1 ARG A 9 12.615 18.209 14.843 1.00 0.00 N ATOM 136 NH2 ARG A 9 10.606 18.843 14.023 1.00 0.00 N ATOM 0 H ARG A 9 14.627 15.418 9.469 1.00 0.00 H new ATOM 0 HA ARG A 9 14.958 18.143 8.512 1.00 0.00 H new ATOM 0 HB2 ARG A 9 15.598 16.507 11.031 1.00 0.00 H new ATOM 0 HB3 ARG A 9 15.932 18.225 10.952 1.00 0.00 H new ATOM 0 HG2 ARG A 9 13.568 18.743 10.549 1.00 0.00 H new ATOM 0 HG3 ARG A 9 13.175 17.047 10.347 1.00 0.00 H new ATOM 0 HD2 ARG A 9 13.697 16.575 12.717 1.00 0.00 H new ATOM 0 HD3 ARG A 9 14.336 18.190 12.950 1.00 0.00 H new ATOM 0 HE ARG A 9 11.596 18.265 11.825 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.560 17.857 14.691 1.00 0.00 H new ATOM 0 HH12 ARG A 9 12.295 18.419 15.788 1.00 0.00 H new ATOM 0 HH21 ARG A 9 9.981 18.986 13.230 1.00 0.00 H new ATOM 0 HH22 ARG A 9 10.286 19.053 14.969 1.00 0.00 H new ATOM 150 N LYS A 10 17.706 16.402 8.967 1.00 0.00 N ATOM 151 CA LYS A 10 19.158 16.428 8.627 1.00 0.00 C ATOM 152 C LYS A 10 19.346 16.679 7.129 1.00 0.00 C ATOM 153 O LYS A 10 20.197 17.444 6.719 1.00 0.00 O ATOM 154 CB LYS A 10 19.679 15.042 9.009 1.00 0.00 C ATOM 155 CG LYS A 10 21.061 14.827 8.388 1.00 0.00 C ATOM 156 CD LYS A 10 21.951 16.034 8.689 1.00 0.00 C ATOM 157 CE LYS A 10 23.321 15.833 8.039 1.00 0.00 C ATOM 158 NZ LYS A 10 23.129 16.220 6.614 1.00 0.00 N ATOM 0 H LYS A 10 17.385 15.555 9.436 1.00 0.00 H new ATOM 0 HA LYS A 10 19.691 17.222 9.150 1.00 0.00 H new ATOM 0 HB2 LYS A 10 19.738 14.950 10.094 1.00 0.00 H new ATOM 0 HB3 LYS A 10 18.989 14.274 8.661 1.00 0.00 H new ATOM 0 HG2 LYS A 10 21.514 13.920 8.788 1.00 0.00 H new ATOM 0 HG3 LYS A 10 20.970 14.689 7.311 1.00 0.00 H new ATOM 0 HD2 LYS A 10 21.487 16.945 8.310 1.00 0.00 H new ATOM 0 HD3 LYS A 10 22.062 16.157 9.766 1.00 0.00 H new ATOM 0 HE2 LYS A 10 24.080 16.452 8.518 1.00 0.00 H new ATOM 0 HE3 LYS A 10 23.652 14.798 8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 23.298 15.395 6.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 22.156 16.560 6.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 23.798 16.976 6.366 1.00 0.00 H new ATOM 172 N THR A 11 18.559 16.040 6.308 1.00 0.00 N ATOM 173 CA THR A 11 18.694 16.241 4.836 1.00 0.00 C ATOM 174 C THR A 11 18.369 17.692 4.469 1.00 0.00 C ATOM 175 O THR A 11 19.133 18.360 3.802 1.00 0.00 O ATOM 176 CB THR A 11 17.674 15.288 4.213 1.00 0.00 C ATOM 177 OG1 THR A 11 17.886 13.977 4.718 1.00 0.00 O ATOM 178 CG2 THR A 11 17.839 15.286 2.692 1.00 0.00 C ATOM 0 H THR A 11 17.828 15.387 6.592 1.00 0.00 H new ATOM 0 HA THR A 11 19.706 16.044 4.482 1.00 0.00 H new ATOM 0 HB THR A 11 16.666 15.616 4.465 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.058 13.645 5.123 1.00 0.00 H new ATOM 0 HG21 THR A 11 17.112 14.606 2.248 1.00 0.00 H new ATOM 0 HG22 THR A 11 17.677 16.293 2.307 1.00 0.00 H new ATOM 0 HG23 THR A 11 18.846 14.957 2.436 1.00 0.00 H new ATOM 186 N VAL A 12 17.239 18.183 4.900 1.00 0.00 N ATOM 187 CA VAL A 12 16.868 19.591 4.574 1.00 0.00 C ATOM 188 C VAL A 12 17.954 20.551 5.064 1.00 0.00 C ATOM 189 O VAL A 12 18.281 21.520 4.407 1.00 0.00 O ATOM 190 CB VAL A 12 15.556 19.837 5.322 1.00 0.00 C ATOM 191 CG1 VAL A 12 15.266 21.338 5.363 1.00 0.00 C ATOM 192 CG2 VAL A 12 14.415 19.118 4.598 1.00 0.00 C ATOM 0 H VAL A 12 16.558 17.672 5.462 1.00 0.00 H new ATOM 0 HA VAL A 12 16.763 19.753 3.501 1.00 0.00 H new ATOM 0 HB VAL A 12 15.640 19.455 6.339 1.00 0.00 H new ATOM 0 HG11 VAL A 12 14.331 21.514 5.896 1.00 0.00 H new ATOM 0 HG12 VAL A 12 16.079 21.852 5.877 1.00 0.00 H new ATOM 0 HG13 VAL A 12 15.181 21.720 4.346 1.00 0.00 H new ATOM 0 HG21 VAL A 12 13.480 19.292 5.130 1.00 0.00 H new ATOM 0 HG22 VAL A 12 14.331 19.501 3.581 1.00 0.00 H new ATOM 0 HG23 VAL A 12 14.621 18.048 4.567 1.00 0.00 H new ATOM 202 N ASN A 13 18.515 20.291 6.213 1.00 0.00 N ATOM 203 CA ASN A 13 19.580 21.192 6.742 1.00 0.00 C ATOM 204 C ASN A 13 20.831 21.105 5.864 1.00 0.00 C ATOM 205 O ASN A 13 21.498 22.090 5.618 1.00 0.00 O ATOM 206 CB ASN A 13 19.876 20.671 8.149 1.00 0.00 C ATOM 207 CG ASN A 13 21.197 21.260 8.646 1.00 0.00 C ATOM 208 OD1 ASN A 13 22.240 21.015 8.072 1.00 0.00 O ATOM 209 ND2 ASN A 13 21.198 22.034 9.697 1.00 0.00 N ATOM 0 H ASN A 13 18.283 19.496 6.808 1.00 0.00 H new ATOM 0 HA ASN A 13 19.270 22.237 6.750 1.00 0.00 H new ATOM 0 HB2 ASN A 13 19.067 20.944 8.826 1.00 0.00 H new ATOM 0 HB3 ASN A 13 19.932 19.582 8.141 1.00 0.00 H new ATOM 0 HD21 ASN A 13 22.074 22.433 10.036 1.00 0.00 H new ATOM 0 HD22 ASN A 13 20.323 22.240 10.179 1.00 0.00 H new ATOM 216 N GLY A 14 21.154 19.933 5.389 1.00 0.00 N ATOM 217 CA GLY A 14 22.361 19.785 4.529 1.00 0.00 C ATOM 218 C GLY A 14 21.933 19.399 3.111 1.00 0.00 C ATOM 219 O GLY A 14 22.414 18.436 2.548 1.00 0.00 O ATOM 0 H GLY A 14 20.634 19.072 5.560 1.00 0.00 H new ATOM 0 HA2 GLY A 14 22.923 20.719 4.509 1.00 0.00 H new ATOM 0 HA3 GLY A 14 23.023 19.023 4.941 1.00 0.00 H new ATOM 223 N HIS A 15 21.034 20.144 2.530 1.00 0.00 N ATOM 224 CA HIS A 15 20.576 19.819 1.147 1.00 0.00 C ATOM 225 C HIS A 15 21.748 19.915 0.167 1.00 0.00 C ATOM 226 O HIS A 15 22.764 20.515 0.455 1.00 0.00 O ATOM 227 CB HIS A 15 19.517 20.873 0.822 1.00 0.00 C ATOM 228 CG HIS A 15 18.822 20.506 -0.460 1.00 0.00 C ATOM 229 ND1 HIS A 15 18.494 19.197 -0.776 1.00 0.00 N ATOM 230 CD2 HIS A 15 18.389 21.265 -1.519 1.00 0.00 C ATOM 231 CE1 HIS A 15 17.889 19.208 -1.977 1.00 0.00 C ATOM 232 NE2 HIS A 15 17.799 20.445 -2.475 1.00 0.00 N ATOM 0 H HIS A 15 20.596 20.963 2.951 1.00 0.00 H new ATOM 0 HA HIS A 15 20.179 18.807 1.070 1.00 0.00 H new ATOM 0 HB2 HIS A 15 18.793 20.940 1.634 1.00 0.00 H new ATOM 0 HB3 HIS A 15 19.982 21.854 0.728 1.00 0.00 H new ATOM 0 HD2 HIS A 15 18.491 22.337 -1.598 1.00 0.00 H new ATOM 0 HE1 HIS A 15 17.521 18.325 -2.478 1.00 0.00 H new ATOM 0 HE2 HIS A 15 17.387 20.727 -3.364 1.00 0.00 H new ATOM 241 N MET B 1 12.625 -14.554 15.678 1.00 0.00 N ATOM 242 CA MET B 1 12.041 -15.574 14.760 1.00 0.00 C ATOM 243 C MET B 1 10.722 -15.063 14.174 1.00 0.00 C ATOM 244 O MET B 1 9.694 -15.701 14.284 1.00 0.00 O ATOM 245 CB MET B 1 11.798 -16.802 15.637 1.00 0.00 C ATOM 246 CG MET B 1 12.389 -18.039 14.960 1.00 0.00 C ATOM 247 SD MET B 1 11.437 -19.502 15.438 1.00 0.00 S ATOM 248 CE MET B 1 10.776 -19.888 13.798 1.00 0.00 C ATOM 0 H1 MET B 1 13.520 -14.911 16.070 1.00 0.00 H new ATOM 0 H2 MET B 1 12.804 -13.675 15.152 1.00 0.00 H new ATOM 0 H3 MET B 1 11.959 -14.363 16.454 1.00 0.00 H new ATOM 0 HA MET B 1 12.697 -15.797 13.919 1.00 0.00 H new ATOM 0 HB2 MET B 1 12.254 -16.658 16.617 1.00 0.00 H new ATOM 0 HB3 MET B 1 10.729 -16.940 15.800 1.00 0.00 H new ATOM 0 HG2 MET B 1 12.370 -17.918 13.877 1.00 0.00 H new ATOM 0 HG3 MET B 1 13.433 -18.161 15.249 1.00 0.00 H new ATOM 0 HE1 MET B 1 10.146 -20.775 13.859 1.00 0.00 H new ATOM 0 HE2 MET B 1 10.184 -19.047 13.437 1.00 0.00 H new ATOM 0 HE3 MET B 1 11.599 -20.075 13.109 1.00 0.00 H new ATOM 260 N ASP B 2 10.744 -13.917 13.549 1.00 0.00 N ATOM 261 CA ASP B 2 9.491 -13.368 12.956 1.00 0.00 C ATOM 262 C ASP B 2 9.771 -12.795 11.563 1.00 0.00 C ATOM 263 O ASP B 2 10.788 -12.173 11.331 1.00 0.00 O ATOM 264 CB ASP B 2 9.054 -12.258 13.913 1.00 0.00 C ATOM 265 CG ASP B 2 7.538 -12.320 14.106 1.00 0.00 C ATOM 266 OD1 ASP B 2 6.829 -12.196 13.122 1.00 0.00 O ATOM 267 OD2 ASP B 2 7.111 -12.489 15.237 1.00 0.00 O ATOM 0 H ASP B 2 11.574 -13.338 13.423 1.00 0.00 H new ATOM 0 HA ASP B 2 8.722 -14.131 12.837 1.00 0.00 H new ATOM 0 HB2 ASP B 2 9.559 -12.371 14.873 1.00 0.00 H new ATOM 0 HB3 ASP B 2 9.341 -11.285 13.514 1.00 0.00 H new ATOM 272 N VAL B 3 8.878 -13.003 10.635 1.00 0.00 N ATOM 273 CA VAL B 3 9.094 -12.472 9.259 1.00 0.00 C ATOM 274 C VAL B 3 7.879 -11.655 8.811 1.00 0.00 C ATOM 275 O VAL B 3 6.822 -11.720 9.404 1.00 0.00 O ATOM 276 CB VAL B 3 9.265 -13.710 8.377 1.00 0.00 C ATOM 277 CG1 VAL B 3 7.903 -14.371 8.153 1.00 0.00 C ATOM 278 CG2 VAL B 3 9.858 -13.296 7.029 1.00 0.00 C ATOM 0 H VAL B 3 8.008 -13.518 10.770 1.00 0.00 H new ATOM 0 HA VAL B 3 9.959 -11.811 9.203 1.00 0.00 H new ATOM 0 HB VAL B 3 9.934 -14.416 8.868 1.00 0.00 H new ATOM 0 HG11 VAL B 3 8.026 -15.253 7.524 1.00 0.00 H new ATOM 0 HG12 VAL B 3 7.479 -14.666 9.113 1.00 0.00 H new ATOM 0 HG13 VAL B 3 7.233 -13.666 7.662 1.00 0.00 H new ATOM 0 HG21 VAL B 3 9.980 -14.177 6.399 1.00 0.00 H new ATOM 0 HG22 VAL B 3 9.188 -12.590 6.538 1.00 0.00 H new ATOM 0 HG23 VAL B 3 10.828 -12.826 7.187 1.00 0.00 H new ATOM 288 N PHE B 4 8.022 -10.883 7.767 1.00 0.00 N ATOM 289 CA PHE B 4 6.873 -10.065 7.286 1.00 0.00 C ATOM 290 C PHE B 4 6.649 -10.293 5.787 1.00 0.00 C ATOM 291 O PHE B 4 7.561 -10.627 5.058 1.00 0.00 O ATOM 292 CB PHE B 4 7.279 -8.615 7.556 1.00 0.00 C ATOM 293 CG PHE B 4 7.333 -8.375 9.046 1.00 0.00 C ATOM 294 CD1 PHE B 4 8.304 -9.016 9.823 1.00 0.00 C ATOM 295 CD2 PHE B 4 6.411 -7.510 9.649 1.00 0.00 C ATOM 296 CE1 PHE B 4 8.355 -8.792 11.205 1.00 0.00 C ATOM 297 CE2 PHE B 4 6.462 -7.287 11.031 1.00 0.00 C ATOM 298 CZ PHE B 4 7.433 -7.928 11.808 1.00 0.00 C ATOM 0 H PHE B 4 8.882 -10.784 7.228 1.00 0.00 H new ATOM 0 HA PHE B 4 5.941 -10.327 7.787 1.00 0.00 H new ATOM 0 HB2 PHE B 4 8.251 -8.409 7.109 1.00 0.00 H new ATOM 0 HB3 PHE B 4 6.565 -7.934 7.093 1.00 0.00 H new ATOM 0 HD1 PHE B 4 9.014 -9.683 9.357 1.00 0.00 H new ATOM 0 HD2 PHE B 4 5.661 -7.015 9.049 1.00 0.00 H new ATOM 0 HE1 PHE B 4 9.105 -9.286 11.805 1.00 0.00 H new ATOM 0 HE2 PHE B 4 5.752 -6.620 11.497 1.00 0.00 H new ATOM 0 HZ PHE B 4 7.471 -7.756 12.874 1.00 0.00 H new ATOM 308 N LEU B 5 5.441 -10.116 5.325 1.00 0.00 N ATOM 309 CA LEU B 5 5.156 -10.324 3.875 1.00 0.00 C ATOM 310 C LEU B 5 4.361 -9.143 3.318 1.00 0.00 C ATOM 311 O LEU B 5 3.528 -8.569 3.989 1.00 0.00 O ATOM 312 CB LEU B 5 4.320 -11.604 3.820 1.00 0.00 C ATOM 313 CG LEU B 5 4.764 -12.457 2.630 1.00 0.00 C ATOM 314 CD1 LEU B 5 6.216 -12.895 2.827 1.00 0.00 C ATOM 315 CD2 LEU B 5 3.870 -13.694 2.530 1.00 0.00 C ATOM 0 H LEU B 5 4.638 -9.836 5.889 1.00 0.00 H new ATOM 0 HA LEU B 5 6.066 -10.402 3.281 1.00 0.00 H new ATOM 0 HB2 LEU B 5 4.436 -12.166 4.747 1.00 0.00 H new ATOM 0 HB3 LEU B 5 3.263 -11.356 3.728 1.00 0.00 H new ATOM 0 HG LEU B 5 4.683 -11.872 1.714 1.00 0.00 H new ATOM 0 HD11 LEU B 5 6.531 -13.503 1.979 1.00 0.00 H new ATOM 0 HD12 LEU B 5 6.855 -12.015 2.900 1.00 0.00 H new ATOM 0 HD13 LEU B 5 6.298 -13.480 3.743 1.00 0.00 H new ATOM 0 HD21 LEU B 5 4.185 -14.303 1.683 1.00 0.00 H new ATOM 0 HD22 LEU B 5 3.953 -14.278 3.447 1.00 0.00 H new ATOM 0 HD23 LEU B 5 2.835 -13.384 2.389 1.00 0.00 H new ATOM 327 N MET B 6 4.604 -8.777 2.092 1.00 0.00 N ATOM 328 CA MET B 6 3.853 -7.635 1.499 1.00 0.00 C ATOM 329 C MET B 6 3.040 -8.122 0.300 1.00 0.00 C ATOM 330 O MET B 6 3.534 -8.847 -0.540 1.00 0.00 O ATOM 331 CB MET B 6 4.926 -6.641 1.053 1.00 0.00 C ATOM 332 CG MET B 6 4.723 -5.310 1.777 1.00 0.00 C ATOM 333 SD MET B 6 4.215 -4.047 0.585 1.00 0.00 S ATOM 334 CE MET B 6 5.710 -4.081 -0.435 1.00 0.00 C ATOM 0 H MET B 6 5.288 -9.217 1.476 1.00 0.00 H new ATOM 0 HA MET B 6 3.154 -7.183 2.203 1.00 0.00 H new ATOM 0 HB2 MET B 6 5.917 -7.038 1.271 1.00 0.00 H new ATOM 0 HB3 MET B 6 4.873 -6.492 -0.025 1.00 0.00 H new ATOM 0 HG2 MET B 6 3.966 -5.418 2.554 1.00 0.00 H new ATOM 0 HG3 MET B 6 5.646 -5.008 2.272 1.00 0.00 H new ATOM 0 HE1 MET B 6 5.885 -3.091 -0.857 1.00 0.00 H new ATOM 0 HE2 MET B 6 6.563 -4.370 0.179 1.00 0.00 H new ATOM 0 HE3 MET B 6 5.583 -4.802 -1.242 1.00 0.00 H new ATOM 344 N ILE B 7 1.798 -7.728 0.210 1.00 0.00 N ATOM 345 CA ILE B 7 0.966 -8.173 -0.938 1.00 0.00 C ATOM 346 C ILE B 7 0.927 -7.062 -1.976 1.00 0.00 C ATOM 347 O ILE B 7 0.882 -5.893 -1.640 1.00 0.00 O ATOM 348 CB ILE B 7 -0.423 -8.434 -0.348 1.00 0.00 C ATOM 349 CG1 ILE B 7 -0.524 -9.912 0.056 1.00 0.00 C ATOM 350 CG2 ILE B 7 -1.498 -8.097 -1.385 1.00 0.00 C ATOM 351 CD1 ILE B 7 -1.647 -10.598 -0.725 1.00 0.00 C ATOM 0 H ILE B 7 1.328 -7.120 0.880 1.00 0.00 H new ATOM 0 HA ILE B 7 1.353 -9.065 -1.431 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.576 -7.806 0.530 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.423 -10.415 -0.138 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -0.714 -9.992 1.126 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -2.484 -8.284 -0.961 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.417 -7.047 -1.665 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.359 -8.720 -2.269 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -1.708 -11.645 -0.430 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -2.594 -10.104 -0.509 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -1.439 -10.534 -1.793 1.00 0.00 H new ATOM 363 N ARG B 8 0.955 -7.401 -3.231 1.00 0.00 N ATOM 364 CA ARG B 8 0.938 -6.332 -4.254 1.00 0.00 C ATOM 365 C ARG B 8 -0.354 -6.365 -5.069 1.00 0.00 C ATOM 366 O ARG B 8 -0.817 -7.400 -5.518 1.00 0.00 O ATOM 367 CB ARG B 8 2.144 -6.626 -5.143 1.00 0.00 C ATOM 368 CG ARG B 8 3.250 -5.606 -4.864 1.00 0.00 C ATOM 369 CD ARG B 8 4.138 -5.465 -6.102 1.00 0.00 C ATOM 370 NE ARG B 8 4.654 -4.071 -6.051 1.00 0.00 N ATOM 371 CZ ARG B 8 5.523 -3.724 -5.139 1.00 0.00 C ATOM 372 NH1 ARG B 8 5.948 -4.602 -4.271 1.00 0.00 N ATOM 373 NH2 ARG B 8 5.970 -2.499 -5.099 1.00 0.00 N ATOM 0 H ARG B 8 0.988 -8.357 -3.586 1.00 0.00 H new ATOM 0 HA ARG B 8 0.985 -5.340 -3.805 1.00 0.00 H new ATOM 0 HB2 ARG B 8 2.510 -7.635 -4.954 1.00 0.00 H new ATOM 0 HB3 ARG B 8 1.853 -6.584 -6.193 1.00 0.00 H new ATOM 0 HG2 ARG B 8 2.813 -4.642 -4.605 1.00 0.00 H new ATOM 0 HG3 ARG B 8 3.847 -5.925 -4.010 1.00 0.00 H new ATOM 0 HD2 ARG B 8 4.953 -6.188 -6.087 1.00 0.00 H new ATOM 0 HD3 ARG B 8 3.571 -5.643 -7.016 1.00 0.00 H new ATOM 0 HE ARG B 8 4.328 -3.383 -6.730 1.00 0.00 H new ATOM 0 HH11 ARG B 8 5.602 -5.561 -4.304 1.00 0.00 H new ATOM 0 HH12 ARG B 8 6.626 -4.329 -3.560 1.00 0.00 H new ATOM 0 HH21 ARG B 8 5.641 -1.814 -5.779 1.00 0.00 H new ATOM 0 HH22 ARG B 8 6.648 -2.227 -4.388 1.00 0.00 H new ATOM 387 N ARG B 9 -0.908 -5.209 -5.269 1.00 0.00 N ATOM 388 CA ARG B 9 -2.152 -5.056 -6.061 1.00 0.00 C ATOM 389 C ARG B 9 -2.123 -3.665 -6.685 1.00 0.00 C ATOM 390 O ARG B 9 -1.538 -2.753 -6.132 1.00 0.00 O ATOM 391 CB ARG B 9 -3.307 -5.203 -5.067 1.00 0.00 C ATOM 392 CG ARG B 9 -4.627 -4.884 -5.772 1.00 0.00 C ATOM 393 CD ARG B 9 -5.317 -6.188 -6.178 1.00 0.00 C ATOM 394 NE ARG B 9 -6.194 -5.818 -7.324 1.00 0.00 N ATOM 395 CZ ARG B 9 -7.325 -5.201 -7.110 1.00 0.00 C ATOM 396 NH1 ARG B 9 -7.687 -4.901 -5.892 1.00 0.00 N ATOM 397 NH2 ARG B 9 -8.094 -4.882 -8.116 1.00 0.00 N ATOM 0 H ARG B 9 -0.536 -4.333 -4.903 1.00 0.00 H new ATOM 0 HA ARG B 9 -2.259 -5.791 -6.859 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -3.331 -6.217 -4.668 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -3.162 -4.531 -4.221 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -5.275 -4.308 -5.111 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -4.442 -4.269 -6.652 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -4.589 -6.947 -6.466 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -5.898 -6.601 -5.353 1.00 0.00 H new ATOM 0 HE ARG B 9 -5.911 -6.047 -8.277 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -7.086 -5.149 -5.106 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -8.571 -4.419 -5.727 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -7.811 -5.115 -9.068 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -8.978 -4.400 -7.950 1.00 0.00 H new ATOM 411 N HIS B 10 -2.716 -3.467 -7.818 1.00 0.00 N ATOM 412 CA HIS B 10 -2.648 -2.108 -8.413 1.00 0.00 C ATOM 413 C HIS B 10 -3.133 -1.095 -7.426 1.00 0.00 C ATOM 414 O HIS B 10 -4.041 -1.335 -6.664 1.00 0.00 O ATOM 415 CB HIS B 10 -3.641 -2.054 -9.510 1.00 0.00 C ATOM 416 CG HIS B 10 -3.178 -2.835 -10.707 1.00 0.00 C ATOM 417 ND1 HIS B 10 -2.338 -2.512 -11.744 1.00 0.00 N flip ATOM 418 CD2 HIS B 10 -3.597 -4.134 -10.949 1.00 0.00 C flip ATOM 419 CE1 HIS B 10 -2.236 -3.592 -12.618 1.00 0.00 C flip ATOM 420 NE2 HIS B 10 -3.014 -4.541 -12.091 1.00 0.00 N flip ATOM 0 H HIS B 10 -3.234 -4.166 -8.351 1.00 0.00 H new ATOM 0 HA HIS B 10 -1.623 -1.910 -8.728 1.00 0.00 H new ATOM 0 HB2 HIS B 10 -4.594 -2.452 -9.160 1.00 0.00 H new ATOM 0 HB3 HIS B 10 -3.814 -1.016 -9.795 1.00 0.00 H new ATOM 0 HD2 HIS B 10 -4.269 -4.713 -10.333 1.00 0.00 H new ATOM 0 HE1 HIS B 10 -1.654 -3.649 -13.526 1.00 0.00 H new ATOM 0 HE2 HIS B 10 -3.150 -5.463 -12.505 1.00 0.00 H new ATOM 428 N LYS B 11 -2.542 0.035 -7.451 1.00 0.00 N ATOM 429 CA LYS B 11 -2.942 1.115 -6.512 1.00 0.00 C ATOM 430 C LYS B 11 -3.155 0.518 -5.120 1.00 0.00 C ATOM 431 O LYS B 11 -3.087 1.207 -4.121 1.00 0.00 O ATOM 432 CB LYS B 11 -4.256 1.665 -7.071 1.00 0.00 C ATOM 433 CG LYS B 11 -3.979 2.952 -7.851 1.00 0.00 C ATOM 434 CD LYS B 11 -3.993 2.652 -9.351 1.00 0.00 C ATOM 435 CE LYS B 11 -5.427 2.745 -9.876 1.00 0.00 C ATOM 436 NZ LYS B 11 -5.807 4.175 -9.703 1.00 0.00 N ATOM 0 H LYS B 11 -1.783 0.277 -8.088 1.00 0.00 H new ATOM 0 HA LYS B 11 -2.189 1.898 -6.422 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -4.724 0.926 -7.722 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -4.955 1.863 -6.258 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -4.732 3.704 -7.613 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -3.013 3.365 -7.561 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -3.354 3.359 -9.880 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -3.590 1.657 -9.537 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -5.485 2.445 -10.922 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -6.095 2.089 -9.319 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -6.339 4.496 -10.537 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -6.399 4.277 -8.854 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -4.948 4.752 -9.597 1.00 0.00 H new ATOM 450 N THR B 12 -3.424 -0.760 -5.048 1.00 0.00 N ATOM 451 CA THR B 12 -3.655 -1.390 -3.705 1.00 0.00 C ATOM 452 C THR B 12 -2.418 -2.156 -3.202 1.00 0.00 C ATOM 453 O THR B 12 -1.997 -3.136 -3.780 1.00 0.00 O ATOM 454 CB THR B 12 -4.825 -2.355 -3.893 1.00 0.00 C ATOM 455 OG1 THR B 12 -5.358 -2.220 -5.202 1.00 0.00 O ATOM 456 CG2 THR B 12 -5.912 -2.045 -2.864 1.00 0.00 C ATOM 0 H THR B 12 -3.494 -1.391 -5.847 1.00 0.00 H new ATOM 0 HA THR B 12 -3.862 -0.623 -2.958 1.00 0.00 H new ATOM 0 HB THR B 12 -4.472 -3.377 -3.755 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.661 -2.421 -5.861 1.00 0.00 H new ATOM 0 HG21 THR B 12 -6.747 -2.733 -2.998 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.505 -2.159 -1.859 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.260 -1.021 -3.000 1.00 0.00 H new ATOM 464 N THR B 13 -1.857 -1.717 -2.107 1.00 0.00 N ATOM 465 CA THR B 13 -0.670 -2.410 -1.509 1.00 0.00 C ATOM 466 C THR B 13 -0.911 -2.618 -0.011 1.00 0.00 C ATOM 467 O THR B 13 -1.287 -1.700 0.691 1.00 0.00 O ATOM 468 CB THR B 13 0.506 -1.461 -1.743 1.00 0.00 C ATOM 469 OG1 THR B 13 0.294 -0.259 -1.017 1.00 0.00 O ATOM 470 CG2 THR B 13 0.621 -1.146 -3.235 1.00 0.00 C ATOM 0 H THR B 13 -2.173 -0.896 -1.591 1.00 0.00 H new ATOM 0 HA THR B 13 -0.484 -3.389 -1.950 1.00 0.00 H new ATOM 0 HB THR B 13 1.428 -1.933 -1.403 1.00 0.00 H new ATOM 0 HG1 THR B 13 1.143 0.222 -0.926 1.00 0.00 H new ATOM 0 HG21 THR B 13 1.460 -0.470 -3.400 1.00 0.00 H new ATOM 0 HG22 THR B 13 0.785 -2.070 -3.790 1.00 0.00 H new ATOM 0 HG23 THR B 13 -0.299 -0.674 -3.579 1.00 0.00 H new ATOM 478 N ILE B 14 -0.711 -3.806 0.495 1.00 0.00 N ATOM 479 CA ILE B 14 -0.951 -4.024 1.953 1.00 0.00 C ATOM 480 C ILE B 14 0.328 -4.432 2.675 1.00 0.00 C ATOM 481 O ILE B 14 1.015 -5.349 2.273 1.00 0.00 O ATOM 482 CB ILE B 14 -1.980 -5.166 2.043 1.00 0.00 C ATOM 483 CG1 ILE B 14 -2.956 -4.883 3.187 1.00 0.00 C ATOM 484 CG2 ILE B 14 -1.268 -6.498 2.328 1.00 0.00 C ATOM 485 CD1 ILE B 14 -2.175 -4.742 4.495 1.00 0.00 C ATOM 0 H ILE B 14 -0.397 -4.624 -0.028 1.00 0.00 H new ATOM 0 HA ILE B 14 -1.303 -3.107 2.425 1.00 0.00 H new ATOM 0 HB ILE B 14 -2.515 -5.231 1.095 1.00 0.00 H new ATOM 0 HG12 ILE B 14 -3.517 -3.970 2.985 1.00 0.00 H new ATOM 0 HG13 ILE B 14 -3.682 -5.692 3.269 1.00 0.00 H new ATOM 0 HG21 ILE B 14 -2.005 -7.299 2.390 1.00 0.00 H new ATOM 0 HG22 ILE B 14 -0.564 -6.714 1.524 1.00 0.00 H new ATOM 0 HG23 ILE B 14 -0.729 -6.428 3.273 1.00 0.00 H new ATOM 0 HD11 ILE B 14 -2.867 -4.540 5.312 1.00 0.00 H new ATOM 0 HD12 ILE B 14 -1.634 -5.667 4.697 1.00 0.00 H new ATOM 0 HD13 ILE B 14 -1.466 -3.919 4.409 1.00 0.00 H new ATOM 497 N PHE B 15 0.626 -3.802 3.773 1.00 0.00 N ATOM 498 CA PHE B 15 1.821 -4.226 4.538 1.00 0.00 C ATOM 499 C PHE B 15 1.360 -5.377 5.423 1.00 0.00 C ATOM 500 O PHE B 15 0.528 -5.210 6.292 1.00 0.00 O ATOM 501 CB PHE B 15 2.235 -3.011 5.369 1.00 0.00 C ATOM 502 CG PHE B 15 3.005 -2.048 4.501 1.00 0.00 C ATOM 503 CD1 PHE B 15 4.343 -2.311 4.181 1.00 0.00 C ATOM 504 CD2 PHE B 15 2.383 -0.892 4.014 1.00 0.00 C ATOM 505 CE1 PHE B 15 5.058 -1.417 3.375 1.00 0.00 C ATOM 506 CE2 PHE B 15 3.099 0.001 3.208 1.00 0.00 C ATOM 507 CZ PHE B 15 4.437 -0.262 2.888 1.00 0.00 C ATOM 0 H PHE B 15 0.100 -3.022 4.168 1.00 0.00 H new ATOM 0 HA PHE B 15 2.663 -4.553 3.928 1.00 0.00 H new ATOM 0 HB2 PHE B 15 1.353 -2.521 5.781 1.00 0.00 H new ATOM 0 HB3 PHE B 15 2.848 -3.326 6.213 1.00 0.00 H new ATOM 0 HD1 PHE B 15 4.823 -3.203 4.556 1.00 0.00 H new ATOM 0 HD2 PHE B 15 1.351 -0.689 4.260 1.00 0.00 H new ATOM 0 HE1 PHE B 15 6.090 -1.619 3.129 1.00 0.00 H new ATOM 0 HE2 PHE B 15 2.620 0.893 2.833 1.00 0.00 H new ATOM 0 HZ PHE B 15 4.989 0.427 2.266 1.00 0.00 H new ATOM 517 N THR B 16 1.840 -6.557 5.171 1.00 0.00 N ATOM 518 CA THR B 16 1.364 -7.723 5.957 1.00 0.00 C ATOM 519 C THR B 16 2.518 -8.427 6.680 1.00 0.00 C ATOM 520 O THR B 16 3.620 -8.516 6.182 1.00 0.00 O ATOM 521 CB THR B 16 0.711 -8.630 4.908 1.00 0.00 C ATOM 522 OG1 THR B 16 -0.692 -8.654 5.125 1.00 0.00 O ATOM 523 CG2 THR B 16 1.265 -10.051 5.005 1.00 0.00 C ATOM 0 H THR B 16 2.539 -6.765 4.458 1.00 0.00 H new ATOM 0 HA THR B 16 0.672 -7.439 6.750 1.00 0.00 H new ATOM 0 HB THR B 16 0.931 -8.239 3.915 1.00 0.00 H new ATOM 0 HG1 THR B 16 -0.923 -8.029 5.843 1.00 0.00 H new ATOM 0 HG21 THR B 16 0.789 -10.679 4.252 1.00 0.00 H new ATOM 0 HG22 THR B 16 2.342 -10.034 4.836 1.00 0.00 H new ATOM 0 HG23 THR B 16 1.060 -10.454 5.997 1.00 0.00 H new ATOM 531 N ASP B 17 2.262 -8.934 7.855 1.00 0.00 N ATOM 532 CA ASP B 17 3.335 -9.641 8.611 1.00 0.00 C ATOM 533 C ASP B 17 2.888 -11.074 8.913 1.00 0.00 C ATOM 534 O ASP B 17 1.727 -11.336 9.154 1.00 0.00 O ATOM 535 CB ASP B 17 3.501 -8.843 9.905 1.00 0.00 C ATOM 536 CG ASP B 17 4.455 -9.586 10.842 1.00 0.00 C ATOM 537 OD1 ASP B 17 5.050 -10.555 10.402 1.00 0.00 O ATOM 538 OD2 ASP B 17 4.572 -9.174 11.984 1.00 0.00 O ATOM 0 H ASP B 17 1.357 -8.889 8.324 1.00 0.00 H new ATOM 0 HA ASP B 17 4.271 -9.703 8.055 1.00 0.00 H new ATOM 0 HB2 ASP B 17 3.891 -7.849 9.685 1.00 0.00 H new ATOM 0 HB3 ASP B 17 2.533 -8.706 10.387 1.00 0.00 H new ATOM 543 N ALA B 18 3.801 -12.006 8.885 1.00 0.00 N ATOM 544 CA ALA B 18 3.429 -13.426 9.152 1.00 0.00 C ATOM 545 C ALA B 18 4.597 -14.167 9.804 1.00 0.00 C ATOM 546 O ALA B 18 5.685 -13.642 9.932 1.00 0.00 O ATOM 547 CB ALA B 18 3.118 -14.019 7.778 1.00 0.00 C ATOM 0 H ALA B 18 4.789 -11.846 8.689 1.00 0.00 H new ATOM 0 HA ALA B 18 2.582 -13.509 9.833 1.00 0.00 H new ATOM 0 HB1 ALA B 18 2.835 -15.066 7.889 1.00 0.00 H new ATOM 0 HB2 ALA B 18 2.296 -13.467 7.321 1.00 0.00 H new ATOM 0 HB3 ALA B 18 4.001 -13.947 7.143 1.00 0.00 H new ATOM 553 N LYS B 19 4.381 -15.384 10.221 1.00 0.00 N ATOM 554 CA LYS B 19 5.483 -16.153 10.867 1.00 0.00 C ATOM 555 C LYS B 19 6.272 -16.931 9.812 1.00 0.00 C ATOM 556 O LYS B 19 5.756 -17.291 8.773 1.00 0.00 O ATOM 557 CB LYS B 19 4.783 -17.112 11.830 1.00 0.00 C ATOM 558 CG LYS B 19 4.672 -16.462 13.210 1.00 0.00 C ATOM 559 CD LYS B 19 3.230 -16.017 13.451 1.00 0.00 C ATOM 560 CE LYS B 19 2.720 -16.624 14.760 1.00 0.00 C ATOM 561 NZ LYS B 19 1.886 -15.556 15.379 1.00 0.00 N ATOM 0 H LYS B 19 3.492 -15.878 10.143 1.00 0.00 H new ATOM 0 HA LYS B 19 6.194 -15.506 11.381 1.00 0.00 H new ATOM 0 HB2 LYS B 19 3.791 -17.362 11.454 1.00 0.00 H new ATOM 0 HB3 LYS B 19 5.342 -18.045 11.900 1.00 0.00 H new ATOM 0 HG2 LYS B 19 4.979 -17.168 13.982 1.00 0.00 H new ATOM 0 HG3 LYS B 19 5.343 -15.606 13.275 1.00 0.00 H new ATOM 0 HD2 LYS B 19 3.177 -14.929 13.497 1.00 0.00 H new ATOM 0 HD3 LYS B 19 2.598 -16.332 12.621 1.00 0.00 H new ATOM 0 HE2 LYS B 19 2.135 -17.525 14.576 1.00 0.00 H new ATOM 0 HE3 LYS B 19 3.546 -16.908 15.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 1.500 -15.897 16.282 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 2.471 -14.713 15.549 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 1.104 -15.311 14.739 1.00 0.00 H new ATOM 575 N GLU B 20 7.524 -17.185 10.072 1.00 0.00 N ATOM 576 CA GLU B 20 8.359 -17.932 9.090 1.00 0.00 C ATOM 577 C GLU B 20 7.617 -19.178 8.612 1.00 0.00 C ATOM 578 O GLU B 20 7.814 -19.645 7.508 1.00 0.00 O ATOM 579 CB GLU B 20 9.622 -18.321 9.860 1.00 0.00 C ATOM 580 CG GLU B 20 10.683 -17.234 9.682 1.00 0.00 C ATOM 581 CD GLU B 20 10.461 -16.131 10.719 1.00 0.00 C ATOM 582 OE1 GLU B 20 9.359 -15.611 10.773 1.00 0.00 O ATOM 583 OE2 GLU B 20 11.397 -15.826 11.439 1.00 0.00 O ATOM 0 H GLU B 20 8.007 -16.906 10.926 1.00 0.00 H new ATOM 0 HA GLU B 20 8.589 -17.339 8.205 1.00 0.00 H new ATOM 0 HB2 GLU B 20 9.391 -18.449 10.918 1.00 0.00 H new ATOM 0 HB3 GLU B 20 10.001 -19.277 9.499 1.00 0.00 H new ATOM 0 HG2 GLU B 20 11.679 -17.661 9.797 1.00 0.00 H new ATOM 0 HG3 GLU B 20 10.628 -16.818 8.676 1.00 0.00 H new ATOM 590 N SER B 21 6.760 -19.719 9.432 1.00 0.00 N ATOM 591 CA SER B 21 6.005 -20.931 9.015 1.00 0.00 C ATOM 592 C SER B 21 4.680 -20.523 8.376 1.00 0.00 C ATOM 593 O SER B 21 3.858 -21.351 8.039 1.00 0.00 O ATOM 594 CB SER B 21 5.769 -21.723 10.299 1.00 0.00 C ATOM 595 OG SER B 21 5.933 -20.863 11.419 1.00 0.00 O ATOM 0 H SER B 21 6.551 -19.375 10.369 1.00 0.00 H new ATOM 0 HA SER B 21 6.546 -21.523 8.277 1.00 0.00 H new ATOM 0 HB2 SER B 21 4.766 -22.150 10.297 1.00 0.00 H new ATOM 0 HB3 SER B 21 6.469 -22.556 10.360 1.00 0.00 H new ATOM 0 HG SER B 21 5.780 -21.368 12.245 1.00 0.00 H new ATOM 601 N SER B 22 4.475 -19.251 8.193 1.00 0.00 N ATOM 602 CA SER B 22 3.214 -18.785 7.554 1.00 0.00 C ATOM 603 C SER B 22 3.512 -18.370 6.113 1.00 0.00 C ATOM 604 O SER B 22 3.812 -19.194 5.275 1.00 0.00 O ATOM 605 CB SER B 22 2.762 -17.587 8.388 1.00 0.00 C ATOM 606 OG SER B 22 2.582 -17.995 9.738 1.00 0.00 O ATOM 0 H SER B 22 5.126 -18.512 8.458 1.00 0.00 H new ATOM 0 HA SER B 22 2.442 -19.553 7.520 1.00 0.00 H new ATOM 0 HB2 SER B 22 3.504 -16.790 8.333 1.00 0.00 H new ATOM 0 HB3 SER B 22 1.831 -17.183 7.991 1.00 0.00 H new ATOM 0 HG SER B 22 2.007 -17.350 10.201 1.00 0.00 H new ATOM 612 N THR B 23 3.461 -17.102 5.822 1.00 0.00 N ATOM 613 CA THR B 23 3.770 -16.636 4.438 1.00 0.00 C ATOM 614 C THR B 23 2.884 -17.331 3.399 1.00 0.00 C ATOM 615 O THR B 23 3.139 -17.265 2.213 1.00 0.00 O ATOM 616 CB THR B 23 5.241 -16.988 4.227 1.00 0.00 C ATOM 617 OG1 THR B 23 5.373 -18.373 3.935 1.00 0.00 O ATOM 618 CG2 THR B 23 6.019 -16.648 5.497 1.00 0.00 C ATOM 0 H THR B 23 3.218 -16.364 6.483 1.00 0.00 H new ATOM 0 HA THR B 23 3.579 -15.569 4.319 1.00 0.00 H new ATOM 0 HB THR B 23 5.637 -16.416 3.388 1.00 0.00 H new ATOM 0 HG1 THR B 23 4.728 -18.883 4.469 1.00 0.00 H new ATOM 0 HG21 THR B 23 7.071 -16.896 5.356 1.00 0.00 H new ATOM 0 HG22 THR B 23 5.922 -15.583 5.709 1.00 0.00 H new ATOM 0 HG23 THR B 23 5.620 -17.222 6.333 1.00 0.00 H new ATOM 626 N VAL B 24 1.839 -17.985 3.826 1.00 0.00 N ATOM 627 CA VAL B 24 0.939 -18.666 2.851 1.00 0.00 C ATOM 628 C VAL B 24 -0.457 -18.840 3.455 1.00 0.00 C ATOM 629 O VAL B 24 -1.388 -18.148 3.094 1.00 0.00 O ATOM 630 CB VAL B 24 1.582 -20.025 2.566 1.00 0.00 C ATOM 631 CG1 VAL B 24 2.597 -19.879 1.432 1.00 0.00 C ATOM 632 CG2 VAL B 24 2.294 -20.544 3.819 1.00 0.00 C ATOM 0 H VAL B 24 1.569 -18.078 4.805 1.00 0.00 H new ATOM 0 HA VAL B 24 0.820 -18.087 1.935 1.00 0.00 H new ATOM 0 HB VAL B 24 0.805 -20.733 2.278 1.00 0.00 H new ATOM 0 HG11 VAL B 24 3.056 -20.846 1.228 1.00 0.00 H new ATOM 0 HG12 VAL B 24 2.092 -19.521 0.535 1.00 0.00 H new ATOM 0 HG13 VAL B 24 3.368 -19.166 1.723 1.00 0.00 H new ATOM 0 HG21 VAL B 24 2.748 -21.512 3.605 1.00 0.00 H new ATOM 0 HG22 VAL B 24 3.069 -19.837 4.116 1.00 0.00 H new ATOM 0 HG23 VAL B 24 1.572 -20.653 4.629 1.00 0.00 H new ATOM 642 N PHE B 25 -0.613 -19.752 4.375 1.00 0.00 N ATOM 643 CA PHE B 25 -1.952 -19.954 4.997 1.00 0.00 C ATOM 644 C PHE B 25 -2.469 -18.625 5.555 1.00 0.00 C ATOM 645 O PHE B 25 -3.545 -18.175 5.218 1.00 0.00 O ATOM 646 CB PHE B 25 -1.716 -20.957 6.126 1.00 0.00 C ATOM 647 CG PHE B 25 -1.677 -22.356 5.558 1.00 0.00 C ATOM 648 CD1 PHE B 25 -2.644 -22.761 4.630 1.00 0.00 C ATOM 649 CD2 PHE B 25 -0.675 -23.246 5.960 1.00 0.00 C ATOM 650 CE1 PHE B 25 -2.607 -24.058 4.103 1.00 0.00 C ATOM 651 CE2 PHE B 25 -0.638 -24.542 5.433 1.00 0.00 C ATOM 652 CZ PHE B 25 -1.605 -24.949 4.505 1.00 0.00 C ATOM 0 H PHE B 25 0.126 -20.364 4.722 1.00 0.00 H new ATOM 0 HA PHE B 25 -2.695 -20.314 4.285 1.00 0.00 H new ATOM 0 HB2 PHE B 25 -0.778 -20.734 6.635 1.00 0.00 H new ATOM 0 HB3 PHE B 25 -2.509 -20.877 6.869 1.00 0.00 H new ATOM 0 HD1 PHE B 25 -3.418 -22.074 4.321 1.00 0.00 H new ATOM 0 HD2 PHE B 25 0.070 -22.933 6.677 1.00 0.00 H new ATOM 0 HE1 PHE B 25 -3.352 -24.371 3.386 1.00 0.00 H new ATOM 0 HE2 PHE B 25 0.136 -25.228 5.742 1.00 0.00 H new ATOM 0 HZ PHE B 25 -1.578 -25.950 4.100 1.00 0.00 H new ATOM 662 N GLU B 26 -1.703 -17.992 6.401 1.00 0.00 N ATOM 663 CA GLU B 26 -2.142 -16.689 6.976 1.00 0.00 C ATOM 664 C GLU B 26 -2.248 -15.634 5.870 1.00 0.00 C ATOM 665 O GLU B 26 -3.104 -14.773 5.900 1.00 0.00 O ATOM 666 CB GLU B 26 -1.051 -16.310 7.979 1.00 0.00 C ATOM 667 CG GLU B 26 -1.372 -14.946 8.592 1.00 0.00 C ATOM 668 CD GLU B 26 -0.403 -14.663 9.743 1.00 0.00 C ATOM 669 OE1 GLU B 26 0.750 -15.039 9.626 1.00 0.00 O ATOM 670 OE2 GLU B 26 -0.834 -14.074 10.721 1.00 0.00 O ATOM 0 H GLU B 26 -0.791 -18.321 6.719 1.00 0.00 H new ATOM 0 HA GLU B 26 -3.122 -16.754 7.448 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -0.984 -17.065 8.762 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -0.081 -16.278 7.483 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -1.291 -14.167 7.834 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -2.399 -14.931 8.956 1.00 0.00 H new ATOM 677 N LEU B 27 -1.381 -15.695 4.896 1.00 0.00 N ATOM 678 CA LEU B 27 -1.429 -14.695 3.789 1.00 0.00 C ATOM 679 C LEU B 27 -2.792 -14.738 3.091 1.00 0.00 C ATOM 680 O LEU B 27 -3.391 -13.716 2.819 1.00 0.00 O ATOM 681 CB LEU B 27 -0.321 -15.119 2.824 1.00 0.00 C ATOM 682 CG LEU B 27 0.117 -13.913 1.991 1.00 0.00 C ATOM 683 CD1 LEU B 27 0.817 -12.897 2.893 1.00 0.00 C ATOM 684 CD2 LEU B 27 1.084 -14.374 0.898 1.00 0.00 C ATOM 0 H LEU B 27 -0.642 -16.393 4.818 1.00 0.00 H new ATOM 0 HA LEU B 27 -1.290 -13.676 4.150 1.00 0.00 H new ATOM 0 HB2 LEU B 27 0.527 -15.518 3.380 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -0.678 -15.916 2.171 1.00 0.00 H new ATOM 0 HG LEU B 27 -0.758 -13.451 1.533 1.00 0.00 H new ATOM 0 HD11 LEU B 27 1.129 -12.038 2.299 1.00 0.00 H new ATOM 0 HD12 LEU B 27 0.130 -12.569 3.673 1.00 0.00 H new ATOM 0 HD13 LEU B 27 1.692 -13.359 3.351 1.00 0.00 H new ATOM 0 HD21 LEU B 27 1.397 -13.516 0.303 1.00 0.00 H new ATOM 0 HD22 LEU B 27 1.958 -14.836 1.357 1.00 0.00 H new ATOM 0 HD23 LEU B 27 0.586 -15.099 0.254 1.00 0.00 H new ATOM 696 N LYS B 28 -3.289 -15.909 2.803 1.00 0.00 N ATOM 697 CA LYS B 28 -4.615 -16.008 2.126 1.00 0.00 C ATOM 698 C LYS B 28 -5.678 -15.298 2.967 1.00 0.00 C ATOM 699 O LYS B 28 -6.571 -14.658 2.447 1.00 0.00 O ATOM 700 CB LYS B 28 -4.906 -17.507 2.040 1.00 0.00 C ATOM 701 CG LYS B 28 -6.369 -17.720 1.647 1.00 0.00 C ATOM 702 CD LYS B 28 -6.525 -19.089 0.980 1.00 0.00 C ATOM 703 CE LYS B 28 -6.264 -18.959 -0.522 1.00 0.00 C ATOM 704 NZ LYS B 28 -5.493 -20.179 -0.886 1.00 0.00 N ATOM 0 H LYS B 28 -2.837 -16.800 3.006 1.00 0.00 H new ATOM 0 HA LYS B 28 -4.619 -15.540 1.141 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -4.249 -17.974 1.306 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -4.703 -17.984 2.999 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -7.006 -17.659 2.529 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -6.692 -16.933 0.966 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -5.827 -19.801 1.421 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -7.529 -19.477 1.153 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -7.198 -18.901 -1.081 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -5.700 -18.054 -0.748 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -5.378 -20.222 -1.919 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -4.557 -20.145 -0.435 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -6.005 -21.023 -0.559 1.00 0.00 H new ATOM 718 N ARG B 29 -5.583 -15.403 4.263 1.00 0.00 N ATOM 719 CA ARG B 29 -6.580 -14.732 5.146 1.00 0.00 C ATOM 720 C ARG B 29 -6.448 -13.211 5.027 1.00 0.00 C ATOM 721 O ARG B 29 -7.425 -12.489 5.052 1.00 0.00 O ATOM 722 CB ARG B 29 -6.229 -15.194 6.561 1.00 0.00 C ATOM 723 CG ARG B 29 -7.437 -14.990 7.478 1.00 0.00 C ATOM 724 CD ARG B 29 -7.437 -13.556 8.012 1.00 0.00 C ATOM 725 NE ARG B 29 -6.085 -13.367 8.607 1.00 0.00 N ATOM 726 CZ ARG B 29 -5.784 -13.936 9.742 1.00 0.00 C ATOM 727 NH1 ARG B 29 -6.668 -14.670 10.362 1.00 0.00 N ATOM 728 NH2 ARG B 29 -4.598 -13.769 10.260 1.00 0.00 N ATOM 0 H ARG B 29 -4.856 -15.926 4.751 1.00 0.00 H new ATOM 0 HA ARG B 29 -7.607 -14.984 4.880 1.00 0.00 H new ATOM 0 HB2 ARG B 29 -5.940 -16.245 6.551 1.00 0.00 H new ATOM 0 HB3 ARG B 29 -5.374 -14.632 6.937 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -8.359 -15.185 6.931 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -7.402 -15.698 8.306 1.00 0.00 H new ATOM 0 HD2 ARG B 29 -7.621 -12.837 7.213 1.00 0.00 H new ATOM 0 HD3 ARG B 29 -8.220 -13.412 8.757 1.00 0.00 H new ATOM 0 HE ARG B 29 -5.393 -12.792 8.127 1.00 0.00 H new ATOM 0 HH11 ARG B 29 -7.596 -14.800 9.959 1.00 0.00 H new ATOM 0 HH12 ARG B 29 -6.430 -15.114 11.249 1.00 0.00 H new ATOM 0 HH21 ARG B 29 -3.907 -13.194 9.778 1.00 0.00 H new ATOM 0 HH22 ARG B 29 -4.362 -14.213 11.147 1.00 0.00 H new ATOM 742 N ILE B 30 -5.244 -12.722 4.905 1.00 0.00 N ATOM 743 CA ILE B 30 -5.040 -11.253 4.792 1.00 0.00 C ATOM 744 C ILE B 30 -5.788 -10.705 3.573 1.00 0.00 C ATOM 745 O ILE B 30 -6.493 -9.719 3.658 1.00 0.00 O ATOM 746 CB ILE B 30 -3.529 -11.093 4.615 1.00 0.00 C ATOM 747 CG1 ILE B 30 -2.865 -10.951 5.984 1.00 0.00 C ATOM 748 CG2 ILE B 30 -3.235 -9.850 3.777 1.00 0.00 C ATOM 749 CD1 ILE B 30 -1.347 -11.001 5.814 1.00 0.00 C ATOM 0 H ILE B 30 -4.391 -13.280 4.879 1.00 0.00 H new ATOM 0 HA ILE B 30 -5.416 -10.708 5.658 1.00 0.00 H new ATOM 0 HB ILE B 30 -3.133 -11.973 4.107 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.160 -10.010 6.449 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -3.195 -11.751 6.646 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.158 -9.741 3.654 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -3.704 -9.952 2.798 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -3.634 -8.969 4.280 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -0.868 -10.900 6.788 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -1.062 -11.953 5.367 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -1.026 -10.185 5.166 1.00 0.00 H new ATOM 761 N VAL B 31 -5.643 -11.335 2.439 1.00 0.00 N ATOM 762 CA VAL B 31 -6.348 -10.845 1.226 1.00 0.00 C ATOM 763 C VAL B 31 -7.862 -10.866 1.465 1.00 0.00 C ATOM 764 O VAL B 31 -8.556 -9.905 1.203 1.00 0.00 O ATOM 765 CB VAL B 31 -5.944 -11.827 0.128 1.00 0.00 C ATOM 766 CG1 VAL B 31 -7.074 -11.955 -0.890 1.00 0.00 C ATOM 767 CG2 VAL B 31 -4.685 -11.307 -0.567 1.00 0.00 C ATOM 0 H VAL B 31 -5.067 -12.166 2.303 1.00 0.00 H new ATOM 0 HA VAL B 31 -6.089 -9.819 0.963 1.00 0.00 H new ATOM 0 HB VAL B 31 -5.746 -12.805 0.566 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -6.782 -12.656 -1.672 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -7.972 -12.320 -0.392 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -7.276 -10.980 -1.334 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -4.390 -12.002 -1.353 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -4.888 -10.330 -1.005 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -3.878 -11.218 0.161 1.00 0.00 H new ATOM 777 N GLU B 32 -8.374 -11.955 1.975 1.00 0.00 N ATOM 778 CA GLU B 32 -9.838 -12.041 2.251 1.00 0.00 C ATOM 779 C GLU B 32 -10.223 -11.026 3.329 1.00 0.00 C ATOM 780 O GLU B 32 -11.384 -10.797 3.598 1.00 0.00 O ATOM 781 CB GLU B 32 -10.062 -13.470 2.752 1.00 0.00 C ATOM 782 CG GLU B 32 -11.564 -13.733 2.887 1.00 0.00 C ATOM 783 CD GLU B 32 -11.872 -14.217 4.306 1.00 0.00 C ATOM 784 OE1 GLU B 32 -10.936 -14.564 5.007 1.00 0.00 O ATOM 785 OE2 GLU B 32 -13.038 -14.232 4.665 1.00 0.00 O ATOM 0 H GLU B 32 -7.840 -12.791 2.213 1.00 0.00 H new ATOM 0 HA GLU B 32 -10.443 -11.820 1.372 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -9.618 -14.184 2.058 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -9.569 -13.611 3.714 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -12.124 -12.823 2.672 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -11.880 -14.481 2.160 1.00 0.00 H new ATOM 792 N GLY B 33 -9.250 -10.416 3.947 1.00 0.00 N ATOM 793 CA GLY B 33 -9.546 -9.414 5.001 1.00 0.00 C ATOM 794 C GLY B 33 -9.444 -8.012 4.401 1.00 0.00 C ATOM 795 O GLY B 33 -10.342 -7.204 4.532 1.00 0.00 O ATOM 0 H GLY B 33 -8.259 -10.571 3.764 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -10.545 -9.578 5.406 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -8.845 -9.521 5.829 1.00 0.00 H new ATOM 799 N ILE B 34 -8.355 -7.716 3.746 1.00 0.00 N ATOM 800 CA ILE B 34 -8.189 -6.374 3.140 1.00 0.00 C ATOM 801 C ILE B 34 -8.921 -6.304 1.793 1.00 0.00 C ATOM 802 O ILE B 34 -9.650 -5.371 1.521 1.00 0.00 O ATOM 803 CB ILE B 34 -6.674 -6.220 2.957 1.00 0.00 C ATOM 804 CG1 ILE B 34 -6.235 -6.841 1.630 1.00 0.00 C ATOM 805 CG2 ILE B 34 -5.935 -6.921 4.098 1.00 0.00 C ATOM 806 CD1 ILE B 34 -4.712 -6.768 1.515 1.00 0.00 C ATOM 0 H ILE B 34 -7.571 -8.353 3.606 1.00 0.00 H new ATOM 0 HA ILE B 34 -8.607 -5.578 3.756 1.00 0.00 H new ATOM 0 HB ILE B 34 -6.434 -5.157 2.960 1.00 0.00 H new ATOM 0 HG12 ILE B 34 -6.566 -7.878 1.574 1.00 0.00 H new ATOM 0 HG13 ILE B 34 -6.699 -6.313 0.797 1.00 0.00 H new ATOM 0 HG21 ILE B 34 -4.860 -6.806 3.960 1.00 0.00 H new ATOM 0 HG22 ILE B 34 -6.228 -6.476 5.049 1.00 0.00 H new ATOM 0 HG23 ILE B 34 -6.190 -7.981 4.100 1.00 0.00 H new ATOM 0 HD11 ILE B 34 -4.397 -7.210 0.570 1.00 0.00 H new ATOM 0 HD12 ILE B 34 -4.394 -5.726 1.552 1.00 0.00 H new ATOM 0 HD13 ILE B 34 -4.258 -7.316 2.341 1.00 0.00 H new ATOM 818 N LEU B 35 -8.735 -7.285 0.952 1.00 0.00 N ATOM 819 CA LEU B 35 -9.423 -7.274 -0.372 1.00 0.00 C ATOM 820 C LEU B 35 -10.620 -8.228 -0.355 1.00 0.00 C ATOM 821 O LEU B 35 -11.442 -8.222 -1.250 1.00 0.00 O ATOM 822 CB LEU B 35 -8.370 -7.755 -1.371 1.00 0.00 C ATOM 823 CG LEU B 35 -7.265 -6.706 -1.490 1.00 0.00 C ATOM 824 CD1 LEU B 35 -5.921 -7.336 -1.119 1.00 0.00 C ATOM 825 CD2 LEU B 35 -7.205 -6.191 -2.930 1.00 0.00 C ATOM 0 H LEU B 35 -8.137 -8.093 1.124 1.00 0.00 H new ATOM 0 HA LEU B 35 -9.807 -6.287 -0.628 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -7.950 -8.706 -1.043 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -8.829 -7.928 -2.345 1.00 0.00 H new ATOM 0 HG LEU B 35 -7.477 -5.877 -0.815 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -5.133 -6.588 -1.204 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -5.963 -7.705 -0.094 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.709 -8.165 -1.794 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -6.417 -5.443 -3.016 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -6.993 -7.021 -3.605 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -8.162 -5.743 -3.196 1.00 0.00 H new ATOM 837 N LYS B 36 -10.726 -9.046 0.656 1.00 0.00 N ATOM 838 CA LYS B 36 -11.871 -9.997 0.726 1.00 0.00 C ATOM 839 C LYS B 36 -11.856 -10.944 -0.477 1.00 0.00 C ATOM 840 O LYS B 36 -12.866 -11.160 -1.117 1.00 0.00 O ATOM 841 CB LYS B 36 -13.120 -9.116 0.698 1.00 0.00 C ATOM 842 CG LYS B 36 -14.349 -9.959 1.042 1.00 0.00 C ATOM 843 CD LYS B 36 -15.087 -9.326 2.224 1.00 0.00 C ATOM 844 CE LYS B 36 -14.911 -10.205 3.465 1.00 0.00 C ATOM 845 NZ LYS B 36 -15.762 -9.571 4.508 1.00 0.00 N ATOM 0 H LYS B 36 -10.070 -9.097 1.436 1.00 0.00 H new ATOM 0 HA LYS B 36 -11.830 -10.622 1.618 1.00 0.00 H new ATOM 0 HB2 LYS B 36 -13.016 -8.298 1.411 1.00 0.00 H new ATOM 0 HB3 LYS B 36 -13.239 -8.667 -0.288 1.00 0.00 H new ATOM 0 HG2 LYS B 36 -15.011 -10.025 0.179 1.00 0.00 H new ATOM 0 HG3 LYS B 36 -14.047 -10.977 1.290 1.00 0.00 H new ATOM 0 HD2 LYS B 36 -14.699 -8.326 2.416 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -16.146 -9.217 1.989 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -15.224 -11.231 3.270 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -13.867 -10.244 3.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -15.694 -10.117 5.390 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -15.437 -8.598 4.677 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -16.751 -9.554 4.186 1.00 0.00 H new ATOM 859 N ARG B 37 -10.721 -11.509 -0.800 1.00 0.00 N ATOM 860 CA ARG B 37 -10.671 -12.434 -1.969 1.00 0.00 C ATOM 861 C ARG B 37 -10.845 -13.884 -1.509 1.00 0.00 C ATOM 862 O ARG B 37 -10.175 -14.333 -0.600 1.00 0.00 O ATOM 863 CB ARG B 37 -9.285 -12.226 -2.582 1.00 0.00 C ATOM 864 CG ARG B 37 -9.399 -12.224 -4.109 1.00 0.00 C ATOM 865 CD ARG B 37 -10.393 -11.146 -4.546 1.00 0.00 C ATOM 866 NE ARG B 37 -9.605 -10.227 -5.414 1.00 0.00 N ATOM 867 CZ ARG B 37 -10.164 -9.155 -5.910 1.00 0.00 C ATOM 868 NH1 ARG B 37 -11.416 -8.891 -5.651 1.00 0.00 N ATOM 869 NH2 ARG B 37 -9.471 -8.349 -6.667 1.00 0.00 N ATOM 0 H ARG B 37 -9.837 -11.372 -0.311 1.00 0.00 H new ATOM 0 HA ARG B 37 -11.467 -12.234 -2.686 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -8.860 -11.283 -2.237 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -8.609 -13.018 -2.258 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -8.423 -12.037 -4.557 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -9.729 -13.202 -4.461 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -11.233 -11.580 -5.089 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -10.808 -10.619 -3.687 1.00 0.00 H new ATOM 0 HE ARG B 37 -8.628 -10.435 -5.621 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -11.959 -9.522 -5.061 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -11.851 -8.054 -6.039 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -8.493 -8.556 -6.871 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -9.907 -7.512 -7.054 1.00 0.00 H new ATOM 883 N PRO B 38 -11.749 -14.568 -2.159 1.00 0.00 N ATOM 884 CA PRO B 38 -12.027 -15.985 -1.819 1.00 0.00 C ATOM 885 C PRO B 38 -10.930 -16.896 -2.376 1.00 0.00 C ATOM 886 O PRO B 38 -10.313 -16.586 -3.376 1.00 0.00 O ATOM 887 CB PRO B 38 -13.359 -16.262 -2.509 1.00 0.00 C ATOM 888 CG PRO B 38 -13.428 -15.283 -3.640 1.00 0.00 C ATOM 889 CD PRO B 38 -12.593 -14.087 -3.258 1.00 0.00 C ATOM 0 HA PRO B 38 -12.059 -16.168 -0.745 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -13.408 -17.288 -2.873 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -14.194 -16.128 -1.821 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -13.054 -15.733 -4.560 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -14.460 -14.986 -3.827 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -11.992 -13.738 -4.097 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -13.217 -13.251 -2.943 1.00 0.00 H new ATOM 897 N PRO B 39 -10.729 -17.998 -1.705 1.00 0.00 N ATOM 898 CA PRO B 39 -9.699 -18.976 -2.134 1.00 0.00 C ATOM 899 C PRO B 39 -10.173 -19.741 -3.375 1.00 0.00 C ATOM 900 O PRO B 39 -9.481 -20.597 -3.889 1.00 0.00 O ATOM 901 CB PRO B 39 -9.576 -19.912 -0.935 1.00 0.00 C ATOM 902 CG PRO B 39 -10.887 -19.809 -0.223 1.00 0.00 C ATOM 903 CD PRO B 39 -11.435 -18.431 -0.495 1.00 0.00 C ATOM 0 HA PRO B 39 -8.752 -18.511 -2.406 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -9.380 -20.936 -1.253 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -8.751 -19.616 -0.287 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -11.578 -20.574 -0.576 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -10.757 -19.967 0.848 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -12.514 -18.454 -0.650 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -11.247 -17.755 0.339 1.00 0.00 H new ATOM 911 N ASP B 40 -11.346 -19.437 -3.858 1.00 0.00 N ATOM 912 CA ASP B 40 -11.863 -20.145 -5.064 1.00 0.00 C ATOM 913 C ASP B 40 -11.724 -19.254 -6.300 1.00 0.00 C ATOM 914 O ASP B 40 -11.839 -19.707 -7.422 1.00 0.00 O ATOM 915 CB ASP B 40 -13.337 -20.418 -4.763 1.00 0.00 C ATOM 916 CG ASP B 40 -13.483 -21.810 -4.146 1.00 0.00 C ATOM 917 OD1 ASP B 40 -12.470 -22.463 -3.956 1.00 0.00 O ATOM 918 OD2 ASP B 40 -14.607 -22.199 -3.873 1.00 0.00 O ATOM 0 H ASP B 40 -11.969 -18.729 -3.470 1.00 0.00 H new ATOM 0 HA ASP B 40 -11.313 -21.063 -5.271 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -13.725 -19.663 -4.079 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -13.924 -20.351 -5.679 1.00 0.00 H new ATOM 923 N GLU B 41 -11.479 -17.988 -6.104 1.00 0.00 N ATOM 924 CA GLU B 41 -11.331 -17.067 -7.267 1.00 0.00 C ATOM 925 C GLU B 41 -10.151 -16.119 -7.045 1.00 0.00 C ATOM 926 O GLU B 41 -10.063 -15.069 -7.651 1.00 0.00 O ATOM 927 CB GLU B 41 -12.645 -16.284 -7.321 1.00 0.00 C ATOM 928 CG GLU B 41 -13.593 -16.947 -8.323 1.00 0.00 C ATOM 929 CD GLU B 41 -14.970 -17.128 -7.681 1.00 0.00 C ATOM 930 OE1 GLU B 41 -15.323 -16.315 -6.843 1.00 0.00 O ATOM 931 OE2 GLU B 41 -15.648 -18.077 -8.040 1.00 0.00 O ATOM 0 H GLU B 41 -11.375 -17.551 -5.188 1.00 0.00 H new ATOM 0 HA GLU B 41 -11.136 -17.603 -8.196 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -13.105 -16.256 -6.333 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -12.454 -15.251 -7.613 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -13.676 -16.335 -9.221 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -13.194 -17.913 -8.632 1.00 0.00 H new ATOM 938 N GLN B 42 -9.242 -16.481 -6.181 1.00 0.00 N ATOM 939 CA GLN B 42 -8.067 -15.599 -5.921 1.00 0.00 C ATOM 940 C GLN B 42 -6.763 -16.388 -6.084 1.00 0.00 C ATOM 941 O GLN B 42 -6.732 -17.595 -5.950 1.00 0.00 O ATOM 942 CB GLN B 42 -8.239 -15.118 -4.476 1.00 0.00 C ATOM 943 CG GLN B 42 -7.661 -16.153 -3.505 1.00 0.00 C ATOM 944 CD GLN B 42 -7.620 -15.559 -2.095 1.00 0.00 C ATOM 945 OE1 GLN B 42 -8.305 -16.126 -1.140 1.00 0.00 O flip ATOM 946 NE2 GLN B 42 -6.959 -14.567 -1.861 1.00 0.00 N flip ATOM 0 H GLN B 42 -9.261 -17.348 -5.644 1.00 0.00 H new ATOM 0 HA GLN B 42 -8.015 -14.764 -6.619 1.00 0.00 H new ATOM 0 HB2 GLN B 42 -7.736 -14.160 -4.341 1.00 0.00 H new ATOM 0 HB3 GLN B 42 -9.295 -14.956 -4.261 1.00 0.00 H new ATOM 0 HG2 GLN B 42 -8.271 -17.056 -3.513 1.00 0.00 H new ATOM 0 HG3 GLN B 42 -6.658 -16.442 -3.819 1.00 0.00 H new ATOM 0 HE21 GLN B 42 -6.423 -14.123 -2.607 1.00 0.00 H new ATOM 0 HE22 GLN B 42 -6.940 -14.178 -0.918 1.00 0.00 H new ATOM 955 N ARG B 43 -5.688 -15.709 -6.373 1.00 0.00 N ATOM 956 CA ARG B 43 -4.382 -16.405 -6.547 1.00 0.00 C ATOM 957 C ARG B 43 -3.237 -15.467 -6.156 1.00 0.00 C ATOM 958 O ARG B 43 -3.344 -14.262 -6.272 1.00 0.00 O ATOM 959 CB ARG B 43 -4.312 -16.746 -8.036 1.00 0.00 C ATOM 960 CG ARG B 43 -5.041 -18.067 -8.292 1.00 0.00 C ATOM 961 CD ARG B 43 -4.814 -18.503 -9.741 1.00 0.00 C ATOM 962 NE ARG B 43 -6.042 -19.259 -10.111 1.00 0.00 N ATOM 963 CZ ARG B 43 -7.186 -18.639 -10.211 1.00 0.00 C ATOM 964 NH1 ARG B 43 -7.255 -17.353 -9.992 1.00 0.00 N ATOM 965 NH2 ARG B 43 -8.262 -19.304 -10.533 1.00 0.00 N ATOM 0 H ARG B 43 -5.658 -14.697 -6.497 1.00 0.00 H new ATOM 0 HA ARG B 43 -4.296 -17.294 -5.923 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -4.765 -15.948 -8.624 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -3.272 -16.825 -8.353 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -4.676 -18.834 -7.609 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -6.107 -17.949 -8.099 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -4.668 -17.643 -10.394 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -3.924 -19.126 -9.831 1.00 0.00 H new ATOM 0 HE ARG B 43 -5.989 -20.262 -10.286 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -6.414 -16.832 -9.743 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -8.150 -16.870 -10.071 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -8.208 -20.308 -10.706 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -9.156 -18.820 -10.611 1.00 0.00 H new ATOM 979 N LEU B 44 -2.145 -16.006 -5.691 1.00 0.00 N ATOM 980 CA LEU B 44 -1.000 -15.137 -5.292 1.00 0.00 C ATOM 981 C LEU B 44 0.225 -15.449 -6.155 1.00 0.00 C ATOM 982 O LEU B 44 0.381 -16.545 -6.655 1.00 0.00 O ATOM 983 CB LEU B 44 -0.729 -15.488 -3.829 1.00 0.00 C ATOM 984 CG LEU B 44 -2.007 -15.294 -3.012 1.00 0.00 C ATOM 985 CD1 LEU B 44 -1.919 -16.113 -1.724 1.00 0.00 C ATOM 986 CD2 LEU B 44 -2.167 -13.812 -2.663 1.00 0.00 C ATOM 0 H LEU B 44 -1.995 -17.008 -5.570 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.219 -14.077 -5.423 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -0.387 -16.520 -3.749 1.00 0.00 H new ATOM 0 HB3 LEU B 44 0.067 -14.857 -3.434 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.866 -15.626 -3.596 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -2.830 -15.975 -1.142 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -1.803 -17.168 -1.971 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.061 -15.781 -1.140 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.078 -13.672 -2.081 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.308 -13.481 -2.079 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -2.229 -13.227 -3.580 1.00 0.00 H new ATOM 998 N TYR B 45 1.096 -14.492 -6.333 1.00 0.00 N ATOM 999 CA TYR B 45 2.307 -14.736 -7.159 1.00 0.00 C ATOM 1000 C TYR B 45 3.554 -14.264 -6.411 1.00 0.00 C ATOM 1001 O TYR B 45 3.595 -13.177 -5.870 1.00 0.00 O ATOM 1002 CB TYR B 45 2.096 -13.909 -8.427 1.00 0.00 C ATOM 1003 CG TYR B 45 1.639 -14.811 -9.548 1.00 0.00 C ATOM 1004 CD1 TYR B 45 0.322 -15.285 -9.573 1.00 0.00 C ATOM 1005 CD2 TYR B 45 2.532 -15.172 -10.565 1.00 0.00 C ATOM 1006 CE1 TYR B 45 -0.102 -16.120 -10.613 1.00 0.00 C ATOM 1007 CE2 TYR B 45 2.107 -16.007 -11.605 1.00 0.00 C ATOM 1008 CZ TYR B 45 0.790 -16.482 -11.629 1.00 0.00 C ATOM 1009 OH TYR B 45 0.372 -17.305 -12.655 1.00 0.00 O ATOM 0 H TYR B 45 1.019 -13.553 -5.941 1.00 0.00 H new ATOM 0 HA TYR B 45 2.450 -15.793 -7.384 1.00 0.00 H new ATOM 0 HB2 TYR B 45 1.354 -13.131 -8.247 1.00 0.00 H new ATOM 0 HB3 TYR B 45 3.023 -13.407 -8.705 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -0.367 -15.006 -8.789 1.00 0.00 H new ATOM 0 HD2 TYR B 45 3.548 -14.806 -10.547 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -1.118 -16.485 -10.632 1.00 0.00 H new ATOM 0 HE2 TYR B 45 2.795 -16.285 -12.389 1.00 0.00 H new ATOM 0 HH TYR B 45 1.115 -17.456 -13.276 1.00 0.00 H new ATOM 1019 N LYS B 46 4.569 -15.076 -6.379 1.00 0.00 N ATOM 1020 CA LYS B 46 5.820 -14.687 -5.668 1.00 0.00 C ATOM 1021 C LYS B 46 6.992 -14.626 -6.651 1.00 0.00 C ATOM 1022 O LYS B 46 7.194 -15.522 -7.447 1.00 0.00 O ATOM 1023 CB LYS B 46 6.046 -15.790 -4.633 1.00 0.00 C ATOM 1024 CG LYS B 46 6.508 -17.066 -5.340 1.00 0.00 C ATOM 1025 CD LYS B 46 6.568 -18.215 -4.332 1.00 0.00 C ATOM 1026 CE LYS B 46 7.778 -19.101 -4.638 1.00 0.00 C ATOM 1027 NZ LYS B 46 7.341 -19.973 -5.763 1.00 0.00 N ATOM 0 H LYS B 46 4.589 -15.997 -6.816 1.00 0.00 H new ATOM 0 HA LYS B 46 5.743 -13.703 -5.206 1.00 0.00 H new ATOM 0 HB2 LYS B 46 6.794 -15.473 -3.906 1.00 0.00 H new ATOM 0 HB3 LYS B 46 5.125 -15.980 -4.081 1.00 0.00 H new ATOM 0 HG2 LYS B 46 5.822 -17.314 -6.150 1.00 0.00 H new ATOM 0 HG3 LYS B 46 7.489 -16.911 -5.789 1.00 0.00 H new ATOM 0 HD2 LYS B 46 6.640 -17.820 -3.319 1.00 0.00 H new ATOM 0 HD3 LYS B 46 5.652 -18.803 -4.380 1.00 0.00 H new ATOM 0 HE2 LYS B 46 8.645 -18.502 -4.916 1.00 0.00 H new ATOM 0 HE3 LYS B 46 8.064 -19.692 -3.768 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 8.118 -20.610 -6.030 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 6.518 -20.536 -5.467 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 7.081 -19.383 -6.579 1.00 0.00 H new ATOM 1041 N ASP B 47 7.767 -13.577 -6.602 1.00 0.00 N ATOM 1042 CA ASP B 47 8.926 -13.462 -7.533 1.00 0.00 C ATOM 1043 C ASP B 47 8.511 -13.874 -8.949 1.00 0.00 C ATOM 1044 O ASP B 47 8.950 -14.881 -9.466 1.00 0.00 O ATOM 1045 CB ASP B 47 9.975 -14.427 -6.981 1.00 0.00 C ATOM 1046 CG ASP B 47 11.335 -13.730 -6.931 1.00 0.00 C ATOM 1047 OD1 ASP B 47 11.437 -12.635 -7.460 1.00 0.00 O ATOM 1048 OD2 ASP B 47 12.252 -14.303 -6.366 1.00 0.00 O ATOM 0 H ASP B 47 7.648 -12.795 -5.958 1.00 0.00 H new ATOM 0 HA ASP B 47 9.304 -12.442 -7.597 1.00 0.00 H new ATOM 0 HB2 ASP B 47 9.689 -14.760 -5.983 1.00 0.00 H new ATOM 0 HB3 ASP B 47 10.033 -15.316 -7.609 1.00 0.00 H new ATOM 1053 N ASP B 48 7.667 -13.102 -9.579 1.00 0.00 N ATOM 1054 CA ASP B 48 7.227 -13.450 -10.960 1.00 0.00 C ATOM 1055 C ASP B 48 6.776 -14.913 -11.019 1.00 0.00 C ATOM 1056 O ASP B 48 6.824 -15.545 -12.056 1.00 0.00 O ATOM 1057 CB ASP B 48 8.463 -13.236 -11.836 1.00 0.00 C ATOM 1058 CG ASP B 48 8.475 -11.798 -12.359 1.00 0.00 C ATOM 1059 OD1 ASP B 48 7.570 -11.452 -13.101 1.00 0.00 O ATOM 1060 OD2 ASP B 48 9.387 -11.069 -12.008 1.00 0.00 O ATOM 0 H ASP B 48 7.264 -12.246 -9.197 1.00 0.00 H new ATOM 0 HA ASP B 48 6.383 -12.843 -11.289 1.00 0.00 H new ATOM 0 HB2 ASP B 48 9.368 -13.433 -11.261 1.00 0.00 H new ATOM 0 HB3 ASP B 48 8.457 -13.938 -12.670 1.00 0.00 H new ATOM 1065 N GLN B 49 6.341 -15.454 -9.915 1.00 0.00 N ATOM 1066 CA GLN B 49 5.888 -16.875 -9.910 1.00 0.00 C ATOM 1067 C GLN B 49 4.599 -17.014 -9.096 1.00 0.00 C ATOM 1068 O GLN B 49 4.093 -16.053 -8.552 1.00 0.00 O ATOM 1069 CB GLN B 49 7.027 -17.651 -9.249 1.00 0.00 C ATOM 1070 CG GLN B 49 7.563 -18.702 -10.223 1.00 0.00 C ATOM 1071 CD GLN B 49 8.665 -18.084 -11.085 1.00 0.00 C ATOM 1072 OE1 GLN B 49 9.752 -17.824 -10.607 1.00 0.00 O ATOM 1073 NE2 GLN B 49 8.431 -17.837 -12.344 1.00 0.00 N ATOM 0 H GLN B 49 6.279 -14.975 -9.017 1.00 0.00 H new ATOM 0 HA GLN B 49 5.672 -17.245 -10.912 1.00 0.00 H new ATOM 0 HB2 GLN B 49 7.826 -16.968 -8.959 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.672 -18.132 -8.338 1.00 0.00 H new ATOM 0 HG2 GLN B 49 7.954 -19.558 -9.672 1.00 0.00 H new ATOM 0 HG3 GLN B 49 6.756 -19.072 -10.856 1.00 0.00 H new ATOM 0 HE21 GLN B 49 7.519 -18.055 -12.746 1.00 0.00 H new ATOM 0 HE22 GLN B 49 9.160 -17.426 -12.927 1.00 0.00 H new ATOM 1082 N LEU B 50 4.065 -18.200 -9.006 1.00 0.00 N ATOM 1083 CA LEU B 50 2.810 -18.397 -8.225 1.00 0.00 C ATOM 1084 C LEU B 50 3.143 -18.750 -6.773 1.00 0.00 C ATOM 1085 O LEU B 50 3.986 -19.582 -6.504 1.00 0.00 O ATOM 1086 CB LEU B 50 2.093 -19.561 -8.911 1.00 0.00 C ATOM 1087 CG LEU B 50 0.752 -19.812 -8.220 1.00 0.00 C ATOM 1088 CD1 LEU B 50 -0.241 -18.718 -8.620 1.00 0.00 C ATOM 1089 CD2 LEU B 50 0.206 -21.175 -8.649 1.00 0.00 C ATOM 0 H LEU B 50 4.443 -19.042 -9.439 1.00 0.00 H new ATOM 0 HA LEU B 50 2.193 -17.499 -8.200 1.00 0.00 H new ATOM 0 HB2 LEU B 50 1.934 -19.334 -9.965 1.00 0.00 H new ATOM 0 HB3 LEU B 50 2.710 -20.458 -8.868 1.00 0.00 H new ATOM 0 HG LEU B 50 0.892 -19.799 -7.139 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -1.197 -18.897 -8.128 1.00 0.00 H new ATOM 0 HD12 LEU B 50 0.147 -17.746 -8.317 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -0.381 -18.732 -9.701 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -0.750 -21.355 -8.157 1.00 0.00 H new ATOM 0 HD22 LEU B 50 0.066 -21.187 -9.730 1.00 0.00 H new ATOM 0 HD23 LEU B 50 0.912 -21.955 -8.366 1.00 0.00 H new ATOM 1101 N LEU B 51 2.487 -18.123 -5.835 1.00 0.00 N ATOM 1102 CA LEU B 51 2.767 -18.422 -4.401 1.00 0.00 C ATOM 1103 C LEU B 51 1.965 -19.645 -3.949 1.00 0.00 C ATOM 1104 O LEU B 51 0.768 -19.576 -3.751 1.00 0.00 O ATOM 1105 CB LEU B 51 2.318 -17.175 -3.640 1.00 0.00 C ATOM 1106 CG LEU B 51 3.120 -17.052 -2.344 1.00 0.00 C ATOM 1107 CD1 LEU B 51 3.305 -15.573 -1.996 1.00 0.00 C ATOM 1108 CD2 LEU B 51 2.366 -17.750 -1.210 1.00 0.00 C ATOM 0 H LEU B 51 1.769 -17.417 -5.999 1.00 0.00 H new ATOM 0 HA LEU B 51 3.818 -18.649 -4.225 1.00 0.00 H new ATOM 0 HB2 LEU B 51 2.464 -16.288 -4.256 1.00 0.00 H new ATOM 0 HB3 LEU B 51 1.253 -17.236 -3.417 1.00 0.00 H new ATOM 0 HG LEU B 51 4.096 -17.520 -2.476 1.00 0.00 H new ATOM 0 HD11 LEU B 51 3.877 -15.485 -1.072 1.00 0.00 H new ATOM 0 HD12 LEU B 51 3.841 -15.074 -2.803 1.00 0.00 H new ATOM 0 HD13 LEU B 51 2.329 -15.105 -1.865 1.00 0.00 H new ATOM 0 HD21 LEU B 51 2.937 -17.663 -0.286 1.00 0.00 H new ATOM 0 HD22 LEU B 51 1.390 -17.282 -1.079 1.00 0.00 H new ATOM 0 HD23 LEU B 51 2.233 -18.803 -1.456 1.00 0.00 H new ATOM 1120 N ASP B 52 2.615 -20.765 -3.783 1.00 0.00 N ATOM 1121 CA ASP B 52 1.888 -21.990 -3.341 1.00 0.00 C ATOM 1122 C ASP B 52 1.666 -21.956 -1.826 1.00 0.00 C ATOM 1123 O ASP B 52 2.581 -21.731 -1.059 1.00 0.00 O ATOM 1124 CB ASP B 52 2.804 -23.152 -3.725 1.00 0.00 C ATOM 1125 CG ASP B 52 2.325 -23.768 -5.040 1.00 0.00 C ATOM 1126 OD1 ASP B 52 1.885 -23.019 -5.896 1.00 0.00 O ATOM 1127 OD2 ASP B 52 2.407 -24.978 -5.170 1.00 0.00 O ATOM 0 H ASP B 52 3.617 -20.885 -3.934 1.00 0.00 H new ATOM 0 HA ASP B 52 0.904 -22.077 -3.802 1.00 0.00 H new ATOM 0 HB2 ASP B 52 3.831 -22.800 -3.829 1.00 0.00 H new ATOM 0 HB3 ASP B 52 2.803 -23.905 -2.937 1.00 0.00 H new ATOM 1132 N ASP B 53 0.457 -22.177 -1.389 1.00 0.00 N ATOM 1133 CA ASP B 53 0.179 -22.156 0.077 1.00 0.00 C ATOM 1134 C ASP B 53 0.738 -23.416 0.744 1.00 0.00 C ATOM 1135 O ASP B 53 0.568 -23.630 1.927 1.00 0.00 O ATOM 1136 CB ASP B 53 -1.346 -22.122 0.188 1.00 0.00 C ATOM 1137 CG ASP B 53 -1.858 -20.743 -0.231 1.00 0.00 C ATOM 1138 OD1 ASP B 53 -1.560 -20.335 -1.341 1.00 0.00 O ATOM 1139 OD2 ASP B 53 -2.539 -20.119 0.565 1.00 0.00 O ATOM 0 H ASP B 53 -0.350 -22.371 -1.982 1.00 0.00 H new ATOM 0 HA ASP B 53 0.645 -21.304 0.573 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -1.785 -22.892 -0.446 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -1.652 -22.339 1.211 1.00 0.00 H new ATOM 1144 N GLY B 54 1.401 -24.254 -0.005 1.00 0.00 N ATOM 1145 CA GLY B 54 1.966 -25.497 0.587 1.00 0.00 C ATOM 1146 C GLY B 54 3.410 -25.252 1.026 1.00 0.00 C ATOM 1147 O GLY B 54 4.097 -26.155 1.459 1.00 0.00 O ATOM 0 H GLY B 54 1.575 -24.130 -1.002 1.00 0.00 H new ATOM 0 HA2 GLY B 54 1.365 -25.810 1.441 1.00 0.00 H new ATOM 0 HA3 GLY B 54 1.930 -26.307 -0.142 1.00 0.00 H new ATOM 1151 N LYS B 55 3.872 -24.036 0.932 1.00 0.00 N ATOM 1152 CA LYS B 55 5.245 -23.726 1.350 1.00 0.00 C ATOM 1153 C LYS B 55 5.237 -22.405 2.106 1.00 0.00 C ATOM 1154 O LYS B 55 4.487 -21.498 1.813 1.00 0.00 O ATOM 1155 CB LYS B 55 6.044 -23.606 0.053 1.00 0.00 C ATOM 1156 CG LYS B 55 5.258 -22.769 -0.956 1.00 0.00 C ATOM 1157 CD LYS B 55 6.202 -21.789 -1.656 1.00 0.00 C ATOM 1158 CE LYS B 55 5.434 -20.517 -2.027 1.00 0.00 C ATOM 1159 NZ LYS B 55 5.448 -19.681 -0.793 1.00 0.00 N ATOM 0 H LYS B 55 3.340 -23.241 0.577 1.00 0.00 H new ATOM 0 HA LYS B 55 5.675 -24.483 2.006 1.00 0.00 H new ATOM 0 HB2 LYS B 55 7.011 -23.143 0.251 1.00 0.00 H new ATOM 0 HB3 LYS B 55 6.243 -24.596 -0.357 1.00 0.00 H new ATOM 0 HG2 LYS B 55 4.782 -23.419 -1.690 1.00 0.00 H new ATOM 0 HG3 LYS B 55 4.462 -22.224 -0.449 1.00 0.00 H new ATOM 0 HD2 LYS B 55 7.039 -21.544 -1.002 1.00 0.00 H new ATOM 0 HD3 LYS B 55 6.621 -22.248 -2.552 1.00 0.00 H new ATOM 0 HE2 LYS B 55 5.909 -19.998 -2.860 1.00 0.00 H new ATOM 0 HE3 LYS B 55 4.414 -20.748 -2.335 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 4.802 -18.875 -0.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 5.140 -20.254 0.018 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 6.412 -19.330 -0.622 1.00 0.00 H new ATOM 1173 N THR B 56 6.073 -22.309 3.069 1.00 0.00 N ATOM 1174 CA THR B 56 6.172 -21.070 3.890 1.00 0.00 C ATOM 1175 C THR B 56 7.462 -20.326 3.549 1.00 0.00 C ATOM 1176 O THR B 56 8.281 -20.808 2.794 1.00 0.00 O ATOM 1177 CB THR B 56 6.201 -21.556 5.338 1.00 0.00 C ATOM 1178 OG1 THR B 56 7.065 -22.680 5.441 1.00 0.00 O ATOM 1179 CG2 THR B 56 4.791 -21.953 5.769 1.00 0.00 C ATOM 0 H THR B 56 6.718 -23.051 3.342 1.00 0.00 H new ATOM 0 HA THR B 56 5.346 -20.383 3.710 1.00 0.00 H new ATOM 0 HB THR B 56 6.566 -20.758 5.984 1.00 0.00 H new ATOM 0 HG1 THR B 56 7.086 -22.992 6.370 1.00 0.00 H new ATOM 0 HG21 THR B 56 4.810 -22.300 6.802 1.00 0.00 H new ATOM 0 HG22 THR B 56 4.129 -21.090 5.688 1.00 0.00 H new ATOM 0 HG23 THR B 56 4.425 -22.752 5.125 1.00 0.00 H new ATOM 1187 N LEU B 57 7.655 -19.155 4.092 1.00 0.00 N ATOM 1188 CA LEU B 57 8.908 -18.404 3.770 1.00 0.00 C ATOM 1189 C LEU B 57 10.127 -19.297 4.005 1.00 0.00 C ATOM 1190 O LEU B 57 11.073 -19.284 3.242 1.00 0.00 O ATOM 1191 CB LEU B 57 8.941 -17.219 4.736 1.00 0.00 C ATOM 1192 CG LEU B 57 8.936 -15.911 3.942 1.00 0.00 C ATOM 1193 CD1 LEU B 57 7.803 -15.936 2.914 1.00 0.00 C ATOM 1194 CD2 LEU B 57 8.728 -14.734 4.899 1.00 0.00 C ATOM 0 H LEU B 57 7.013 -18.690 4.734 1.00 0.00 H new ATOM 0 HA LEU B 57 8.928 -18.080 2.729 1.00 0.00 H new ATOM 0 HB2 LEU B 57 8.079 -17.255 5.402 1.00 0.00 H new ATOM 0 HB3 LEU B 57 9.831 -17.272 5.363 1.00 0.00 H new ATOM 0 HG LEU B 57 9.890 -15.799 3.426 1.00 0.00 H new ATOM 0 HD11 LEU B 57 7.802 -15.003 2.350 1.00 0.00 H new ATOM 0 HD12 LEU B 57 7.950 -16.773 2.231 1.00 0.00 H new ATOM 0 HD13 LEU B 57 6.848 -16.050 3.427 1.00 0.00 H new ATOM 0 HD21 LEU B 57 8.724 -13.802 4.334 1.00 0.00 H new ATOM 0 HD22 LEU B 57 7.775 -14.849 5.415 1.00 0.00 H new ATOM 0 HD23 LEU B 57 9.536 -14.712 5.630 1.00 0.00 H new ATOM 1206 N GLY B 58 10.114 -20.074 5.052 1.00 0.00 N ATOM 1207 CA GLY B 58 11.274 -20.967 5.328 1.00 0.00 C ATOM 1208 C GLY B 58 11.279 -22.117 4.322 1.00 0.00 C ATOM 1209 O GLY B 58 12.315 -22.517 3.828 1.00 0.00 O ATOM 0 H GLY B 58 9.352 -20.129 5.728 1.00 0.00 H new ATOM 0 HA2 GLY B 58 12.205 -20.404 5.259 1.00 0.00 H new ATOM 0 HA3 GLY B 58 11.213 -21.358 6.344 1.00 0.00 H new ATOM 1213 N GLU B 59 10.130 -22.653 4.009 1.00 0.00 N ATOM 1214 CA GLU B 59 10.076 -23.774 3.028 1.00 0.00 C ATOM 1215 C GLU B 59 9.935 -23.221 1.612 1.00 0.00 C ATOM 1216 O GLU B 59 9.818 -23.955 0.650 1.00 0.00 O ATOM 1217 CB GLU B 59 8.844 -24.590 3.418 1.00 0.00 C ATOM 1218 CG GLU B 59 9.266 -26.019 3.763 1.00 0.00 C ATOM 1219 CD GLU B 59 8.082 -26.766 4.381 1.00 0.00 C ATOM 1220 OE1 GLU B 59 6.995 -26.211 4.388 1.00 0.00 O ATOM 1221 OE2 GLU B 59 8.283 -27.880 4.837 1.00 0.00 O ATOM 0 H GLU B 59 9.229 -22.364 4.389 1.00 0.00 H new ATOM 0 HA GLU B 59 10.980 -24.383 3.043 1.00 0.00 H new ATOM 0 HB2 GLU B 59 8.346 -24.131 4.272 1.00 0.00 H new ATOM 0 HB3 GLU B 59 8.126 -24.600 2.598 1.00 0.00 H new ATOM 0 HG2 GLU B 59 9.607 -26.535 2.866 1.00 0.00 H new ATOM 0 HG3 GLU B 59 10.104 -26.004 4.460 1.00 0.00 H new ATOM 1228 N CYS B 60 9.952 -21.930 1.486 1.00 0.00 N ATOM 1229 CA CYS B 60 9.828 -21.299 0.141 1.00 0.00 C ATOM 1230 C CYS B 60 11.123 -20.568 -0.213 1.00 0.00 C ATOM 1231 O CYS B 60 11.540 -20.537 -1.354 1.00 0.00 O ATOM 1232 CB CYS B 60 8.674 -20.305 0.278 1.00 0.00 C ATOM 1233 SG CYS B 60 8.411 -19.470 -1.307 1.00 0.00 S ATOM 0 H CYS B 60 10.047 -21.275 2.262 1.00 0.00 H new ATOM 0 HA CYS B 60 9.646 -22.030 -0.647 1.00 0.00 H new ATOM 0 HB2 CYS B 60 7.766 -20.825 0.583 1.00 0.00 H new ATOM 0 HB3 CYS B 60 8.899 -19.574 1.054 1.00 0.00 H new ATOM 0 HG CYS B 60 8.796 -18.232 -1.214 1.00 0.00 H new ATOM 1239 N GLY B 61 11.762 -19.978 0.760 1.00 0.00 N ATOM 1240 CA GLY B 61 13.030 -19.246 0.485 1.00 0.00 C ATOM 1241 C GLY B 61 12.731 -17.758 0.329 1.00 0.00 C ATOM 1242 O GLY B 61 12.960 -17.169 -0.709 1.00 0.00 O ATOM 0 H GLY B 61 11.460 -19.971 1.734 1.00 0.00 H new ATOM 0 HA2 GLY B 61 13.738 -19.403 1.299 1.00 0.00 H new ATOM 0 HA3 GLY B 61 13.497 -19.632 -0.421 1.00 0.00 H new ATOM 1246 N PHE B 62 12.220 -17.151 1.356 1.00 0.00 N ATOM 1247 CA PHE B 62 11.896 -15.696 1.282 1.00 0.00 C ATOM 1248 C PHE B 62 12.328 -14.989 2.569 1.00 0.00 C ATOM 1249 O PHE B 62 12.797 -13.869 2.546 1.00 0.00 O ATOM 1250 CB PHE B 62 10.377 -15.636 1.123 1.00 0.00 C ATOM 1251 CG PHE B 62 10.026 -15.419 -0.330 1.00 0.00 C ATOM 1252 CD1 PHE B 62 10.770 -14.519 -1.104 1.00 0.00 C ATOM 1253 CD2 PHE B 62 8.957 -16.117 -0.903 1.00 0.00 C ATOM 1254 CE1 PHE B 62 10.443 -14.318 -2.451 1.00 0.00 C ATOM 1255 CE2 PHE B 62 8.631 -15.916 -2.249 1.00 0.00 C ATOM 1256 CZ PHE B 62 9.373 -15.017 -3.023 1.00 0.00 C ATOM 0 H PHE B 62 12.010 -17.597 2.249 1.00 0.00 H new ATOM 0 HA PHE B 62 12.413 -15.201 0.460 1.00 0.00 H new ATOM 0 HB2 PHE B 62 9.927 -16.562 1.482 1.00 0.00 H new ATOM 0 HB3 PHE B 62 9.970 -14.828 1.730 1.00 0.00 H new ATOM 0 HD1 PHE B 62 11.595 -13.980 -0.662 1.00 0.00 H new ATOM 0 HD2 PHE B 62 8.383 -16.811 -0.306 1.00 0.00 H new ATOM 0 HE1 PHE B 62 11.016 -13.624 -3.048 1.00 0.00 H new ATOM 0 HE2 PHE B 62 7.806 -16.455 -2.691 1.00 0.00 H new ATOM 0 HZ PHE B 62 9.120 -14.862 -4.062 1.00 0.00 H new ATOM 1266 N THR B 63 12.168 -15.633 3.693 1.00 0.00 N ATOM 1267 CA THR B 63 12.567 -14.995 4.981 1.00 0.00 C ATOM 1268 C THR B 63 14.050 -14.627 4.957 1.00 0.00 C ATOM 1269 O THR B 63 14.504 -13.873 4.121 1.00 0.00 O ATOM 1270 CB THR B 63 12.312 -16.057 6.049 1.00 0.00 C ATOM 1271 OG1 THR B 63 12.806 -15.596 7.299 1.00 0.00 O ATOM 1272 CG2 THR B 63 13.029 -17.350 5.663 1.00 0.00 C ATOM 0 H THR B 63 11.779 -16.572 3.776 1.00 0.00 H new ATOM 0 HA THR B 63 12.009 -14.077 5.168 1.00 0.00 H new ATOM 0 HB THR B 63 11.241 -16.246 6.127 1.00 0.00 H new ATOM 0 HG1 THR B 63 13.148 -16.355 7.816 1.00 0.00 H new ATOM 0 HG21 THR B 63 12.847 -18.108 6.425 1.00 0.00 H new ATOM 0 HG22 THR B 63 12.652 -17.703 4.703 1.00 0.00 H new ATOM 0 HG23 THR B 63 14.100 -17.163 5.585 1.00 0.00 H new ATOM 1280 N SER B 64 14.804 -15.157 5.879 1.00 0.00 N ATOM 1281 CA SER B 64 16.260 -14.843 5.924 1.00 0.00 C ATOM 1282 C SER B 64 16.460 -13.330 5.899 1.00 0.00 C ATOM 1283 O SER B 64 17.480 -12.831 5.466 1.00 0.00 O ATOM 1284 CB SER B 64 16.851 -15.490 4.674 1.00 0.00 C ATOM 1285 OG SER B 64 16.997 -14.505 3.659 1.00 0.00 O ATOM 0 H SER B 64 14.475 -15.795 6.604 1.00 0.00 H new ATOM 0 HA SER B 64 16.740 -15.216 6.829 1.00 0.00 H new ATOM 0 HB2 SER B 64 17.818 -15.937 4.905 1.00 0.00 H new ATOM 0 HB3 SER B 64 16.203 -16.294 4.326 1.00 0.00 H new ATOM 0 HG SER B 64 16.115 -14.152 3.416 1.00 0.00 H new ATOM 1291 N GLN B 65 15.488 -12.603 6.364 1.00 0.00 N ATOM 1292 CA GLN B 65 15.600 -11.114 6.377 1.00 0.00 C ATOM 1293 C GLN B 65 14.275 -10.483 6.817 1.00 0.00 C ATOM 1294 O GLN B 65 13.937 -9.385 6.420 1.00 0.00 O ATOM 1295 CB GLN B 65 15.928 -10.727 4.933 1.00 0.00 C ATOM 1296 CG GLN B 65 17.130 -9.780 4.918 1.00 0.00 C ATOM 1297 CD GLN B 65 18.413 -10.585 4.703 1.00 0.00 C ATOM 1298 OE1 GLN B 65 19.044 -11.010 5.651 1.00 0.00 O ATOM 1299 NE2 GLN B 65 18.829 -10.815 3.488 1.00 0.00 N ATOM 0 H GLN B 65 14.615 -12.974 6.738 1.00 0.00 H new ATOM 0 HA GLN B 65 16.361 -10.765 7.075 1.00 0.00 H new ATOM 0 HB2 GLN B 65 16.148 -11.620 4.347 1.00 0.00 H new ATOM 0 HB3 GLN B 65 15.067 -10.246 4.470 1.00 0.00 H new ATOM 0 HG2 GLN B 65 17.014 -9.042 4.125 1.00 0.00 H new ATOM 0 HG3 GLN B 65 17.186 -9.232 5.858 1.00 0.00 H new ATOM 0 HE21 GLN B 65 18.300 -10.459 2.692 1.00 0.00 H new ATOM 0 HE22 GLN B 65 19.683 -11.351 3.334 1.00 0.00 H new ATOM 1308 N THR B 66 13.522 -11.169 7.633 1.00 0.00 N ATOM 1309 CA THR B 66 12.219 -10.612 8.100 1.00 0.00 C ATOM 1310 C THR B 66 11.404 -10.102 6.912 1.00 0.00 C ATOM 1311 O THR B 66 10.531 -9.270 7.058 1.00 0.00 O ATOM 1312 CB THR B 66 12.589 -9.460 9.036 1.00 0.00 C ATOM 1313 OG1 THR B 66 13.985 -9.492 9.300 1.00 0.00 O ATOM 1314 CG2 THR B 66 11.816 -9.601 10.349 1.00 0.00 C ATOM 0 H THR B 66 13.753 -12.093 7.998 1.00 0.00 H new ATOM 0 HA THR B 66 11.608 -11.362 8.603 1.00 0.00 H new ATOM 0 HB THR B 66 12.332 -8.512 8.564 1.00 0.00 H new ATOM 0 HG1 THR B 66 14.222 -8.753 9.898 1.00 0.00 H new ATOM 0 HG21 THR B 66 12.079 -8.780 11.016 1.00 0.00 H new ATOM 0 HG22 THR B 66 10.745 -9.574 10.146 1.00 0.00 H new ATOM 0 HG23 THR B 66 12.072 -10.549 10.822 1.00 0.00 H new ATOM 1322 N ALA B 67 11.687 -10.604 5.741 1.00 0.00 N ATOM 1323 CA ALA B 67 10.942 -10.172 4.516 1.00 0.00 C ATOM 1324 C ALA B 67 10.242 -8.826 4.736 1.00 0.00 C ATOM 1325 O ALA B 67 9.072 -8.772 5.061 1.00 0.00 O ATOM 1326 CB ALA B 67 9.911 -11.271 4.269 1.00 0.00 C ATOM 0 H ALA B 67 12.411 -11.304 5.576 1.00 0.00 H new ATOM 0 HA ALA B 67 11.614 -10.034 3.669 1.00 0.00 H new ATOM 0 HB1 ALA B 67 9.323 -11.026 3.384 1.00 0.00 H new ATOM 0 HB2 ALA B 67 10.422 -12.221 4.114 1.00 0.00 H new ATOM 0 HB3 ALA B 67 9.251 -11.351 5.133 1.00 0.00 H new ATOM 1332 N ARG B 68 10.946 -7.743 4.550 1.00 0.00 N ATOM 1333 CA ARG B 68 10.326 -6.396 4.735 1.00 0.00 C ATOM 1334 C ARG B 68 11.411 -5.321 4.842 1.00 0.00 C ATOM 1335 O ARG B 68 11.480 -4.426 4.022 1.00 0.00 O ATOM 1336 CB ARG B 68 9.530 -6.483 6.037 1.00 0.00 C ATOM 1337 CG ARG B 68 8.039 -6.343 5.729 1.00 0.00 C ATOM 1338 CD ARG B 68 7.366 -5.522 6.830 1.00 0.00 C ATOM 1339 NE ARG B 68 8.176 -4.276 6.925 1.00 0.00 N ATOM 1340 CZ ARG B 68 8.002 -3.314 6.059 1.00 0.00 C ATOM 1341 NH1 ARG B 68 7.122 -3.443 5.104 1.00 0.00 N ATOM 1342 NH2 ARG B 68 8.712 -2.222 6.147 1.00 0.00 N ATOM 0 H ARG B 68 11.929 -7.731 4.277 1.00 0.00 H new ATOM 0 HA ARG B 68 9.690 -6.125 3.893 1.00 0.00 H new ATOM 0 HB2 ARG B 68 9.723 -7.435 6.532 1.00 0.00 H new ATOM 0 HB3 ARG B 68 9.847 -5.697 6.723 1.00 0.00 H new ATOM 0 HG2 ARG B 68 7.900 -5.858 4.763 1.00 0.00 H new ATOM 0 HG3 ARG B 68 7.577 -7.328 5.661 1.00 0.00 H new ATOM 0 HD2 ARG B 68 6.328 -5.301 6.580 1.00 0.00 H new ATOM 0 HD3 ARG B 68 7.358 -6.062 7.777 1.00 0.00 H new ATOM 0 HE ARG B 68 8.868 -4.174 7.668 1.00 0.00 H new ATOM 0 HH11 ARG B 68 6.568 -4.297 5.033 1.00 0.00 H new ATOM 0 HH12 ARG B 68 6.988 -2.690 4.429 1.00 0.00 H new ATOM 0 HH21 ARG B 68 9.402 -2.121 6.892 1.00 0.00 H new ATOM 0 HH22 ARG B 68 8.577 -1.470 5.471 1.00 0.00 H new ATOM 1356 N PRO B 69 12.228 -5.445 5.855 1.00 0.00 N ATOM 1357 CA PRO B 69 13.323 -4.468 6.071 1.00 0.00 C ATOM 1358 C PRO B 69 14.422 -4.667 5.023 1.00 0.00 C ATOM 1359 O PRO B 69 14.379 -4.096 3.951 1.00 0.00 O ATOM 1360 CB PRO B 69 13.829 -4.802 7.472 1.00 0.00 C ATOM 1361 CG PRO B 69 13.461 -6.236 7.683 1.00 0.00 C ATOM 1362 CD PRO B 69 12.212 -6.493 6.880 1.00 0.00 C ATOM 0 HA PRO B 69 13.003 -3.430 5.980 1.00 0.00 H new ATOM 0 HB2 PRO B 69 14.906 -4.655 7.548 1.00 0.00 H new ATOM 0 HB3 PRO B 69 13.366 -4.161 8.222 1.00 0.00 H new ATOM 0 HG2 PRO B 69 14.269 -6.893 7.360 1.00 0.00 H new ATOM 0 HG3 PRO B 69 13.288 -6.438 8.740 1.00 0.00 H new ATOM 0 HD2 PRO B 69 12.222 -7.488 6.434 1.00 0.00 H new ATOM 0 HD3 PRO B 69 11.318 -6.431 7.501 1.00 0.00 H new ATOM 1370 N GLN B 70 15.402 -5.478 5.315 1.00 0.00 N ATOM 1371 CA GLN B 70 16.491 -5.713 4.323 1.00 0.00 C ATOM 1372 C GLN B 70 15.885 -6.165 2.992 1.00 0.00 C ATOM 1373 O GLN B 70 15.759 -5.394 2.062 1.00 0.00 O ATOM 1374 CB GLN B 70 17.351 -6.822 4.929 1.00 0.00 C ATOM 1375 CG GLN B 70 18.424 -6.204 5.827 1.00 0.00 C ATOM 1376 CD GLN B 70 19.647 -7.122 5.868 1.00 0.00 C ATOM 1377 OE1 GLN B 70 19.751 -7.978 6.724 1.00 0.00 O ATOM 1378 NE2 GLN B 70 20.584 -6.981 4.970 1.00 0.00 N ATOM 0 H GLN B 70 15.496 -5.987 6.194 1.00 0.00 H new ATOM 0 HA GLN B 70 17.077 -4.816 4.123 1.00 0.00 H new ATOM 0 HB2 GLN B 70 16.728 -7.505 5.506 1.00 0.00 H new ATOM 0 HB3 GLN B 70 17.818 -7.408 4.137 1.00 0.00 H new ATOM 0 HG2 GLN B 70 18.707 -5.221 5.450 1.00 0.00 H new ATOM 0 HG3 GLN B 70 18.031 -6.059 6.833 1.00 0.00 H new ATOM 0 HE21 GLN B 70 20.497 -6.263 4.251 1.00 0.00 H new ATOM 0 HE22 GLN B 70 21.403 -7.589 4.987 1.00 0.00 H new ATOM 1387 N ALA B 71 15.495 -7.407 2.900 1.00 0.00 N ATOM 1388 CA ALA B 71 14.883 -7.905 1.636 1.00 0.00 C ATOM 1389 C ALA B 71 13.397 -8.187 1.866 1.00 0.00 C ATOM 1390 O ALA B 71 13.040 -9.163 2.495 1.00 0.00 O ATOM 1391 CB ALA B 71 15.634 -9.195 1.308 1.00 0.00 C ATOM 0 H ALA B 71 15.574 -8.098 3.646 1.00 0.00 H new ATOM 0 HA ALA B 71 14.955 -7.184 0.822 1.00 0.00 H new ATOM 0 HB1 ALA B 71 15.238 -9.622 0.387 1.00 0.00 H new ATOM 0 HB2 ALA B 71 16.694 -8.976 1.180 1.00 0.00 H new ATOM 0 HB3 ALA B 71 15.506 -9.908 2.123 1.00 0.00 H new ATOM 1397 N PRO B 72 12.579 -7.310 1.354 1.00 0.00 N ATOM 1398 CA PRO B 72 11.114 -7.450 1.510 1.00 0.00 C ATOM 1399 C PRO B 72 10.553 -8.489 0.540 1.00 0.00 C ATOM 1400 O PRO B 72 11.019 -8.633 -0.574 1.00 0.00 O ATOM 1401 CB PRO B 72 10.586 -6.060 1.173 1.00 0.00 C ATOM 1402 CG PRO B 72 11.625 -5.447 0.284 1.00 0.00 C ATOM 1403 CD PRO B 72 12.944 -6.112 0.590 1.00 0.00 C ATOM 0 HA PRO B 72 10.828 -7.788 2.506 1.00 0.00 H new ATOM 0 HB2 PRO B 72 9.621 -6.117 0.669 1.00 0.00 H new ATOM 0 HB3 PRO B 72 10.440 -5.466 2.075 1.00 0.00 H new ATOM 0 HG2 PRO B 72 11.361 -5.586 -0.764 1.00 0.00 H new ATOM 0 HG3 PRO B 72 11.690 -4.373 0.456 1.00 0.00 H new ATOM 0 HD2 PRO B 72 13.480 -6.371 -0.323 1.00 0.00 H new ATOM 0 HD3 PRO B 72 13.596 -5.456 1.167 1.00 0.00 H new ATOM 1411 N ALA B 73 9.542 -9.201 0.952 1.00 0.00 N ATOM 1412 CA ALA B 73 8.929 -10.220 0.055 1.00 0.00 C ATOM 1413 C ALA B 73 7.554 -9.726 -0.394 1.00 0.00 C ATOM 1414 O ALA B 73 6.702 -9.422 0.416 1.00 0.00 O ATOM 1415 CB ALA B 73 8.798 -11.480 0.910 1.00 0.00 C ATOM 0 H ALA B 73 9.112 -9.121 1.874 1.00 0.00 H new ATOM 0 HA ALA B 73 9.521 -10.409 -0.841 1.00 0.00 H new ATOM 0 HB1 ALA B 73 8.353 -12.278 0.316 1.00 0.00 H new ATOM 0 HB2 ALA B 73 9.785 -11.791 1.254 1.00 0.00 H new ATOM 0 HB3 ALA B 73 8.163 -11.271 1.771 1.00 0.00 H new ATOM 1421 N THR B 74 7.334 -9.623 -1.675 1.00 0.00 N ATOM 1422 CA THR B 74 6.018 -9.126 -2.156 1.00 0.00 C ATOM 1423 C THR B 74 5.193 -10.255 -2.767 1.00 0.00 C ATOM 1424 O THR B 74 5.688 -11.081 -3.508 1.00 0.00 O ATOM 1425 CB THR B 74 6.354 -8.084 -3.220 1.00 0.00 C ATOM 1426 OG1 THR B 74 6.560 -6.823 -2.600 1.00 0.00 O ATOM 1427 CG2 THR B 74 5.202 -7.982 -4.222 1.00 0.00 C ATOM 0 H THR B 74 8.005 -9.860 -2.405 1.00 0.00 H new ATOM 0 HA THR B 74 5.423 -8.714 -1.341 1.00 0.00 H new ATOM 0 HB THR B 74 7.262 -8.382 -3.745 1.00 0.00 H new ATOM 0 HG1 THR B 74 7.315 -6.368 -3.028 1.00 0.00 H new ATOM 0 HG21 THR B 74 5.444 -7.238 -4.980 1.00 0.00 H new ATOM 0 HG22 THR B 74 5.048 -8.950 -4.699 1.00 0.00 H new ATOM 0 HG23 THR B 74 4.292 -7.686 -3.701 1.00 0.00 H new ATOM 1435 N VAL B 75 3.926 -10.268 -2.478 1.00 0.00 N ATOM 1436 CA VAL B 75 3.032 -11.308 -3.053 1.00 0.00 C ATOM 1437 C VAL B 75 2.086 -10.629 -4.049 1.00 0.00 C ATOM 1438 O VAL B 75 1.634 -9.525 -3.827 1.00 0.00 O ATOM 1439 CB VAL B 75 2.263 -11.922 -1.866 1.00 0.00 C ATOM 1440 CG1 VAL B 75 2.753 -11.328 -0.539 1.00 0.00 C ATOM 1441 CG2 VAL B 75 0.764 -11.649 -2.020 1.00 0.00 C ATOM 0 H VAL B 75 3.466 -9.597 -1.863 1.00 0.00 H new ATOM 0 HA VAL B 75 3.573 -12.090 -3.585 1.00 0.00 H new ATOM 0 HB VAL B 75 2.442 -12.997 -1.860 1.00 0.00 H new ATOM 0 HG11 VAL B 75 2.198 -11.774 0.286 1.00 0.00 H new ATOM 0 HG12 VAL B 75 3.816 -11.538 -0.417 1.00 0.00 H new ATOM 0 HG13 VAL B 75 2.594 -10.250 -0.542 1.00 0.00 H new ATOM 0 HG21 VAL B 75 0.226 -12.085 -1.178 1.00 0.00 H new ATOM 0 HG22 VAL B 75 0.591 -10.573 -2.043 1.00 0.00 H new ATOM 0 HG23 VAL B 75 0.407 -12.094 -2.949 1.00 0.00 H new ATOM 1451 N GLY B 76 1.798 -11.261 -5.148 1.00 0.00 N ATOM 1452 CA GLY B 76 0.911 -10.637 -6.148 1.00 0.00 C ATOM 1453 C GLY B 76 -0.523 -11.067 -5.886 1.00 0.00 C ATOM 1454 O GLY B 76 -0.788 -12.088 -5.285 1.00 0.00 O ATOM 0 H GLY B 76 2.144 -12.189 -5.393 1.00 0.00 H new ATOM 0 HA2 GLY B 76 0.992 -9.551 -6.096 1.00 0.00 H new ATOM 0 HA3 GLY B 76 1.213 -10.931 -7.153 1.00 0.00 H new ATOM 1458 N LEU B 77 -1.440 -10.278 -6.335 1.00 0.00 N ATOM 1459 CA LEU B 77 -2.874 -10.588 -6.131 1.00 0.00 C ATOM 1460 C LEU B 77 -3.564 -10.804 -7.473 1.00 0.00 C ATOM 1461 O LEU B 77 -3.626 -9.928 -8.312 1.00 0.00 O ATOM 1462 CB LEU B 77 -3.449 -9.355 -5.438 1.00 0.00 C ATOM 1463 CG LEU B 77 -2.905 -9.271 -4.013 1.00 0.00 C ATOM 1464 CD1 LEU B 77 -3.522 -8.069 -3.299 1.00 0.00 C ATOM 1465 CD2 LEU B 77 -3.268 -10.551 -3.260 1.00 0.00 C ATOM 0 H LEU B 77 -1.257 -9.414 -6.845 1.00 0.00 H new ATOM 0 HA LEU B 77 -3.018 -11.496 -5.546 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.183 -8.456 -5.994 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.538 -9.409 -5.420 1.00 0.00 H new ATOM 0 HG LEU B 77 -1.821 -9.156 -4.042 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.133 -8.011 -2.282 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.268 -7.156 -3.838 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -4.606 -8.182 -3.267 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -2.882 -10.496 -2.242 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -4.352 -10.661 -3.232 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -2.829 -11.409 -3.769 1.00 0.00 H new ATOM 1477 N ALA B 78 -4.093 -11.966 -7.657 1.00 0.00 N ATOM 1478 CA ALA B 78 -4.810 -12.287 -8.924 1.00 0.00 C ATOM 1479 C ALA B 78 -6.112 -13.028 -8.600 1.00 0.00 C ATOM 1480 O ALA B 78 -6.113 -14.007 -7.885 1.00 0.00 O ATOM 1481 CB ALA B 78 -3.855 -13.192 -9.702 1.00 0.00 C ATOM 0 H ALA B 78 -4.064 -12.726 -6.978 1.00 0.00 H new ATOM 0 HA ALA B 78 -5.075 -11.397 -9.495 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -4.312 -13.473 -10.651 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -2.923 -12.660 -9.892 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -3.648 -14.089 -9.119 1.00 0.00 H new ATOM 1487 N PHE B 79 -7.221 -12.568 -9.110 1.00 0.00 N ATOM 1488 CA PHE B 79 -8.513 -13.253 -8.810 1.00 0.00 C ATOM 1489 C PHE B 79 -9.452 -13.187 -10.021 1.00 0.00 C ATOM 1490 O PHE B 79 -9.346 -12.308 -10.854 1.00 0.00 O ATOM 1491 CB PHE B 79 -9.096 -12.483 -7.619 1.00 0.00 C ATOM 1492 CG PHE B 79 -10.094 -11.457 -8.104 1.00 0.00 C ATOM 1493 CD1 PHE B 79 -9.649 -10.229 -8.606 1.00 0.00 C ATOM 1494 CD2 PHE B 79 -11.464 -11.737 -8.052 1.00 0.00 C ATOM 1495 CE1 PHE B 79 -10.574 -9.279 -9.056 1.00 0.00 C ATOM 1496 CE2 PHE B 79 -12.390 -10.788 -8.503 1.00 0.00 C ATOM 1497 CZ PHE B 79 -11.945 -9.559 -9.004 1.00 0.00 C ATOM 0 H PHE B 79 -7.290 -11.752 -9.718 1.00 0.00 H new ATOM 0 HA PHE B 79 -8.379 -14.311 -8.585 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -9.580 -13.175 -6.930 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -8.295 -11.991 -7.067 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -8.591 -10.014 -8.646 1.00 0.00 H new ATOM 0 HD2 PHE B 79 -11.807 -12.685 -7.664 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -10.230 -8.331 -9.443 1.00 0.00 H new ATOM 0 HE2 PHE B 79 -13.447 -11.004 -8.464 1.00 0.00 H new ATOM 0 HZ PHE B 79 -12.659 -8.827 -9.350 1.00 0.00 H new ATOM 1507 N ARG B 80 -10.371 -14.110 -10.122 1.00 0.00 N ATOM 1508 CA ARG B 80 -11.318 -14.099 -11.275 1.00 0.00 C ATOM 1509 C ARG B 80 -12.698 -13.611 -10.822 1.00 0.00 C ATOM 1510 O ARG B 80 -13.239 -14.076 -9.839 1.00 0.00 O ATOM 1511 CB ARG B 80 -11.391 -15.554 -11.740 1.00 0.00 C ATOM 1512 CG ARG B 80 -9.977 -16.087 -11.980 1.00 0.00 C ATOM 1513 CD ARG B 80 -9.921 -16.796 -13.335 1.00 0.00 C ATOM 1514 NE ARG B 80 -8.811 -17.780 -13.206 1.00 0.00 N ATOM 1515 CZ ARG B 80 -7.570 -17.376 -13.263 1.00 0.00 C ATOM 1516 NH1 ARG B 80 -7.302 -16.110 -13.431 1.00 0.00 N ATOM 1517 NH2 ARG B 80 -6.598 -18.239 -13.149 1.00 0.00 N ATOM 0 H ARG B 80 -10.507 -14.871 -9.456 1.00 0.00 H new ATOM 0 HA ARG B 80 -10.991 -13.431 -12.072 1.00 0.00 H new ATOM 0 HB2 ARG B 80 -11.897 -16.161 -10.990 1.00 0.00 H new ATOM 0 HB3 ARG B 80 -11.978 -15.625 -12.656 1.00 0.00 H new ATOM 0 HG2 ARG B 80 -9.259 -15.267 -11.957 1.00 0.00 H new ATOM 0 HG3 ARG B 80 -9.698 -16.778 -11.184 1.00 0.00 H new ATOM 0 HD2 ARG B 80 -10.865 -17.292 -13.561 1.00 0.00 H new ATOM 0 HD3 ARG B 80 -9.731 -16.090 -14.143 1.00 0.00 H new ATOM 0 HE ARG B 80 -9.020 -18.770 -13.073 1.00 0.00 H new ATOM 0 HH11 ARG B 80 -8.062 -15.435 -13.518 1.00 0.00 H new ATOM 0 HH12 ARG B 80 -6.333 -15.795 -13.475 1.00 0.00 H new ATOM 0 HH21 ARG B 80 -6.807 -19.228 -13.016 1.00 0.00 H new ATOM 0 HH22 ARG B 80 -5.629 -17.924 -13.193 1.00 0.00 H new ATOM 1599 N GLU B 86 -7.496 -11.309 -13.532 1.00 0.00 N ATOM 1600 CA GLU B 86 -6.229 -11.651 -12.827 1.00 0.00 C ATOM 1601 C GLU B 86 -5.192 -10.542 -13.024 1.00 0.00 C ATOM 1602 O GLU B 86 -4.475 -10.520 -14.005 1.00 0.00 O ATOM 1603 CB GLU B 86 -5.753 -12.950 -13.478 1.00 0.00 C ATOM 1604 CG GLU B 86 -4.898 -13.738 -12.484 1.00 0.00 C ATOM 1605 CD GLU B 86 -4.119 -14.824 -13.227 1.00 0.00 C ATOM 1606 OE1 GLU B 86 -3.460 -14.491 -14.199 1.00 0.00 O ATOM 1607 OE2 GLU B 86 -4.193 -15.968 -12.812 1.00 0.00 O ATOM 0 HA GLU B 86 -6.373 -11.760 -11.752 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -6.610 -13.547 -13.790 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -5.175 -12.729 -14.375 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -4.208 -13.068 -11.971 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -5.532 -14.189 -11.721 1.00 0.00 H new ATOM 1614 N ALA B 87 -5.103 -9.624 -12.101 1.00 0.00 N ATOM 1615 CA ALA B 87 -4.106 -8.525 -12.242 1.00 0.00 C ATOM 1616 C ALA B 87 -2.771 -9.096 -12.726 1.00 0.00 C ATOM 1617 O ALA B 87 -2.452 -9.043 -13.897 1.00 0.00 O ATOM 1618 CB ALA B 87 -3.963 -7.932 -10.839 1.00 0.00 C ATOM 0 H ALA B 87 -5.676 -9.587 -11.258 1.00 0.00 H new ATOM 0 HA ALA B 87 -4.415 -7.772 -12.967 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -3.243 -7.114 -10.861 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -4.929 -7.556 -10.503 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -3.615 -8.703 -10.152 1.00 0.00 H new ATOM 1624 N LEU B 88 -1.991 -9.638 -11.828 1.00 0.00 N ATOM 1625 CA LEU B 88 -0.670 -10.222 -12.210 1.00 0.00 C ATOM 1626 C LEU B 88 0.365 -9.111 -12.378 1.00 0.00 C ATOM 1627 O LEU B 88 1.550 -9.329 -12.216 1.00 0.00 O ATOM 1628 CB LEU B 88 -0.899 -10.966 -13.528 1.00 0.00 C ATOM 1629 CG LEU B 88 -0.368 -12.395 -13.399 1.00 0.00 C ATOM 1630 CD1 LEU B 88 0.987 -12.379 -12.686 1.00 0.00 C ATOM 1631 CD2 LEU B 88 -1.358 -13.231 -12.586 1.00 0.00 C ATOM 0 H LEU B 88 -2.215 -9.702 -10.835 1.00 0.00 H new ATOM 0 HA LEU B 88 -0.289 -10.898 -11.445 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -1.961 -10.981 -13.771 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -0.393 -10.450 -14.343 1.00 0.00 H new ATOM 0 HG LEU B 88 -0.249 -12.828 -14.392 1.00 0.00 H new ATOM 0 HD11 LEU B 88 1.363 -13.398 -12.596 1.00 0.00 H new ATOM 0 HD12 LEU B 88 1.694 -11.781 -13.262 1.00 0.00 H new ATOM 0 HD13 LEU B 88 0.870 -11.946 -11.693 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.983 -14.250 -12.492 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -1.474 -12.794 -11.594 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -2.324 -13.245 -13.092 1.00 0.00 H new ATOM 1643 N CYS B 89 -0.068 -7.914 -12.659 1.00 0.00 N ATOM 1644 CA CYS B 89 0.888 -6.797 -12.784 1.00 0.00 C ATOM 1645 C CYS B 89 0.488 -5.766 -11.748 1.00 0.00 C ATOM 1646 O CYS B 89 -0.531 -5.119 -11.865 1.00 0.00 O ATOM 1647 CB CYS B 89 0.704 -6.248 -14.199 1.00 0.00 C ATOM 1648 SG CYS B 89 0.593 -7.622 -15.374 1.00 0.00 S ATOM 0 H CYS B 89 -1.047 -7.668 -12.807 1.00 0.00 H new ATOM 0 HA CYS B 89 1.928 -7.082 -12.626 1.00 0.00 H new ATOM 0 HB2 CYS B 89 -0.199 -5.639 -14.249 1.00 0.00 H new ATOM 0 HB3 CYS B 89 1.540 -5.600 -14.460 1.00 0.00 H new ATOM 0 HG CYS B 89 0.434 -7.153 -16.576 1.00 0.00 H new ATOM 1654 N ILE B 90 1.254 -5.624 -10.719 1.00 0.00 N ATOM 1655 CA ILE B 90 0.866 -4.653 -9.675 1.00 0.00 C ATOM 1656 C ILE B 90 1.490 -3.298 -9.952 1.00 0.00 C ATOM 1657 O ILE B 90 2.673 -3.095 -9.778 1.00 0.00 O ATOM 1658 CB ILE B 90 1.412 -5.240 -8.379 1.00 0.00 C ATOM 1659 CG1 ILE B 90 0.830 -6.640 -8.180 1.00 0.00 C ATOM 1660 CG2 ILE B 90 1.018 -4.344 -7.204 1.00 0.00 C ATOM 1661 CD1 ILE B 90 1.963 -7.664 -8.185 1.00 0.00 C ATOM 0 H ILE B 90 2.124 -6.131 -10.554 1.00 0.00 H new ATOM 0 HA ILE B 90 -0.212 -4.497 -9.635 1.00 0.00 H new ATOM 0 HB ILE B 90 2.499 -5.301 -8.431 1.00 0.00 H new ATOM 0 HG12 ILE B 90 0.285 -6.689 -7.237 1.00 0.00 H new ATOM 0 HG13 ILE B 90 0.117 -6.866 -8.973 1.00 0.00 H new ATOM 0 HG21 ILE B 90 1.409 -4.765 -6.278 1.00 0.00 H new ATOM 0 HG22 ILE B 90 1.432 -3.347 -7.352 1.00 0.00 H new ATOM 0 HG23 ILE B 90 -0.068 -4.281 -7.143 1.00 0.00 H new ATOM 0 HD11 ILE B 90 1.551 -8.663 -8.043 1.00 0.00 H new ATOM 0 HD12 ILE B 90 2.489 -7.620 -9.139 1.00 0.00 H new ATOM 0 HD13 ILE B 90 2.659 -7.441 -7.376 1.00 0.00 H new ATOM 1673 N GLU B 91 0.685 -2.368 -10.368 1.00 0.00 N ATOM 1674 CA GLU B 91 1.208 -0.999 -10.647 1.00 0.00 C ATOM 1675 C GLU B 91 1.433 -0.262 -9.322 1.00 0.00 C ATOM 1676 O GLU B 91 0.490 0.143 -8.672 1.00 0.00 O ATOM 1677 CB GLU B 91 0.114 -0.313 -11.466 1.00 0.00 C ATOM 1678 CG GLU B 91 0.541 1.119 -11.793 1.00 0.00 C ATOM 1679 CD GLU B 91 -0.446 2.103 -11.162 1.00 0.00 C ATOM 1680 OE1 GLU B 91 -0.753 1.935 -9.992 1.00 0.00 O ATOM 1681 OE2 GLU B 91 -0.878 3.006 -11.857 1.00 0.00 O ATOM 0 H GLU B 91 -0.315 -2.492 -10.529 1.00 0.00 H new ATOM 0 HA GLU B 91 2.158 -1.011 -11.180 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -0.068 -0.868 -12.386 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -0.822 -0.306 -10.908 1.00 0.00 H new ATOM 0 HG2 GLU B 91 1.547 1.305 -11.416 1.00 0.00 H new ATOM 0 HG3 GLU B 91 0.573 1.262 -12.873 1.00 0.00 H new ATOM 1688 N PRO B 92 2.680 -0.132 -8.955 1.00 0.00 N ATOM 1689 CA PRO B 92 3.034 0.535 -7.687 1.00 0.00 C ATOM 1690 C PRO B 92 3.198 2.044 -7.897 1.00 0.00 C ATOM 1691 O PRO B 92 2.236 2.785 -7.927 1.00 0.00 O ATOM 1692 CB PRO B 92 4.366 -0.113 -7.322 1.00 0.00 C ATOM 1693 CG PRO B 92 4.961 -0.584 -8.621 1.00 0.00 C ATOM 1694 CD PRO B 92 3.871 -0.586 -9.671 1.00 0.00 C ATOM 0 HA PRO B 92 2.276 0.424 -6.912 1.00 0.00 H new ATOM 0 HB2 PRO B 92 5.025 0.600 -6.826 1.00 0.00 H new ATOM 0 HB3 PRO B 92 4.220 -0.946 -6.634 1.00 0.00 H new ATOM 0 HG2 PRO B 92 5.778 0.071 -8.924 1.00 0.00 H new ATOM 0 HG3 PRO B 92 5.379 -1.584 -8.506 1.00 0.00 H new ATOM 0 HD2 PRO B 92 4.115 0.079 -10.499 1.00 0.00 H new ATOM 0 HD3 PRO B 92 3.727 -1.581 -10.093 1.00 0.00 H new ATOM 1702 N PHE B 93 4.412 2.505 -8.036 1.00 0.00 N ATOM 1703 CA PHE B 93 4.640 3.964 -8.236 1.00 0.00 C ATOM 1704 C PHE B 93 5.971 4.192 -8.959 1.00 0.00 C ATOM 1705 O PHE B 93 6.480 3.318 -9.631 1.00 0.00 O ATOM 1706 CB PHE B 93 4.684 4.552 -6.825 1.00 0.00 C ATOM 1707 CG PHE B 93 5.377 3.588 -5.891 1.00 0.00 C ATOM 1708 CD1 PHE B 93 4.673 2.501 -5.359 1.00 0.00 C ATOM 1709 CD2 PHE B 93 6.722 3.782 -5.558 1.00 0.00 C ATOM 1710 CE1 PHE B 93 5.316 1.607 -4.494 1.00 0.00 C ATOM 1711 CE2 PHE B 93 7.365 2.888 -4.693 1.00 0.00 C ATOM 1712 CZ PHE B 93 6.662 1.800 -4.161 1.00 0.00 C ATOM 0 H PHE B 93 5.256 1.933 -8.020 1.00 0.00 H new ATOM 0 HA PHE B 93 3.864 4.428 -8.845 1.00 0.00 H new ATOM 0 HB2 PHE B 93 5.211 5.506 -6.835 1.00 0.00 H new ATOM 0 HB3 PHE B 93 3.672 4.751 -6.472 1.00 0.00 H new ATOM 0 HD1 PHE B 93 3.635 2.352 -5.616 1.00 0.00 H new ATOM 0 HD2 PHE B 93 7.264 4.621 -5.968 1.00 0.00 H new ATOM 0 HE1 PHE B 93 4.773 0.768 -4.084 1.00 0.00 H new ATOM 0 HE2 PHE B 93 8.403 3.038 -4.436 1.00 0.00 H new ATOM 0 HZ PHE B 93 7.158 1.110 -3.494 1.00 0.00 H new ATOM 2071 N MET C 17 -5.627 -5.083 13.948 1.00 0.00 N ATOM 2072 CA MET C 17 -6.404 -4.196 13.034 1.00 0.00 C ATOM 2073 C MET C 17 -5.521 -3.728 11.873 1.00 0.00 C ATOM 2074 O MET C 17 -4.309 -3.762 11.949 1.00 0.00 O ATOM 2075 CB MET C 17 -6.826 -3.008 13.899 1.00 0.00 C ATOM 2076 CG MET C 17 -8.297 -2.680 13.633 1.00 0.00 C ATOM 2077 SD MET C 17 -9.324 -4.094 14.105 1.00 0.00 S ATOM 2078 CE MET C 17 -10.806 -3.614 13.186 1.00 0.00 C ATOM 0 HA MET C 17 -7.262 -4.706 12.595 1.00 0.00 H new ATOM 0 HB2 MET C 17 -6.679 -3.242 14.953 1.00 0.00 H new ATOM 0 HB3 MET C 17 -6.203 -2.142 13.675 1.00 0.00 H new ATOM 0 HG2 MET C 17 -8.592 -1.797 14.200 1.00 0.00 H new ATOM 0 HG3 MET C 17 -8.444 -2.446 12.579 1.00 0.00 H new ATOM 0 HE1 MET C 17 -11.586 -4.361 13.337 1.00 0.00 H new ATOM 0 HE2 MET C 17 -11.157 -2.646 13.542 1.00 0.00 H new ATOM 0 HE3 MET C 17 -10.570 -3.546 12.124 1.00 0.00 H new ATOM 2088 N TYR C 18 -6.122 -3.292 10.800 1.00 0.00 N ATOM 2089 CA TYR C 18 -5.317 -2.823 9.635 1.00 0.00 C ATOM 2090 C TYR C 18 -5.692 -1.381 9.280 1.00 0.00 C ATOM 2091 O TYR C 18 -6.806 -0.948 9.500 1.00 0.00 O ATOM 2092 CB TYR C 18 -5.691 -3.766 8.489 1.00 0.00 C ATOM 2093 CG TYR C 18 -4.535 -4.689 8.185 1.00 0.00 C ATOM 2094 CD1 TYR C 18 -3.220 -4.215 8.255 1.00 0.00 C ATOM 2095 CD2 TYR C 18 -4.781 -6.021 7.831 1.00 0.00 C ATOM 2096 CE1 TYR C 18 -2.150 -5.073 7.972 1.00 0.00 C ATOM 2097 CE2 TYR C 18 -3.711 -6.880 7.549 1.00 0.00 C ATOM 2098 CZ TYR C 18 -2.396 -6.405 7.619 1.00 0.00 C ATOM 2099 OH TYR C 18 -1.342 -7.251 7.341 1.00 0.00 O ATOM 0 H TYR C 18 -7.133 -3.240 10.679 1.00 0.00 H new ATOM 0 HA TYR C 18 -4.247 -2.834 9.843 1.00 0.00 H new ATOM 0 HB2 TYR C 18 -6.572 -4.349 8.759 1.00 0.00 H new ATOM 0 HB3 TYR C 18 -5.950 -3.189 7.601 1.00 0.00 H new ATOM 0 HD1 TYR C 18 -3.030 -3.187 8.527 1.00 0.00 H new ATOM 0 HD2 TYR C 18 -5.796 -6.386 7.775 1.00 0.00 H new ATOM 0 HE1 TYR C 18 -1.135 -4.707 8.026 1.00 0.00 H new ATOM 0 HE2 TYR C 18 -3.900 -7.908 7.278 1.00 0.00 H new ATOM 0 HH TYR C 18 -1.444 -8.080 7.854 1.00 0.00 H new ATOM 2109 N VAL C 19 -4.774 -0.637 8.725 1.00 0.00 N ATOM 2110 CA VAL C 19 -5.086 0.772 8.350 1.00 0.00 C ATOM 2111 C VAL C 19 -4.581 1.062 6.933 1.00 0.00 C ATOM 2112 O VAL C 19 -3.513 0.638 6.542 1.00 0.00 O ATOM 2113 CB VAL C 19 -4.352 1.637 9.378 1.00 0.00 C ATOM 2114 CG1 VAL C 19 -2.846 1.604 9.109 1.00 0.00 C ATOM 2115 CG2 VAL C 19 -4.853 3.080 9.277 1.00 0.00 C ATOM 0 H VAL C 19 -3.824 -0.943 8.515 1.00 0.00 H new ATOM 0 HA VAL C 19 -6.157 0.973 8.352 1.00 0.00 H new ATOM 0 HB VAL C 19 -4.546 1.247 10.377 1.00 0.00 H new ATOM 0 HG11 VAL C 19 -2.331 2.222 9.845 1.00 0.00 H new ATOM 0 HG12 VAL C 19 -2.486 0.578 9.181 1.00 0.00 H new ATOM 0 HG13 VAL C 19 -2.647 1.989 8.109 1.00 0.00 H new ATOM 0 HG21 VAL C 19 -4.332 3.698 10.008 1.00 0.00 H new ATOM 0 HG22 VAL C 19 -4.660 3.463 8.275 1.00 0.00 H new ATOM 0 HG23 VAL C 19 -5.924 3.108 9.476 1.00 0.00 H new ATOM 2125 N LYS C 20 -5.351 1.772 6.153 1.00 0.00 N ATOM 2126 CA LYS C 20 -4.927 2.079 4.765 1.00 0.00 C ATOM 2127 C LYS C 20 -4.444 3.529 4.660 1.00 0.00 C ATOM 2128 O LYS C 20 -5.040 4.432 5.210 1.00 0.00 O ATOM 2129 CB LYS C 20 -6.183 1.869 3.919 1.00 0.00 C ATOM 2130 CG LYS C 20 -7.433 2.265 4.710 1.00 0.00 C ATOM 2131 CD LYS C 20 -8.631 2.348 3.763 1.00 0.00 C ATOM 2132 CE LYS C 20 -9.784 1.508 4.321 1.00 0.00 C ATOM 2133 NZ LYS C 20 -9.763 0.250 3.524 1.00 0.00 N ATOM 0 H LYS C 20 -6.258 2.152 6.422 1.00 0.00 H new ATOM 0 HA LYS C 20 -4.099 1.450 4.437 1.00 0.00 H new ATOM 0 HB2 LYS C 20 -6.119 2.463 3.007 1.00 0.00 H new ATOM 0 HB3 LYS C 20 -6.253 0.825 3.614 1.00 0.00 H new ATOM 0 HG2 LYS C 20 -7.626 1.534 5.495 1.00 0.00 H new ATOM 0 HG3 LYS C 20 -7.277 3.226 5.201 1.00 0.00 H new ATOM 0 HD2 LYS C 20 -8.946 3.385 3.648 1.00 0.00 H new ATOM 0 HD3 LYS C 20 -8.351 1.988 2.773 1.00 0.00 H new ATOM 0 HE2 LYS C 20 -9.647 1.305 5.383 1.00 0.00 H new ATOM 0 HE3 LYS C 20 -10.737 2.026 4.216 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 -10.525 -0.379 3.848 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 -9.903 0.474 2.518 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 -8.846 -0.225 3.649 1.00 0.00 H new ATOM 2147 N LEU C 21 -3.374 3.758 3.948 1.00 0.00 N ATOM 2148 CA LEU C 21 -2.861 5.150 3.799 1.00 0.00 C ATOM 2149 C LEU C 21 -2.945 5.562 2.327 1.00 0.00 C ATOM 2150 O LEU C 21 -2.570 4.815 1.445 1.00 0.00 O ATOM 2151 CB LEU C 21 -1.396 5.120 4.261 1.00 0.00 C ATOM 2152 CG LEU C 21 -1.127 3.893 5.140 1.00 0.00 C ATOM 2153 CD1 LEU C 21 0.377 3.759 5.379 1.00 0.00 C ATOM 2154 CD2 LEU C 21 -1.838 4.053 6.484 1.00 0.00 C ATOM 0 H LEU C 21 -2.833 3.042 3.463 1.00 0.00 H new ATOM 0 HA LEU C 21 -3.440 5.864 4.385 1.00 0.00 H new ATOM 0 HB2 LEU C 21 -0.737 5.103 3.393 1.00 0.00 H new ATOM 0 HB3 LEU C 21 -1.167 6.029 4.817 1.00 0.00 H new ATOM 0 HG LEU C 21 -1.501 3.002 4.636 1.00 0.00 H new ATOM 0 HD11 LEU C 21 0.570 2.887 6.004 1.00 0.00 H new ATOM 0 HD12 LEU C 21 0.888 3.641 4.424 1.00 0.00 H new ATOM 0 HD13 LEU C 21 0.747 4.653 5.880 1.00 0.00 H new ATOM 0 HD21 LEU C 21 -1.644 3.178 7.105 1.00 0.00 H new ATOM 0 HD22 LEU C 21 -1.467 4.945 6.988 1.00 0.00 H new ATOM 0 HD23 LEU C 21 -2.911 4.149 6.319 1.00 0.00 H new ATOM 2166 N ILE C 22 -3.437 6.737 2.051 1.00 0.00 N ATOM 2167 CA ILE C 22 -3.544 7.178 0.636 1.00 0.00 C ATOM 2168 C ILE C 22 -2.534 8.292 0.353 1.00 0.00 C ATOM 2169 O ILE C 22 -2.284 9.148 1.178 1.00 0.00 O ATOM 2170 CB ILE C 22 -4.976 7.694 0.494 1.00 0.00 C ATOM 2171 CG1 ILE C 22 -5.903 6.529 0.136 1.00 0.00 C ATOM 2172 CG2 ILE C 22 -5.037 8.750 -0.609 1.00 0.00 C ATOM 2173 CD1 ILE C 22 -6.284 5.770 1.408 1.00 0.00 C ATOM 0 H ILE C 22 -3.769 7.409 2.743 1.00 0.00 H new ATOM 0 HA ILE C 22 -3.330 6.374 -0.069 1.00 0.00 H new ATOM 0 HB ILE C 22 -5.294 8.139 1.437 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -6.799 6.903 -0.359 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -5.407 5.858 -0.566 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -6.059 9.115 -0.707 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -4.378 9.580 -0.355 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -4.717 8.309 -1.553 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.944 4.941 1.153 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -5.383 5.384 1.885 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -6.797 6.444 2.094 1.00 0.00 H new ATOM 2185 N SER C 23 -1.954 8.279 -0.811 1.00 0.00 N ATOM 2186 CA SER C 23 -0.956 9.329 -1.166 1.00 0.00 C ATOM 2187 C SER C 23 -1.521 10.249 -2.251 1.00 0.00 C ATOM 2188 O SER C 23 -2.364 9.858 -3.034 1.00 0.00 O ATOM 2189 CB SER C 23 0.255 8.560 -1.693 1.00 0.00 C ATOM 2190 OG SER C 23 0.439 7.384 -0.916 1.00 0.00 O ATOM 0 H SER C 23 -2.127 7.584 -1.537 1.00 0.00 H new ATOM 0 HA SER C 23 -0.700 9.961 -0.316 1.00 0.00 H new ATOM 0 HB2 SER C 23 0.106 8.298 -2.741 1.00 0.00 H new ATOM 0 HB3 SER C 23 1.147 9.185 -1.644 1.00 0.00 H new ATOM 0 HG SER C 23 -0.003 6.628 -1.357 1.00 0.00 H new ATOM 2196 N SER C 24 -1.065 11.470 -2.302 1.00 0.00 N ATOM 2197 CA SER C 24 -1.577 12.416 -3.335 1.00 0.00 C ATOM 2198 C SER C 24 -1.350 11.847 -4.740 1.00 0.00 C ATOM 2199 O SER C 24 -1.897 12.334 -5.710 1.00 0.00 O ATOM 2200 CB SER C 24 -0.762 13.693 -3.138 1.00 0.00 C ATOM 2201 OG SER C 24 -1.642 14.810 -3.100 1.00 0.00 O ATOM 0 H SER C 24 -0.360 11.854 -1.673 1.00 0.00 H new ATOM 0 HA SER C 24 -2.648 12.593 -3.236 1.00 0.00 H new ATOM 0 HB2 SER C 24 -0.190 13.634 -2.212 1.00 0.00 H new ATOM 0 HB3 SER C 24 -0.044 13.809 -3.950 1.00 0.00 H new ATOM 0 HG SER C 24 -1.558 15.263 -2.235 1.00 0.00 H new ATOM 2207 N ASP C 25 -0.550 10.824 -4.859 1.00 0.00 N ATOM 2208 CA ASP C 25 -0.294 10.231 -6.204 1.00 0.00 C ATOM 2209 C ASP C 25 -1.546 9.512 -6.713 1.00 0.00 C ATOM 2210 O ASP C 25 -1.884 9.584 -7.878 1.00 0.00 O ATOM 2211 CB ASP C 25 0.847 9.236 -5.988 1.00 0.00 C ATOM 2212 CG ASP C 25 2.187 9.938 -6.215 1.00 0.00 C ATOM 2213 OD1 ASP C 25 2.482 10.863 -5.477 1.00 0.00 O ATOM 2214 OD2 ASP C 25 2.896 9.537 -7.124 1.00 0.00 O ATOM 0 H ASP C 25 -0.062 10.373 -4.085 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.040 10.987 -6.947 1.00 0.00 H new ATOM 0 HB2 ASP C 25 0.804 8.831 -4.977 1.00 0.00 H new ATOM 0 HB3 ASP C 25 0.745 8.395 -6.673 1.00 0.00 H new ATOM 2219 N GLY C 26 -2.237 8.820 -5.849 1.00 0.00 N ATOM 2220 CA GLY C 26 -3.466 8.098 -6.286 1.00 0.00 C ATOM 2221 C GLY C 26 -3.375 6.630 -5.867 1.00 0.00 C ATOM 2222 O GLY C 26 -4.303 5.866 -6.042 1.00 0.00 O ATOM 0 H GLY C 26 -2.004 8.723 -4.861 1.00 0.00 H new ATOM 0 HA2 GLY C 26 -4.348 8.559 -5.842 1.00 0.00 H new ATOM 0 HA3 GLY C 26 -3.578 8.172 -7.368 1.00 0.00 H new ATOM 2226 N HIS C 27 -2.262 6.228 -5.314 1.00 0.00 N ATOM 2227 CA HIS C 27 -2.116 4.807 -4.884 1.00 0.00 C ATOM 2228 C HIS C 27 -2.479 4.663 -3.404 1.00 0.00 C ATOM 2229 O HIS C 27 -2.706 5.639 -2.716 1.00 0.00 O ATOM 2230 CB HIS C 27 -0.641 4.475 -5.113 1.00 0.00 C ATOM 2231 CG HIS C 27 -0.280 4.764 -6.544 1.00 0.00 C ATOM 2232 ND1 HIS C 27 -0.191 5.940 -7.248 1.00 0.00 N flip ATOM 2233 CD2 HIS C 27 0.045 3.760 -7.442 1.00 0.00 C flip ATOM 2234 CE1 HIS C 27 0.183 5.672 -8.562 1.00 0.00 C flip ATOM 2235 NE2 HIS C 27 0.312 4.344 -8.625 1.00 0.00 N flip ATOM 0 H HIS C 27 -1.450 6.820 -5.142 1.00 0.00 H new ATOM 0 HA HIS C 27 -2.774 4.137 -5.437 1.00 0.00 H new ATOM 0 HB2 HIS C 27 -0.016 5.065 -4.443 1.00 0.00 H new ATOM 0 HB3 HIS C 27 -0.453 3.426 -4.884 1.00 0.00 H new ATOM 0 HD2 HIS C 27 0.078 2.701 -7.231 1.00 0.00 H new ATOM 0 HE1 HIS C 27 0.336 6.385 -9.359 1.00 0.00 H new ATOM 0 HE2 HIS C 27 0.580 3.835 -9.467 1.00 0.00 H new ATOM 2243 N GLU C 28 -2.536 3.457 -2.909 1.00 0.00 N ATOM 2244 CA GLU C 28 -2.885 3.263 -1.473 1.00 0.00 C ATOM 2245 C GLU C 28 -1.985 2.209 -0.835 1.00 0.00 C ATOM 2246 O GLU C 28 -1.450 1.338 -1.492 1.00 0.00 O ATOM 2247 CB GLU C 28 -4.337 2.793 -1.470 1.00 0.00 C ATOM 2248 CG GLU C 28 -4.679 2.194 -0.104 1.00 0.00 C ATOM 2249 CD GLU C 28 -6.199 2.138 0.063 1.00 0.00 C ATOM 2250 OE1 GLU C 28 -6.844 3.130 -0.232 1.00 0.00 O ATOM 2251 OE2 GLU C 28 -6.691 1.104 0.483 1.00 0.00 O ATOM 0 H GLU C 28 -2.357 2.601 -3.434 1.00 0.00 H new ATOM 0 HA GLU C 28 -2.751 4.180 -0.899 1.00 0.00 H new ATOM 0 HB2 GLU C 28 -5.001 3.629 -1.688 1.00 0.00 H new ATOM 0 HB3 GLU C 28 -4.491 2.051 -2.253 1.00 0.00 H new ATOM 0 HG2 GLU C 28 -4.256 1.193 -0.018 1.00 0.00 H new ATOM 0 HG3 GLU C 28 -4.237 2.796 0.690 1.00 0.00 H new ATOM 2258 N PHE C 29 -1.829 2.293 0.448 1.00 0.00 N ATOM 2259 CA PHE C 29 -0.977 1.315 1.184 1.00 0.00 C ATOM 2260 C PHE C 29 -1.623 1.006 2.531 1.00 0.00 C ATOM 2261 O PHE C 29 -2.126 1.883 3.199 1.00 0.00 O ATOM 2262 CB PHE C 29 0.368 2.022 1.374 1.00 0.00 C ATOM 2263 CG PHE C 29 1.000 2.278 0.025 1.00 0.00 C ATOM 2264 CD1 PHE C 29 0.521 3.311 -0.790 1.00 0.00 C ATOM 2265 CD2 PHE C 29 2.065 1.480 -0.412 1.00 0.00 C ATOM 2266 CE1 PHE C 29 1.104 3.545 -2.041 1.00 0.00 C ATOM 2267 CE2 PHE C 29 2.649 1.715 -1.662 1.00 0.00 C ATOM 2268 CZ PHE C 29 2.169 2.748 -2.477 1.00 0.00 C ATOM 0 H PHE C 29 -2.261 3.008 1.034 1.00 0.00 H new ATOM 0 HA PHE C 29 -0.857 0.370 0.654 1.00 0.00 H new ATOM 0 HB2 PHE C 29 0.224 2.963 1.904 1.00 0.00 H new ATOM 0 HB3 PHE C 29 1.029 1.409 1.987 1.00 0.00 H new ATOM 0 HD1 PHE C 29 -0.299 3.928 -0.453 1.00 0.00 H new ATOM 0 HD2 PHE C 29 2.436 0.683 0.216 1.00 0.00 H new ATOM 0 HE1 PHE C 29 0.732 4.340 -2.670 1.00 0.00 H new ATOM 0 HE2 PHE C 29 3.470 1.099 -1.998 1.00 0.00 H new ATOM 0 HZ PHE C 29 2.620 2.930 -3.441 1.00 0.00 H new ATOM 2278 N ILE C 30 -1.640 -0.232 2.932 1.00 0.00 N ATOM 2279 CA ILE C 30 -2.284 -0.570 4.231 1.00 0.00 C ATOM 2280 C ILE C 30 -1.255 -1.093 5.235 1.00 0.00 C ATOM 2281 O ILE C 30 -0.512 -2.012 4.958 1.00 0.00 O ATOM 2282 CB ILE C 30 -3.301 -1.658 3.892 1.00 0.00 C ATOM 2283 CG1 ILE C 30 -4.090 -1.246 2.645 1.00 0.00 C ATOM 2284 CG2 ILE C 30 -4.263 -1.844 5.066 1.00 0.00 C ATOM 2285 CD1 ILE C 30 -3.866 -2.271 1.531 1.00 0.00 C ATOM 0 H ILE C 30 -1.240 -1.020 2.422 1.00 0.00 H new ATOM 0 HA ILE C 30 -2.747 0.302 4.693 1.00 0.00 H new ATOM 0 HB ILE C 30 -2.779 -2.596 3.700 1.00 0.00 H new ATOM 0 HG12 ILE C 30 -5.152 -1.177 2.881 1.00 0.00 H new ATOM 0 HG13 ILE C 30 -3.773 -0.258 2.312 1.00 0.00 H new ATOM 0 HG21 ILE C 30 -4.988 -2.621 4.823 1.00 0.00 H new ATOM 0 HG22 ILE C 30 -3.702 -2.137 5.953 1.00 0.00 H new ATOM 0 HG23 ILE C 30 -4.786 -0.907 5.260 1.00 0.00 H new ATOM 0 HD11 ILE C 30 -4.429 -1.975 0.646 1.00 0.00 H new ATOM 0 HD12 ILE C 30 -2.805 -2.318 1.288 1.00 0.00 H new ATOM 0 HD13 ILE C 30 -4.205 -3.252 1.865 1.00 0.00 H new ATOM 2297 N VAL C 31 -1.221 -0.519 6.408 1.00 0.00 N ATOM 2298 CA VAL C 31 -0.255 -0.989 7.440 1.00 0.00 C ATOM 2299 C VAL C 31 -1.022 -1.430 8.692 1.00 0.00 C ATOM 2300 O VAL C 31 -1.979 -0.804 9.098 1.00 0.00 O ATOM 2301 CB VAL C 31 0.638 0.216 7.739 1.00 0.00 C ATOM 2302 CG1 VAL C 31 1.331 0.670 6.452 1.00 0.00 C ATOM 2303 CG2 VAL C 31 -0.209 1.363 8.290 1.00 0.00 C ATOM 0 H VAL C 31 -1.821 0.255 6.695 1.00 0.00 H new ATOM 0 HA VAL C 31 0.336 -1.842 7.106 1.00 0.00 H new ATOM 0 HB VAL C 31 1.387 -0.067 8.478 1.00 0.00 H new ATOM 0 HG11 VAL C 31 1.967 1.529 6.665 1.00 0.00 H new ATOM 0 HG12 VAL C 31 1.940 -0.145 6.060 1.00 0.00 H new ATOM 0 HG13 VAL C 31 0.580 0.949 5.713 1.00 0.00 H new ATOM 0 HG21 VAL C 31 0.431 2.219 8.502 1.00 0.00 H new ATOM 0 HG22 VAL C 31 -0.962 1.646 7.554 1.00 0.00 H new ATOM 0 HG23 VAL C 31 -0.702 1.043 9.208 1.00 0.00 H new ATOM 2313 N LYS C 32 -0.617 -2.513 9.293 1.00 0.00 N ATOM 2314 CA LYS C 32 -1.331 -3.008 10.506 1.00 0.00 C ATOM 2315 C LYS C 32 -1.390 -1.918 11.578 1.00 0.00 C ATOM 2316 O LYS C 32 -0.483 -1.123 11.717 1.00 0.00 O ATOM 2317 CB LYS C 32 -0.501 -4.195 10.996 1.00 0.00 C ATOM 2318 CG LYS C 32 -1.228 -4.884 12.153 1.00 0.00 C ATOM 2319 CD LYS C 32 -0.220 -5.667 12.996 1.00 0.00 C ATOM 2320 CE LYS C 32 0.665 -6.514 12.079 1.00 0.00 C ATOM 2321 NZ LYS C 32 -0.258 -7.508 11.466 1.00 0.00 N ATOM 0 H LYS C 32 0.179 -3.079 8.997 1.00 0.00 H new ATOM 0 HA LYS C 32 -2.361 -3.289 10.288 1.00 0.00 H new ATOM 0 HB2 LYS C 32 -0.341 -4.901 10.181 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.482 -3.855 11.321 1.00 0.00 H new ATOM 0 HG2 LYS C 32 -1.736 -4.143 12.770 1.00 0.00 H new ATOM 0 HG3 LYS C 32 -1.994 -5.556 11.766 1.00 0.00 H new ATOM 0 HD2 LYS C 32 0.394 -4.980 13.578 1.00 0.00 H new ATOM 0 HD3 LYS C 32 -0.743 -6.307 13.706 1.00 0.00 H new ATOM 0 HE2 LYS C 32 1.147 -5.900 11.318 1.00 0.00 H new ATOM 0 HE3 LYS C 32 1.459 -7.006 12.641 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 0.293 -8.299 11.076 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 -0.913 -7.866 12.190 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 -0.800 -7.054 10.703 1.00 0.00 H new ATOM 2335 N ARG C 33 -2.454 -1.882 12.339 1.00 0.00 N ATOM 2336 CA ARG C 33 -2.574 -0.850 13.410 1.00 0.00 C ATOM 2337 C ARG C 33 -1.196 -0.574 14.018 1.00 0.00 C ATOM 2338 O ARG C 33 -0.794 0.560 14.183 1.00 0.00 O ATOM 2339 CB ARG C 33 -3.525 -1.468 14.444 1.00 0.00 C ATOM 2340 CG ARG C 33 -2.929 -1.346 15.850 1.00 0.00 C ATOM 2341 CD ARG C 33 -3.904 -1.934 16.871 1.00 0.00 C ATOM 2342 NE ARG C 33 -4.628 -0.760 17.432 1.00 0.00 N ATOM 2343 CZ ARG C 33 -5.592 -0.936 18.294 1.00 0.00 C ATOM 2344 NH1 ARG C 33 -5.924 -2.142 18.668 1.00 0.00 N ATOM 2345 NH2 ARG C 33 -6.225 0.095 18.784 1.00 0.00 N ATOM 0 H ARG C 33 -3.244 -2.523 12.264 1.00 0.00 H new ATOM 0 HA ARG C 33 -2.951 0.104 13.041 1.00 0.00 H new ATOM 0 HB2 ARG C 33 -4.492 -0.966 14.406 1.00 0.00 H new ATOM 0 HB3 ARG C 33 -3.701 -2.517 14.206 1.00 0.00 H new ATOM 0 HG2 ARG C 33 -1.975 -1.871 15.899 1.00 0.00 H new ATOM 0 HG3 ARG C 33 -2.730 -0.300 16.082 1.00 0.00 H new ATOM 0 HD2 ARG C 33 -4.593 -2.635 16.400 1.00 0.00 H new ATOM 0 HD3 ARG C 33 -3.376 -2.482 17.651 1.00 0.00 H new ATOM 0 HE ARG C 33 -4.370 0.183 17.142 1.00 0.00 H new ATOM 0 HH11 ARG C 33 -5.430 -2.949 18.286 1.00 0.00 H new ATOM 0 HH12 ARG C 33 -6.678 -2.278 19.342 1.00 0.00 H new ATOM 0 HH21 ARG C 33 -5.966 1.038 18.493 1.00 0.00 H new ATOM 0 HH22 ARG C 33 -6.978 -0.042 19.458 1.00 0.00 H new ATOM 2359 N GLU C 34 -0.465 -1.606 14.337 1.00 0.00 N ATOM 2360 CA GLU C 34 0.892 -1.403 14.915 1.00 0.00 C ATOM 2361 C GLU C 34 1.794 -0.757 13.865 1.00 0.00 C ATOM 2362 O GLU C 34 2.512 0.183 14.140 1.00 0.00 O ATOM 2363 CB GLU C 34 1.392 -2.804 15.271 1.00 0.00 C ATOM 2364 CG GLU C 34 1.998 -2.789 16.675 1.00 0.00 C ATOM 2365 CD GLU C 34 1.076 -3.539 17.638 1.00 0.00 C ATOM 2366 OE1 GLU C 34 -0.127 -3.475 17.447 1.00 0.00 O ATOM 2367 OE2 GLU C 34 1.590 -4.164 18.551 1.00 0.00 O ATOM 0 H GLU C 34 -0.748 -2.579 14.223 1.00 0.00 H new ATOM 0 HA GLU C 34 0.886 -0.751 15.788 1.00 0.00 H new ATOM 0 HB2 GLU C 34 0.569 -3.517 15.226 1.00 0.00 H new ATOM 0 HB3 GLU C 34 2.137 -3.131 14.546 1.00 0.00 H new ATOM 0 HG2 GLU C 34 2.984 -3.254 16.662 1.00 0.00 H new ATOM 0 HG3 GLU C 34 2.135 -1.762 17.012 1.00 0.00 H new ATOM 2374 N HIS C 35 1.750 -1.247 12.654 1.00 0.00 N ATOM 2375 CA HIS C 35 2.592 -0.648 11.582 1.00 0.00 C ATOM 2376 C HIS C 35 2.226 0.828 11.421 1.00 0.00 C ATOM 2377 O HIS C 35 3.056 1.653 11.102 1.00 0.00 O ATOM 2378 CB HIS C 35 2.252 -1.435 10.318 1.00 0.00 C ATOM 2379 CG HIS C 35 3.290 -1.157 9.265 1.00 0.00 C ATOM 2380 ND1 HIS C 35 3.051 -1.366 7.915 1.00 0.00 N ATOM 2381 CD2 HIS C 35 4.575 -0.685 9.350 1.00 0.00 C ATOM 2382 CE1 HIS C 35 4.169 -1.021 7.250 1.00 0.00 C ATOM 2383 NE2 HIS C 35 5.129 -0.600 8.076 1.00 0.00 N ATOM 0 H HIS C 35 1.169 -2.033 12.363 1.00 0.00 H new ATOM 0 HA HIS C 35 3.658 -0.697 11.803 1.00 0.00 H new ATOM 0 HB2 HIS C 35 2.218 -2.502 10.538 1.00 0.00 H new ATOM 0 HB3 HIS C 35 1.264 -1.153 9.955 1.00 0.00 H new ATOM 0 HD1 HIS C 35 2.187 -1.717 7.502 1.00 0.00 H new ATOM 0 HD2 HIS C 35 5.080 -0.419 10.267 1.00 0.00 H new ATOM 0 HE1 HIS C 35 4.276 -1.078 6.177 1.00 0.00 H new ATOM 2391 N ALA C 36 0.989 1.165 11.650 1.00 0.00 N ATOM 2392 CA ALA C 36 0.571 2.592 11.525 1.00 0.00 C ATOM 2393 C ALA C 36 0.780 3.307 12.859 1.00 0.00 C ATOM 2394 O ALA C 36 0.991 4.503 12.908 1.00 0.00 O ATOM 2395 CB ALA C 36 -0.913 2.546 11.167 1.00 0.00 C ATOM 0 H ALA C 36 0.248 0.517 11.918 1.00 0.00 H new ATOM 0 HA ALA C 36 1.148 3.131 10.774 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -1.293 3.562 11.058 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -1.044 2.007 10.229 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -1.463 2.036 11.958 1.00 0.00 H new ATOM 2401 N LEU C 37 0.733 2.583 13.943 1.00 0.00 N ATOM 2402 CA LEU C 37 0.939 3.226 15.269 1.00 0.00 C ATOM 2403 C LEU C 37 2.355 3.802 15.345 1.00 0.00 C ATOM 2404 O LEU C 37 2.686 4.550 16.244 1.00 0.00 O ATOM 2405 CB LEU C 37 0.755 2.103 16.291 1.00 0.00 C ATOM 2406 CG LEU C 37 0.608 2.703 17.690 1.00 0.00 C ATOM 2407 CD1 LEU C 37 -0.806 2.441 18.211 1.00 0.00 C ATOM 2408 CD2 LEU C 37 1.625 2.054 18.630 1.00 0.00 C ATOM 0 H LEU C 37 0.561 1.578 13.967 1.00 0.00 H new ATOM 0 HA LEU C 37 0.246 4.048 15.449 1.00 0.00 H new ATOM 0 HB2 LEU C 37 -0.127 1.512 16.043 1.00 0.00 H new ATOM 0 HB3 LEU C 37 1.610 1.427 16.262 1.00 0.00 H new ATOM 0 HG LEU C 37 0.786 3.778 17.646 1.00 0.00 H new ATOM 0 HD11 LEU C 37 -0.911 2.868 19.208 1.00 0.00 H new ATOM 0 HD12 LEU C 37 -1.532 2.901 17.540 1.00 0.00 H new ATOM 0 HD13 LEU C 37 -0.984 1.367 18.256 1.00 0.00 H new ATOM 0 HD21 LEU C 37 1.522 2.480 19.628 1.00 0.00 H new ATOM 0 HD22 LEU C 37 1.446 0.980 18.674 1.00 0.00 H new ATOM 0 HD23 LEU C 37 2.633 2.239 18.259 1.00 0.00 H new ATOM 2420 N THR C 38 3.192 3.465 14.400 1.00 0.00 N ATOM 2421 CA THR C 38 4.581 4.000 14.410 1.00 0.00 C ATOM 2422 C THR C 38 4.580 5.460 13.966 1.00 0.00 C ATOM 2423 O THR C 38 5.611 6.089 13.846 1.00 0.00 O ATOM 2424 CB THR C 38 5.359 3.123 13.431 1.00 0.00 C ATOM 2425 OG1 THR C 38 4.513 2.755 12.355 1.00 0.00 O ATOM 2426 CG2 THR C 38 5.848 1.864 14.148 1.00 0.00 C ATOM 0 H THR C 38 2.972 2.842 13.623 1.00 0.00 H new ATOM 0 HA THR C 38 5.030 3.976 15.403 1.00 0.00 H new ATOM 0 HB THR C 38 6.216 3.677 13.049 1.00 0.00 H new ATOM 0 HG1 THR C 38 4.551 3.444 11.659 1.00 0.00 H new ATOM 0 HG21 THR C 38 6.403 1.239 13.448 1.00 0.00 H new ATOM 0 HG22 THR C 38 6.498 2.146 14.976 1.00 0.00 H new ATOM 0 HG23 THR C 38 4.992 1.308 14.531 1.00 0.00 H new ATOM 2434 N SER C 39 3.419 6.003 13.738 1.00 0.00 N ATOM 2435 CA SER C 39 3.328 7.428 13.316 1.00 0.00 C ATOM 2436 C SER C 39 2.999 8.308 14.523 1.00 0.00 C ATOM 2437 O SER C 39 3.484 9.414 14.650 1.00 0.00 O ATOM 2438 CB SER C 39 2.182 7.471 12.309 1.00 0.00 C ATOM 2439 OG SER C 39 0.983 7.837 12.979 1.00 0.00 O ATOM 0 H SER C 39 2.525 5.520 13.826 1.00 0.00 H new ATOM 0 HA SER C 39 4.262 7.793 12.890 1.00 0.00 H new ATOM 0 HB2 SER C 39 2.404 8.188 11.518 1.00 0.00 H new ATOM 0 HB3 SER C 39 2.064 6.498 11.833 1.00 0.00 H new ATOM 0 HG SER C 39 0.722 7.122 13.596 1.00 0.00 H new ATOM 2445 N GLY C 40 2.165 7.827 15.401 1.00 0.00 N ATOM 2446 CA GLY C 40 1.786 8.636 16.593 1.00 0.00 C ATOM 2447 C GLY C 40 0.641 9.573 16.211 1.00 0.00 C ATOM 2448 O GLY C 40 -0.030 10.133 17.055 1.00 0.00 O ATOM 0 H GLY C 40 1.728 6.907 15.345 1.00 0.00 H new ATOM 0 HA2 GLY C 40 1.482 7.983 17.411 1.00 0.00 H new ATOM 0 HA3 GLY C 40 2.642 9.211 16.946 1.00 0.00 H new ATOM 2452 N THR C 41 0.410 9.741 14.937 1.00 0.00 N ATOM 2453 CA THR C 41 -0.692 10.633 14.484 1.00 0.00 C ATOM 2454 C THR C 41 -1.741 9.813 13.730 1.00 0.00 C ATOM 2455 O THR C 41 -2.915 10.123 13.746 1.00 0.00 O ATOM 2456 CB THR C 41 -0.031 11.647 13.551 1.00 0.00 C ATOM 2457 OG1 THR C 41 1.303 11.240 13.283 1.00 0.00 O ATOM 2458 CG2 THR C 41 -0.024 13.024 14.215 1.00 0.00 C ATOM 0 H THR C 41 0.941 9.296 14.188 1.00 0.00 H new ATOM 0 HA THR C 41 -1.199 11.124 15.315 1.00 0.00 H new ATOM 0 HB THR C 41 -0.589 11.701 12.616 1.00 0.00 H new ATOM 0 HG1 THR C 41 1.296 10.488 12.655 1.00 0.00 H new ATOM 0 HG21 THR C 41 0.448 13.747 13.549 1.00 0.00 H new ATOM 0 HG22 THR C 41 -1.049 13.334 14.420 1.00 0.00 H new ATOM 0 HG23 THR C 41 0.534 12.974 15.150 1.00 0.00 H new ATOM 2466 N ILE C 42 -1.325 8.760 13.075 1.00 0.00 N ATOM 2467 CA ILE C 42 -2.306 7.921 12.331 1.00 0.00 C ATOM 2468 C ILE C 42 -3.328 7.346 13.314 1.00 0.00 C ATOM 2469 O ILE C 42 -4.521 7.433 13.105 1.00 0.00 O ATOM 2470 CB ILE C 42 -1.470 6.813 11.680 1.00 0.00 C ATOM 2471 CG1 ILE C 42 -1.107 7.229 10.252 1.00 0.00 C ATOM 2472 CG2 ILE C 42 -2.274 5.510 11.637 1.00 0.00 C ATOM 2473 CD1 ILE C 42 0.404 7.102 10.045 1.00 0.00 C ATOM 0 H ILE C 42 -0.355 8.448 13.024 1.00 0.00 H new ATOM 0 HA ILE C 42 -2.866 8.480 11.582 1.00 0.00 H new ATOM 0 HB ILE C 42 -0.563 6.656 12.264 1.00 0.00 H new ATOM 0 HG12 ILE C 42 -1.636 6.601 9.535 1.00 0.00 H new ATOM 0 HG13 ILE C 42 -1.423 8.256 10.071 1.00 0.00 H new ATOM 0 HG21 ILE C 42 -1.674 4.727 11.173 1.00 0.00 H new ATOM 0 HG22 ILE C 42 -2.538 5.212 12.652 1.00 0.00 H new ATOM 0 HG23 ILE C 42 -3.183 5.663 11.056 1.00 0.00 H new ATOM 0 HD11 ILE C 42 0.658 7.399 9.027 1.00 0.00 H new ATOM 0 HD12 ILE C 42 0.924 7.748 10.752 1.00 0.00 H new ATOM 0 HD13 ILE C 42 0.708 6.068 10.208 1.00 0.00 H new ATOM 2485 N LYS C 43 -2.871 6.769 14.393 1.00 0.00 N ATOM 2486 CA LYS C 43 -3.826 6.206 15.389 1.00 0.00 C ATOM 2487 C LYS C 43 -4.748 7.313 15.904 1.00 0.00 C ATOM 2488 O LYS C 43 -5.947 7.142 16.001 1.00 0.00 O ATOM 2489 CB LYS C 43 -2.948 5.670 16.521 1.00 0.00 C ATOM 2490 CG LYS C 43 -1.881 4.738 15.944 1.00 0.00 C ATOM 2491 CD LYS C 43 -2.507 3.827 14.887 1.00 0.00 C ATOM 2492 CE LYS C 43 -3.551 2.924 15.545 1.00 0.00 C ATOM 2493 NZ LYS C 43 -3.316 1.576 14.958 1.00 0.00 N ATOM 0 H LYS C 43 -1.884 6.664 14.626 1.00 0.00 H new ATOM 0 HA LYS C 43 -4.461 5.428 14.966 1.00 0.00 H new ATOM 0 HB2 LYS C 43 -2.475 6.497 17.051 1.00 0.00 H new ATOM 0 HB3 LYS C 43 -3.560 5.134 17.247 1.00 0.00 H new ATOM 0 HG2 LYS C 43 -1.074 5.323 15.502 1.00 0.00 H new ATOM 0 HG3 LYS C 43 -1.440 4.138 16.740 1.00 0.00 H new ATOM 0 HD2 LYS C 43 -2.971 4.426 14.104 1.00 0.00 H new ATOM 0 HD3 LYS C 43 -1.736 3.222 14.410 1.00 0.00 H new ATOM 0 HE2 LYS C 43 -3.434 2.909 16.629 1.00 0.00 H new ATOM 0 HE3 LYS C 43 -4.562 3.274 15.339 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 -3.961 0.889 15.398 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 -3.491 1.608 13.933 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 -2.332 1.288 15.133 1.00 0.00 H new ATOM 2507 N ALA C 44 -4.198 8.452 16.228 1.00 0.00 N ATOM 2508 CA ALA C 44 -5.045 9.571 16.727 1.00 0.00 C ATOM 2509 C ALA C 44 -6.046 9.988 15.647 1.00 0.00 C ATOM 2510 O ALA C 44 -7.132 10.449 15.938 1.00 0.00 O ATOM 2511 CB ALA C 44 -4.067 10.708 17.023 1.00 0.00 C ATOM 0 H ALA C 44 -3.200 8.655 16.169 1.00 0.00 H new ATOM 0 HA ALA C 44 -5.622 9.295 17.609 1.00 0.00 H new ATOM 0 HB1 ALA C 44 -4.616 11.572 17.396 1.00 0.00 H new ATOM 0 HB2 ALA C 44 -3.348 10.383 17.775 1.00 0.00 H new ATOM 0 HB3 ALA C 44 -3.539 10.981 16.109 1.00 0.00 H new ATOM 2517 N MET C 45 -5.689 9.825 14.402 1.00 0.00 N ATOM 2518 CA MET C 45 -6.621 10.208 13.304 1.00 0.00 C ATOM 2519 C MET C 45 -7.878 9.336 13.356 1.00 0.00 C ATOM 2520 O MET C 45 -8.973 9.793 13.090 1.00 0.00 O ATOM 2521 CB MET C 45 -5.843 9.951 12.013 1.00 0.00 C ATOM 2522 CG MET C 45 -4.646 10.901 11.940 1.00 0.00 C ATOM 2523 SD MET C 45 -4.850 12.023 10.534 1.00 0.00 S ATOM 2524 CE MET C 45 -3.672 13.284 11.080 1.00 0.00 C ATOM 0 H MET C 45 -4.793 9.444 14.098 1.00 0.00 H new ATOM 0 HA MET C 45 -6.947 11.245 13.381 1.00 0.00 H new ATOM 0 HB2 MET C 45 -5.502 8.916 11.981 1.00 0.00 H new ATOM 0 HB3 MET C 45 -6.492 10.099 11.150 1.00 0.00 H new ATOM 0 HG2 MET C 45 -4.564 11.471 12.865 1.00 0.00 H new ATOM 0 HG3 MET C 45 -3.722 10.332 11.834 1.00 0.00 H new ATOM 0 HE1 MET C 45 -3.636 14.090 10.347 1.00 0.00 H new ATOM 0 HE2 MET C 45 -3.988 13.684 12.043 1.00 0.00 H new ATOM 0 HE3 MET C 45 -2.682 12.839 11.179 1.00 0.00 H new ATOM 2534 N LEU C 46 -7.732 8.084 13.696 1.00 0.00 N ATOM 2535 CA LEU C 46 -8.922 7.189 13.765 1.00 0.00 C ATOM 2536 C LEU C 46 -9.694 7.234 12.443 1.00 0.00 C ATOM 2537 O LEU C 46 -10.907 7.168 12.418 1.00 0.00 O ATOM 2538 CB LEU C 46 -9.777 7.749 14.903 1.00 0.00 C ATOM 2539 CG LEU C 46 -8.913 7.930 16.153 1.00 0.00 C ATOM 2540 CD1 LEU C 46 -9.470 9.079 16.996 1.00 0.00 C ATOM 2541 CD2 LEU C 46 -8.930 6.640 16.975 1.00 0.00 C ATOM 0 H LEU C 46 -6.842 7.643 13.928 1.00 0.00 H new ATOM 0 HA LEU C 46 -8.646 6.149 13.938 1.00 0.00 H new ATOM 0 HB2 LEU C 46 -10.213 8.704 14.608 1.00 0.00 H new ATOM 0 HB3 LEU C 46 -10.605 7.073 15.116 1.00 0.00 H new ATOM 0 HG LEU C 46 -7.889 8.159 15.857 1.00 0.00 H new ATOM 0 HD11 LEU C 46 -8.855 9.208 17.887 1.00 0.00 H new ATOM 0 HD12 LEU C 46 -9.459 9.998 16.411 1.00 0.00 H new ATOM 0 HD13 LEU C 46 -10.494 8.850 17.292 1.00 0.00 H new ATOM 0 HD21 LEU C 46 -8.315 6.768 17.866 1.00 0.00 H new ATOM 0 HD22 LEU C 46 -9.954 6.411 17.271 1.00 0.00 H new ATOM 0 HD23 LEU C 46 -8.534 5.821 16.375 1.00 0.00 H new ATOM 2697 N ASN C 58 -8.085 2.420 11.312 1.00 0.00 N ATOM 2698 CA ASN C 58 -9.070 2.305 10.197 1.00 0.00 C ATOM 2699 C ASN C 58 -8.416 2.701 8.872 1.00 0.00 C ATOM 2700 O ASN C 58 -7.991 1.863 8.100 1.00 0.00 O ATOM 2701 CB ASN C 58 -10.192 3.280 10.555 1.00 0.00 C ATOM 2702 CG ASN C 58 -11.456 2.497 10.912 1.00 0.00 C ATOM 2703 OD1 ASN C 58 -11.910 2.533 12.038 1.00 0.00 O ATOM 2704 ND2 ASN C 58 -12.050 1.787 9.992 1.00 0.00 N ATOM 0 HA ASN C 58 -9.440 1.287 10.077 1.00 0.00 H new ATOM 0 HB2 ASN C 58 -9.890 3.906 11.395 1.00 0.00 H new ATOM 0 HB3 ASN C 58 -10.390 3.947 9.716 1.00 0.00 H new ATOM 0 HD21 ASN C 58 -12.895 1.263 10.219 1.00 0.00 H new ATOM 0 HD22 ASN C 58 -11.669 1.756 9.046 1.00 0.00 H new ATOM 2711 N GLU C 59 -8.332 3.974 8.599 1.00 0.00 N ATOM 2712 CA GLU C 59 -7.708 4.419 7.321 1.00 0.00 C ATOM 2713 C GLU C 59 -6.951 5.733 7.525 1.00 0.00 C ATOM 2714 O GLU C 59 -7.177 6.452 8.478 1.00 0.00 O ATOM 2715 CB GLU C 59 -8.875 4.617 6.356 1.00 0.00 C ATOM 2716 CG GLU C 59 -9.843 5.653 6.930 1.00 0.00 C ATOM 2717 CD GLU C 59 -10.284 6.610 5.821 1.00 0.00 C ATOM 2718 OE1 GLU C 59 -10.006 6.318 4.670 1.00 0.00 O ATOM 2719 OE2 GLU C 59 -10.891 7.618 6.143 1.00 0.00 O ATOM 0 H GLU C 59 -8.668 4.724 9.204 1.00 0.00 H new ATOM 0 HA GLU C 59 -6.986 3.695 6.944 1.00 0.00 H new ATOM 0 HB2 GLU C 59 -8.506 4.948 5.385 1.00 0.00 H new ATOM 0 HB3 GLU C 59 -9.392 3.671 6.195 1.00 0.00 H new ATOM 0 HG2 GLU C 59 -10.711 5.155 7.362 1.00 0.00 H new ATOM 0 HG3 GLU C 59 -9.362 6.209 7.735 1.00 0.00 H new ATOM 2726 N VAL C 60 -6.054 6.049 6.635 1.00 0.00 N ATOM 2727 CA VAL C 60 -5.277 7.314 6.767 1.00 0.00 C ATOM 2728 C VAL C 60 -5.333 8.098 5.453 1.00 0.00 C ATOM 2729 O VAL C 60 -5.510 7.537 4.391 1.00 0.00 O ATOM 2730 CB VAL C 60 -3.844 6.877 7.069 1.00 0.00 C ATOM 2731 CG1 VAL C 60 -3.101 8.007 7.778 1.00 0.00 C ATOM 2732 CG2 VAL C 60 -3.863 5.641 7.972 1.00 0.00 C ATOM 0 H VAL C 60 -5.824 5.484 5.818 1.00 0.00 H new ATOM 0 HA VAL C 60 -5.673 7.963 7.548 1.00 0.00 H new ATOM 0 HB VAL C 60 -3.338 6.638 6.134 1.00 0.00 H new ATOM 0 HG11 VAL C 60 -2.080 7.693 7.992 1.00 0.00 H new ATOM 0 HG12 VAL C 60 -3.083 8.889 7.137 1.00 0.00 H new ATOM 0 HG13 VAL C 60 -3.610 8.248 8.711 1.00 0.00 H new ATOM 0 HG21 VAL C 60 -2.840 5.331 8.186 1.00 0.00 H new ATOM 0 HG22 VAL C 60 -4.373 5.880 8.905 1.00 0.00 H new ATOM 0 HG23 VAL C 60 -4.390 4.830 7.468 1.00 0.00 H new ATOM 2742 N ASN C 61 -5.183 9.390 5.519 1.00 0.00 N ATOM 2743 CA ASN C 61 -5.226 10.210 4.278 1.00 0.00 C ATOM 2744 C ASN C 61 -4.111 11.256 4.300 1.00 0.00 C ATOM 2745 O ASN C 61 -4.104 12.157 5.114 1.00 0.00 O ATOM 2746 CB ASN C 61 -6.598 10.884 4.296 1.00 0.00 C ATOM 2747 CG ASN C 61 -7.691 9.822 4.151 1.00 0.00 C ATOM 2748 OD1 ASN C 61 -7.438 8.738 3.664 1.00 0.00 O ATOM 2749 ND2 ASN C 61 -8.902 10.090 4.555 1.00 0.00 N ATOM 0 H ASN C 61 -5.032 9.915 6.381 1.00 0.00 H new ATOM 0 HA ASN C 61 -5.080 9.610 3.379 1.00 0.00 H new ATOM 0 HB2 ASN C 61 -6.732 11.434 5.227 1.00 0.00 H new ATOM 0 HB3 ASN C 61 -6.670 11.608 3.484 1.00 0.00 H new ATOM 0 HD21 ASN C 61 -9.637 9.389 4.462 1.00 0.00 H new ATOM 0 HD22 ASN C 61 -9.114 11.000 4.964 1.00 0.00 H new ATOM 2756 N PHE C 62 -3.174 11.142 3.405 1.00 0.00 N ATOM 2757 CA PHE C 62 -2.056 12.128 3.362 1.00 0.00 C ATOM 2758 C PHE C 62 -2.150 12.970 2.086 1.00 0.00 C ATOM 2759 O PHE C 62 -1.710 12.563 1.029 1.00 0.00 O ATOM 2760 CB PHE C 62 -0.782 11.283 3.356 1.00 0.00 C ATOM 2761 CG PHE C 62 -0.681 10.512 4.651 1.00 0.00 C ATOM 2762 CD1 PHE C 62 -0.809 11.180 5.876 1.00 0.00 C ATOM 2763 CD2 PHE C 62 -0.456 9.130 4.628 1.00 0.00 C ATOM 2764 CE1 PHE C 62 -0.713 10.465 7.076 1.00 0.00 C ATOM 2765 CE2 PHE C 62 -0.361 8.416 5.828 1.00 0.00 C ATOM 2766 CZ PHE C 62 -0.490 9.083 7.053 1.00 0.00 C ATOM 0 H PHE C 62 -3.131 10.408 2.698 1.00 0.00 H new ATOM 0 HA PHE C 62 -2.079 12.820 4.204 1.00 0.00 H new ATOM 0 HB2 PHE C 62 -0.794 10.595 2.511 1.00 0.00 H new ATOM 0 HB3 PHE C 62 0.091 11.924 3.233 1.00 0.00 H new ATOM 0 HD1 PHE C 62 -0.982 12.246 5.895 1.00 0.00 H new ATOM 0 HD2 PHE C 62 -0.356 8.615 3.684 1.00 0.00 H new ATOM 0 HE1 PHE C 62 -0.811 10.980 8.020 1.00 0.00 H new ATOM 0 HE2 PHE C 62 -0.188 7.350 5.809 1.00 0.00 H new ATOM 0 HZ PHE C 62 -0.418 8.532 7.979 1.00 0.00 H new ATOM 2776 N ARG C 63 -2.726 14.139 2.175 1.00 0.00 N ATOM 2777 CA ARG C 63 -2.852 15.002 0.965 1.00 0.00 C ATOM 2778 C ARG C 63 -1.541 15.749 0.704 1.00 0.00 C ATOM 2779 O ARG C 63 -1.282 16.203 -0.393 1.00 0.00 O ATOM 2780 CB ARG C 63 -3.972 15.988 1.299 1.00 0.00 C ATOM 2781 CG ARG C 63 -3.507 16.936 2.407 1.00 0.00 C ATOM 2782 CD ARG C 63 -4.503 18.090 2.544 1.00 0.00 C ATOM 2783 NE ARG C 63 -5.723 17.476 3.140 1.00 0.00 N ATOM 2784 CZ ARG C 63 -6.868 18.101 3.076 1.00 0.00 C ATOM 2785 NH1 ARG C 63 -6.947 19.263 2.487 1.00 0.00 N ATOM 2786 NH2 ARG C 63 -7.935 17.562 3.601 1.00 0.00 N ATOM 0 H ARG C 63 -3.114 14.533 3.032 1.00 0.00 H new ATOM 0 HA ARG C 63 -3.069 14.423 0.067 1.00 0.00 H new ATOM 0 HB2 ARG C 63 -4.246 16.557 0.411 1.00 0.00 H new ATOM 0 HB3 ARG C 63 -4.863 15.447 1.619 1.00 0.00 H new ATOM 0 HG2 ARG C 63 -3.427 16.397 3.351 1.00 0.00 H new ATOM 0 HG3 ARG C 63 -2.515 17.324 2.176 1.00 0.00 H new ATOM 0 HD2 ARG C 63 -4.107 18.880 3.182 1.00 0.00 H new ATOM 0 HD3 ARG C 63 -4.721 18.541 1.576 1.00 0.00 H new ATOM 0 HE ARG C 63 -5.664 16.567 3.598 1.00 0.00 H new ATOM 0 HH11 ARG C 63 -6.114 19.684 2.076 1.00 0.00 H new ATOM 0 HH12 ARG C 63 -7.842 19.750 2.438 1.00 0.00 H new ATOM 0 HH21 ARG C 63 -7.874 16.654 4.061 1.00 0.00 H new ATOM 0 HH22 ARG C 63 -8.830 18.049 3.551 1.00 0.00 H new ATOM 2800 N GLU C 64 -0.712 15.880 1.703 1.00 0.00 N ATOM 2801 CA GLU C 64 0.581 16.596 1.508 1.00 0.00 C ATOM 2802 C GLU C 64 1.740 15.598 1.496 1.00 0.00 C ATOM 2803 O GLU C 64 2.779 15.831 2.082 1.00 0.00 O ATOM 2804 CB GLU C 64 0.696 17.538 2.708 1.00 0.00 C ATOM 2805 CG GLU C 64 1.218 18.898 2.243 1.00 0.00 C ATOM 2806 CD GLU C 64 0.230 19.992 2.653 1.00 0.00 C ATOM 2807 OE1 GLU C 64 -0.957 19.711 2.679 1.00 0.00 O ATOM 2808 OE2 GLU C 64 0.677 21.092 2.934 1.00 0.00 O ATOM 0 H GLU C 64 -0.873 15.523 2.645 1.00 0.00 H new ATOM 0 HA GLU C 64 0.617 17.135 0.561 1.00 0.00 H new ATOM 0 HB2 GLU C 64 -0.276 17.654 3.186 1.00 0.00 H new ATOM 0 HB3 GLU C 64 1.369 17.114 3.453 1.00 0.00 H new ATOM 0 HG2 GLU C 64 2.196 19.093 2.682 1.00 0.00 H new ATOM 0 HG3 GLU C 64 1.349 18.898 1.161 1.00 0.00 H new ATOM 2815 N ILE C 65 1.569 14.485 0.838 1.00 0.00 N ATOM 2816 CA ILE C 65 2.660 13.470 0.792 1.00 0.00 C ATOM 2817 C ILE C 65 2.521 12.603 -0.465 1.00 0.00 C ATOM 2818 O ILE C 65 1.509 11.963 -0.670 1.00 0.00 O ATOM 2819 CB ILE C 65 2.465 12.637 2.064 1.00 0.00 C ATOM 2820 CG1 ILE C 65 3.490 13.073 3.114 1.00 0.00 C ATOM 2821 CG2 ILE C 65 2.655 11.149 1.755 1.00 0.00 C ATOM 2822 CD1 ILE C 65 2.783 13.326 4.448 1.00 0.00 C ATOM 0 H ILE C 65 0.721 14.234 0.330 1.00 0.00 H new ATOM 0 HA ILE C 65 3.653 13.918 0.749 1.00 0.00 H new ATOM 0 HB ILE C 65 1.455 12.794 2.443 1.00 0.00 H new ATOM 0 HG12 ILE C 65 4.252 12.303 3.235 1.00 0.00 H new ATOM 0 HG13 ILE C 65 4.001 13.978 2.784 1.00 0.00 H new ATOM 0 HG21 ILE C 65 2.514 10.567 2.666 1.00 0.00 H new ATOM 0 HG22 ILE C 65 1.925 10.836 1.008 1.00 0.00 H new ATOM 0 HG23 ILE C 65 3.661 10.983 1.370 1.00 0.00 H new ATOM 0 HD11 ILE C 65 3.514 13.636 5.194 1.00 0.00 H new ATOM 0 HD12 ILE C 65 2.038 14.111 4.322 1.00 0.00 H new ATOM 0 HD13 ILE C 65 2.293 12.411 4.779 1.00 0.00 H new ATOM 2834 N PRO C 66 3.552 12.614 -1.266 1.00 0.00 N ATOM 2835 CA PRO C 66 3.555 11.821 -2.520 1.00 0.00 C ATOM 2836 C PRO C 66 3.708 10.329 -2.212 1.00 0.00 C ATOM 2837 O PRO C 66 3.997 9.942 -1.096 1.00 0.00 O ATOM 2838 CB PRO C 66 4.774 12.347 -3.274 1.00 0.00 C ATOM 2839 CG PRO C 66 5.678 12.895 -2.215 1.00 0.00 C ATOM 2840 CD PRO C 66 4.802 13.361 -1.081 1.00 0.00 C ATOM 0 HA PRO C 66 2.631 11.919 -3.090 1.00 0.00 H new ATOM 0 HB2 PRO C 66 5.263 11.552 -3.837 1.00 0.00 H new ATOM 0 HB3 PRO C 66 4.492 13.119 -3.990 1.00 0.00 H new ATOM 0 HG2 PRO C 66 6.377 12.132 -1.873 1.00 0.00 H new ATOM 0 HG3 PRO C 66 6.273 13.720 -2.606 1.00 0.00 H new ATOM 0 HD2 PRO C 66 5.255 13.147 -0.113 1.00 0.00 H new ATOM 0 HD3 PRO C 66 4.634 14.437 -1.123 1.00 0.00 H new ATOM 2848 N SER C 67 3.517 9.488 -3.191 1.00 0.00 N ATOM 2849 CA SER C 67 3.650 8.023 -2.951 1.00 0.00 C ATOM 2850 C SER C 67 5.055 7.698 -2.440 1.00 0.00 C ATOM 2851 O SER C 67 5.223 7.078 -1.409 1.00 0.00 O ATOM 2852 CB SER C 67 3.411 7.375 -4.314 1.00 0.00 C ATOM 2853 OG SER C 67 3.897 8.238 -5.335 1.00 0.00 O ATOM 0 H SER C 67 3.275 9.752 -4.146 1.00 0.00 H new ATOM 0 HA SER C 67 2.948 7.661 -2.200 1.00 0.00 H new ATOM 0 HB2 SER C 67 3.917 6.411 -4.365 1.00 0.00 H new ATOM 0 HB3 SER C 67 2.347 7.185 -4.458 1.00 0.00 H new ATOM 0 HG SER C 67 3.349 8.133 -6.141 1.00 0.00 H new ATOM 2859 N HIS C 68 6.068 8.112 -3.152 1.00 0.00 N ATOM 2860 CA HIS C 68 7.461 7.828 -2.701 1.00 0.00 C ATOM 2861 C HIS C 68 7.582 8.048 -1.190 1.00 0.00 C ATOM 2862 O HIS C 68 8.254 7.311 -0.498 1.00 0.00 O ATOM 2863 CB HIS C 68 8.335 8.825 -3.461 1.00 0.00 C ATOM 2864 CG HIS C 68 8.188 8.594 -4.939 1.00 0.00 C ATOM 2865 ND1 HIS C 68 8.648 9.503 -5.879 1.00 0.00 N ATOM 2866 CD2 HIS C 68 7.635 7.561 -5.656 1.00 0.00 C ATOM 2867 CE1 HIS C 68 8.365 9.005 -7.097 1.00 0.00 C ATOM 2868 NE2 HIS C 68 7.748 7.823 -7.018 1.00 0.00 N ATOM 0 H HIS C 68 5.992 8.634 -4.025 1.00 0.00 H new ATOM 0 HA HIS C 68 7.757 6.797 -2.896 1.00 0.00 H new ATOM 0 HB2 HIS C 68 8.044 9.845 -3.211 1.00 0.00 H new ATOM 0 HB3 HIS C 68 9.378 8.710 -3.166 1.00 0.00 H new ATOM 0 HD2 HIS C 68 7.181 6.679 -5.228 1.00 0.00 H new ATOM 0 HE1 HIS C 68 8.607 9.501 -8.025 1.00 0.00 H new ATOM 0 HE2 HIS C 68 7.428 7.238 -7.790 1.00 0.00 H new ATOM 2876 N VAL C 69 6.931 9.055 -0.672 1.00 0.00 N ATOM 2877 CA VAL C 69 7.004 9.320 0.793 1.00 0.00 C ATOM 2878 C VAL C 69 5.997 8.434 1.535 1.00 0.00 C ATOM 2879 O VAL C 69 6.258 7.948 2.618 1.00 0.00 O ATOM 2880 CB VAL C 69 6.644 10.801 0.941 1.00 0.00 C ATOM 2881 CG1 VAL C 69 5.982 11.039 2.299 1.00 0.00 C ATOM 2882 CG2 VAL C 69 7.915 11.645 0.843 1.00 0.00 C ATOM 0 H VAL C 69 6.351 9.706 -1.201 1.00 0.00 H new ATOM 0 HA VAL C 69 7.986 9.100 1.212 1.00 0.00 H new ATOM 0 HB VAL C 69 5.953 11.084 0.147 1.00 0.00 H new ATOM 0 HG11 VAL C 69 5.728 12.094 2.400 1.00 0.00 H new ATOM 0 HG12 VAL C 69 5.075 10.439 2.372 1.00 0.00 H new ATOM 0 HG13 VAL C 69 6.671 10.754 3.094 1.00 0.00 H new ATOM 0 HG21 VAL C 69 7.660 12.700 0.948 1.00 0.00 H new ATOM 0 HG22 VAL C 69 8.605 11.357 1.636 1.00 0.00 H new ATOM 0 HG23 VAL C 69 8.387 11.481 -0.126 1.00 0.00 H new ATOM 2892 N LEU C 70 4.848 8.226 0.953 1.00 0.00 N ATOM 2893 CA LEU C 70 3.810 7.377 1.607 1.00 0.00 C ATOM 2894 C LEU C 70 4.423 6.056 2.088 1.00 0.00 C ATOM 2895 O LEU C 70 4.104 5.566 3.153 1.00 0.00 O ATOM 2896 CB LEU C 70 2.763 7.147 0.506 1.00 0.00 C ATOM 2897 CG LEU C 70 2.197 5.722 0.574 1.00 0.00 C ATOM 2898 CD1 LEU C 70 3.248 4.724 0.080 1.00 0.00 C ATOM 2899 CD2 LEU C 70 1.807 5.389 2.018 1.00 0.00 C ATOM 0 H LEU C 70 4.581 8.610 0.046 1.00 0.00 H new ATOM 0 HA LEU C 70 3.375 7.842 2.492 1.00 0.00 H new ATOM 0 HB2 LEU C 70 1.953 7.869 0.613 1.00 0.00 H new ATOM 0 HB3 LEU C 70 3.215 7.316 -0.471 1.00 0.00 H new ATOM 0 HG LEU C 70 1.313 5.656 -0.061 1.00 0.00 H new ATOM 0 HD11 LEU C 70 2.842 3.714 0.130 1.00 0.00 H new ATOM 0 HD12 LEU C 70 3.515 4.957 -0.951 1.00 0.00 H new ATOM 0 HD13 LEU C 70 4.136 4.790 0.709 1.00 0.00 H new ATOM 0 HD21 LEU C 70 1.406 4.377 2.062 1.00 0.00 H new ATOM 0 HD22 LEU C 70 2.687 5.459 2.658 1.00 0.00 H new ATOM 0 HD23 LEU C 70 1.051 6.094 2.363 1.00 0.00 H new ATOM 2911 N SER C 71 5.290 5.471 1.309 1.00 0.00 N ATOM 2912 CA SER C 71 5.907 4.179 1.723 1.00 0.00 C ATOM 2913 C SER C 71 7.250 4.443 2.390 1.00 0.00 C ATOM 2914 O SER C 71 7.705 3.690 3.228 1.00 0.00 O ATOM 2915 CB SER C 71 6.096 3.396 0.424 1.00 0.00 C ATOM 2916 OG SER C 71 6.283 4.308 -0.651 1.00 0.00 O ATOM 0 H SER C 71 5.598 5.830 0.405 1.00 0.00 H new ATOM 0 HA SER C 71 5.293 3.631 2.438 1.00 0.00 H new ATOM 0 HB2 SER C 71 6.957 2.733 0.508 1.00 0.00 H new ATOM 0 HB3 SER C 71 5.226 2.767 0.235 1.00 0.00 H new ATOM 0 HG SER C 71 6.406 3.809 -1.486 1.00 0.00 H new ATOM 2922 N LYS C 72 7.884 5.516 2.023 1.00 0.00 N ATOM 2923 CA LYS C 72 9.202 5.847 2.636 1.00 0.00 C ATOM 2924 C LYS C 72 9.101 5.769 4.158 1.00 0.00 C ATOM 2925 O LYS C 72 9.656 4.889 4.785 1.00 0.00 O ATOM 2926 CB LYS C 72 9.502 7.276 2.187 1.00 0.00 C ATOM 2927 CG LYS C 72 10.852 7.314 1.468 1.00 0.00 C ATOM 2928 CD LYS C 72 11.942 6.775 2.397 1.00 0.00 C ATOM 2929 CE LYS C 72 12.796 7.935 2.912 1.00 0.00 C ATOM 2930 NZ LYS C 72 14.202 7.530 2.633 1.00 0.00 N ATOM 0 H LYS C 72 7.550 6.181 1.325 1.00 0.00 H new ATOM 0 HA LYS C 72 9.988 5.156 2.332 1.00 0.00 H new ATOM 0 HB2 LYS C 72 8.715 7.632 1.523 1.00 0.00 H new ATOM 0 HB3 LYS C 72 9.518 7.943 3.049 1.00 0.00 H new ATOM 0 HG2 LYS C 72 10.808 6.717 0.557 1.00 0.00 H new ATOM 0 HG3 LYS C 72 11.087 8.335 1.168 1.00 0.00 H new ATOM 0 HD2 LYS C 72 11.490 6.243 3.234 1.00 0.00 H new ATOM 0 HD3 LYS C 72 12.567 6.059 1.864 1.00 0.00 H new ATOM 0 HE2 LYS C 72 12.545 8.866 2.404 1.00 0.00 H new ATOM 0 HE3 LYS C 72 12.637 8.100 3.978 1.00 0.00 H new ATOM 0 HZ1 LYS C 72 14.853 8.208 3.077 1.00 0.00 H new ATOM 0 HZ2 LYS C 72 14.373 6.580 3.021 1.00 0.00 H new ATOM 0 HZ3 LYS C 72 14.362 7.518 1.606 1.00 0.00 H new ATOM 2944 N VAL C 73 8.393 6.682 4.756 1.00 0.00 N ATOM 2945 CA VAL C 73 8.252 6.659 6.241 1.00 0.00 C ATOM 2946 C VAL C 73 7.559 5.371 6.684 1.00 0.00 C ATOM 2947 O VAL C 73 7.857 4.827 7.730 1.00 0.00 O ATOM 2948 CB VAL C 73 7.417 7.892 6.639 1.00 0.00 C ATOM 2949 CG1 VAL C 73 6.529 8.361 5.485 1.00 0.00 C ATOM 2950 CG2 VAL C 73 6.527 7.535 7.831 1.00 0.00 C ATOM 0 H VAL C 73 7.905 7.444 4.284 1.00 0.00 H new ATOM 0 HA VAL C 73 9.228 6.689 6.726 1.00 0.00 H new ATOM 0 HB VAL C 73 8.105 8.697 6.898 1.00 0.00 H new ATOM 0 HG11 VAL C 73 5.954 9.232 5.799 1.00 0.00 H new ATOM 0 HG12 VAL C 73 7.152 8.627 4.631 1.00 0.00 H new ATOM 0 HG13 VAL C 73 5.847 7.559 5.201 1.00 0.00 H new ATOM 0 HG21 VAL C 73 5.935 8.404 8.116 1.00 0.00 H new ATOM 0 HG22 VAL C 73 5.862 6.717 7.556 1.00 0.00 H new ATOM 0 HG23 VAL C 73 7.150 7.229 8.672 1.00 0.00 H new ATOM 2960 N CYS C 74 6.632 4.881 5.911 1.00 0.00 N ATOM 2961 CA CYS C 74 5.930 3.634 6.316 1.00 0.00 C ATOM 2962 C CYS C 74 6.952 2.512 6.519 1.00 0.00 C ATOM 2963 O CYS C 74 6.815 1.678 7.393 1.00 0.00 O ATOM 2964 CB CYS C 74 4.990 3.308 5.155 1.00 0.00 C ATOM 2965 SG CYS C 74 3.402 4.138 5.412 1.00 0.00 S ATOM 0 H CYS C 74 6.332 5.286 5.024 1.00 0.00 H new ATOM 0 HA CYS C 74 5.384 3.746 7.252 1.00 0.00 H new ATOM 0 HB2 CYS C 74 5.433 3.631 4.213 1.00 0.00 H new ATOM 0 HB3 CYS C 74 4.842 2.230 5.085 1.00 0.00 H new ATOM 0 HG CYS C 74 3.300 5.143 4.593 1.00 0.00 H new ATOM 2971 N MET C 75 7.990 2.494 5.733 1.00 0.00 N ATOM 2972 CA MET C 75 9.016 1.434 5.912 1.00 0.00 C ATOM 2973 C MET C 75 9.592 1.543 7.320 1.00 0.00 C ATOM 2974 O MET C 75 9.908 0.552 7.949 1.00 0.00 O ATOM 2975 CB MET C 75 10.086 1.719 4.858 1.00 0.00 C ATOM 2976 CG MET C 75 9.672 1.089 3.526 1.00 0.00 C ATOM 2977 SD MET C 75 11.152 0.670 2.571 1.00 0.00 S ATOM 2978 CE MET C 75 11.610 2.360 2.110 1.00 0.00 C ATOM 0 H MET C 75 8.171 3.160 4.982 1.00 0.00 H new ATOM 0 HA MET C 75 8.615 0.427 5.795 1.00 0.00 H new ATOM 0 HB2 MET C 75 10.216 2.795 4.739 1.00 0.00 H new ATOM 0 HB3 MET C 75 11.046 1.315 5.181 1.00 0.00 H new ATOM 0 HG2 MET C 75 9.076 0.194 3.704 1.00 0.00 H new ATOM 0 HG3 MET C 75 9.047 1.782 2.963 1.00 0.00 H new ATOM 0 HE1 MET C 75 12.463 2.334 1.432 1.00 0.00 H new ATOM 0 HE2 MET C 75 10.768 2.843 1.615 1.00 0.00 H new ATOM 0 HE3 MET C 75 11.876 2.922 3.005 1.00 0.00 H new ATOM 2988 N TYR C 76 9.705 2.737 7.836 1.00 0.00 N ATOM 2989 CA TYR C 76 10.230 2.882 9.216 1.00 0.00 C ATOM 2990 C TYR C 76 9.121 2.524 10.201 1.00 0.00 C ATOM 2991 O TYR C 76 9.374 2.220 11.350 1.00 0.00 O ATOM 2992 CB TYR C 76 10.667 4.343 9.359 1.00 0.00 C ATOM 2993 CG TYR C 76 12.086 4.382 9.885 1.00 0.00 C ATOM 2994 CD1 TYR C 76 12.981 3.357 9.548 1.00 0.00 C ATOM 2995 CD2 TYR C 76 12.510 5.433 10.712 1.00 0.00 C ATOM 2996 CE1 TYR C 76 14.290 3.380 10.033 1.00 0.00 C ATOM 2997 CE2 TYR C 76 13.826 5.452 11.197 1.00 0.00 C ATOM 2998 CZ TYR C 76 14.714 4.426 10.859 1.00 0.00 C ATOM 2999 OH TYR C 76 16.008 4.446 11.338 1.00 0.00 O ATOM 0 H TYR C 76 9.458 3.607 7.365 1.00 0.00 H new ATOM 0 HA TYR C 76 11.074 2.223 9.419 1.00 0.00 H new ATOM 0 HB2 TYR C 76 10.608 4.850 8.396 1.00 0.00 H new ATOM 0 HB3 TYR C 76 9.999 4.871 10.039 1.00 0.00 H new ATOM 0 HD1 TYR C 76 12.657 2.547 8.911 1.00 0.00 H new ATOM 0 HD2 TYR C 76 11.825 6.225 10.975 1.00 0.00 H new ATOM 0 HE1 TYR C 76 14.976 2.589 9.770 1.00 0.00 H new ATOM 0 HE2 TYR C 76 14.154 6.261 11.833 1.00 0.00 H new ATOM 0 HH TYR C 76 16.138 5.241 11.895 1.00 0.00 H new ATOM 3009 N PHE C 77 7.892 2.515 9.751 1.00 0.00 N ATOM 3010 CA PHE C 77 6.787 2.124 10.666 1.00 0.00 C ATOM 3011 C PHE C 77 7.000 0.661 11.031 1.00 0.00 C ATOM 3012 O PHE C 77 6.741 0.233 12.138 1.00 0.00 O ATOM 3013 CB PHE C 77 5.498 2.268 9.850 1.00 0.00 C ATOM 3014 CG PHE C 77 4.886 3.644 10.020 1.00 0.00 C ATOM 3015 CD1 PHE C 77 5.447 4.579 10.903 1.00 0.00 C ATOM 3016 CD2 PHE C 77 3.748 3.985 9.271 1.00 0.00 C ATOM 3017 CE1 PHE C 77 4.870 5.849 11.033 1.00 0.00 C ATOM 3018 CE2 PHE C 77 3.178 5.253 9.401 1.00 0.00 C ATOM 3019 CZ PHE C 77 3.739 6.186 10.280 1.00 0.00 C ATOM 0 H PHE C 77 7.612 2.759 8.801 1.00 0.00 H new ATOM 0 HA PHE C 77 6.745 2.727 11.573 1.00 0.00 H new ATOM 0 HB2 PHE C 77 5.711 2.091 8.796 1.00 0.00 H new ATOM 0 HB3 PHE C 77 4.781 1.508 10.162 1.00 0.00 H new ATOM 0 HD1 PHE C 77 6.322 4.320 11.481 1.00 0.00 H new ATOM 0 HD2 PHE C 77 3.313 3.265 8.593 1.00 0.00 H new ATOM 0 HE1 PHE C 77 5.298 6.569 11.715 1.00 0.00 H new ATOM 0 HE2 PHE C 77 2.304 5.514 8.823 1.00 0.00 H new ATOM 0 HZ PHE C 77 3.299 7.167 10.378 1.00 0.00 H new ATOM 3029 N THR C 78 7.498 -0.103 10.095 1.00 0.00 N ATOM 3030 CA THR C 78 7.768 -1.540 10.372 1.00 0.00 C ATOM 3031 C THR C 78 9.202 -1.689 10.877 1.00 0.00 C ATOM 3032 O THR C 78 9.472 -2.425 11.805 1.00 0.00 O ATOM 3033 CB THR C 78 7.588 -2.251 9.030 1.00 0.00 C ATOM 3034 OG1 THR C 78 7.454 -1.285 7.996 1.00 0.00 O ATOM 3035 CG2 THR C 78 6.337 -3.129 9.077 1.00 0.00 C ATOM 0 H THR C 78 7.729 0.208 9.151 1.00 0.00 H new ATOM 0 HA THR C 78 7.106 -1.957 11.131 1.00 0.00 H new ATOM 0 HB THR C 78 8.459 -2.876 8.832 1.00 0.00 H new ATOM 0 HG1 THR C 78 6.526 -0.973 7.958 1.00 0.00 H new ATOM 0 HG21 THR C 78 6.211 -3.634 8.120 1.00 0.00 H new ATOM 0 HG22 THR C 78 6.443 -3.871 9.868 1.00 0.00 H new ATOM 0 HG23 THR C 78 5.464 -2.508 9.277 1.00 0.00 H new ATOM 3043 N TYR C 79 10.120 -0.977 10.282 1.00 0.00 N ATOM 3044 CA TYR C 79 11.535 -1.057 10.739 1.00 0.00 C ATOM 3045 C TYR C 79 11.611 -0.636 12.207 1.00 0.00 C ATOM 3046 O TYR C 79 12.253 -1.278 13.016 1.00 0.00 O ATOM 3047 CB TYR C 79 12.294 -0.064 9.858 1.00 0.00 C ATOM 3048 CG TYR C 79 13.780 -0.241 10.061 1.00 0.00 C ATOM 3049 CD1 TYR C 79 14.462 -1.259 9.383 1.00 0.00 C ATOM 3050 CD2 TYR C 79 14.475 0.615 10.925 1.00 0.00 C ATOM 3051 CE1 TYR C 79 15.840 -1.421 9.569 1.00 0.00 C ATOM 3052 CE2 TYR C 79 15.853 0.451 11.111 1.00 0.00 C ATOM 3053 CZ TYR C 79 16.535 -0.567 10.433 1.00 0.00 C ATOM 3054 OH TYR C 79 17.893 -0.727 10.615 1.00 0.00 O ATOM 0 H TYR C 79 9.951 -0.344 9.500 1.00 0.00 H new ATOM 0 HA TYR C 79 11.950 -2.062 10.660 1.00 0.00 H new ATOM 0 HB2 TYR C 79 12.038 -0.222 8.810 1.00 0.00 H new ATOM 0 HB3 TYR C 79 12.002 0.956 10.107 1.00 0.00 H new ATOM 0 HD1 TYR C 79 13.925 -1.919 8.717 1.00 0.00 H new ATOM 0 HD2 TYR C 79 13.949 1.400 11.447 1.00 0.00 H new ATOM 0 HE1 TYR C 79 16.367 -2.205 9.046 1.00 0.00 H new ATOM 0 HE2 TYR C 79 16.390 1.110 11.777 1.00 0.00 H new ATOM 0 HH TYR C 79 18.109 -0.635 11.567 1.00 0.00 H new ATOM 3064 N LYS C 80 10.952 0.436 12.557 1.00 0.00 N ATOM 3065 CA LYS C 80 10.978 0.896 13.974 1.00 0.00 C ATOM 3066 C LYS C 80 10.401 -0.188 14.889 1.00 0.00 C ATOM 3067 O LYS C 80 10.824 -0.352 16.015 1.00 0.00 O ATOM 3068 CB LYS C 80 10.099 2.147 14.001 1.00 0.00 C ATOM 3069 CG LYS C 80 9.712 2.474 15.445 1.00 0.00 C ATOM 3070 CD LYS C 80 8.196 2.355 15.608 1.00 0.00 C ATOM 3071 CE LYS C 80 7.812 2.659 17.058 1.00 0.00 C ATOM 3072 NZ LYS C 80 8.360 4.018 17.323 1.00 0.00 N ATOM 0 H LYS C 80 10.398 1.012 11.923 1.00 0.00 H new ATOM 0 HA LYS C 80 11.989 1.103 14.324 1.00 0.00 H new ATOM 0 HB2 LYS C 80 10.633 2.988 13.558 1.00 0.00 H new ATOM 0 HB3 LYS C 80 9.203 1.987 13.401 1.00 0.00 H new ATOM 0 HG2 LYS C 80 10.216 1.793 16.131 1.00 0.00 H new ATOM 0 HG3 LYS C 80 10.038 3.482 15.700 1.00 0.00 H new ATOM 0 HD2 LYS C 80 7.692 3.048 14.934 1.00 0.00 H new ATOM 0 HD3 LYS C 80 7.868 1.351 15.337 1.00 0.00 H new ATOM 0 HE2 LYS C 80 6.731 2.636 17.193 1.00 0.00 H new ATOM 0 HE3 LYS C 80 8.235 1.922 17.741 1.00 0.00 H new ATOM 0 HZ1 LYS C 80 7.763 4.502 18.024 1.00 0.00 H new ATOM 0 HZ2 LYS C 80 9.329 3.936 17.691 1.00 0.00 H new ATOM 0 HZ3 LYS C 80 8.371 4.566 16.439 1.00 0.00 H new ATOM 3086 N VAL C 81 9.434 -0.927 14.415 1.00 0.00 N ATOM 3087 CA VAL C 81 8.833 -1.997 15.262 1.00 0.00 C ATOM 3088 C VAL C 81 9.897 -3.027 15.648 1.00 0.00 C ATOM 3089 O VAL C 81 9.920 -3.525 16.756 1.00 0.00 O ATOM 3090 CB VAL C 81 7.756 -2.636 14.388 1.00 0.00 C ATOM 3091 CG1 VAL C 81 7.192 -3.872 15.094 1.00 0.00 C ATOM 3092 CG2 VAL C 81 6.630 -1.629 14.148 1.00 0.00 C ATOM 0 H VAL C 81 9.035 -0.836 13.481 1.00 0.00 H new ATOM 0 HA VAL C 81 8.421 -1.605 16.192 1.00 0.00 H new ATOM 0 HB VAL C 81 8.191 -2.930 13.433 1.00 0.00 H new ATOM 0 HG11 VAL C 81 6.423 -4.328 14.470 1.00 0.00 H new ATOM 0 HG12 VAL C 81 7.994 -4.590 15.266 1.00 0.00 H new ATOM 0 HG13 VAL C 81 6.757 -3.579 16.049 1.00 0.00 H new ATOM 0 HG21 VAL C 81 5.861 -2.085 13.524 1.00 0.00 H new ATOM 0 HG22 VAL C 81 6.195 -1.335 15.103 1.00 0.00 H new ATOM 0 HG23 VAL C 81 7.030 -0.749 13.645 1.00 0.00 H new ATOM 3102 N ARG C 82 10.778 -3.353 14.742 1.00 0.00 N ATOM 3103 CA ARG C 82 11.838 -4.351 15.062 1.00 0.00 C ATOM 3104 C ARG C 82 13.059 -3.651 15.660 1.00 0.00 C ATOM 3105 O ARG C 82 13.891 -4.268 16.295 1.00 0.00 O ATOM 3106 CB ARG C 82 12.191 -4.999 13.722 1.00 0.00 C ATOM 3107 CG ARG C 82 12.807 -3.950 12.794 1.00 0.00 C ATOM 3108 CD ARG C 82 13.958 -4.579 12.006 1.00 0.00 C ATOM 3109 NE ARG C 82 15.130 -4.513 12.922 1.00 0.00 N ATOM 3110 CZ ARG C 82 16.293 -4.955 12.528 1.00 0.00 C ATOM 3111 NH1 ARG C 82 16.431 -5.458 11.331 1.00 0.00 N ATOM 3112 NH2 ARG C 82 17.320 -4.895 13.331 1.00 0.00 N ATOM 0 H ARG C 82 10.810 -2.973 13.796 1.00 0.00 H new ATOM 0 HA ARG C 82 11.505 -5.087 15.794 1.00 0.00 H new ATOM 0 HB2 ARG C 82 12.892 -5.820 13.876 1.00 0.00 H new ATOM 0 HB3 ARG C 82 11.297 -5.424 13.265 1.00 0.00 H new ATOM 0 HG2 ARG C 82 12.051 -3.566 12.109 1.00 0.00 H new ATOM 0 HG3 ARG C 82 13.171 -3.103 13.376 1.00 0.00 H new ATOM 0 HD2 ARG C 82 13.731 -5.608 11.729 1.00 0.00 H new ATOM 0 HD3 ARG C 82 14.148 -4.034 11.081 1.00 0.00 H new ATOM 0 HE ARG C 82 15.024 -4.122 13.858 1.00 0.00 H new ATOM 0 HH11 ARG C 82 15.629 -5.506 10.702 1.00 0.00 H new ATOM 0 HH12 ARG C 82 17.341 -5.803 11.025 1.00 0.00 H new ATOM 0 HH21 ARG C 82 17.214 -4.503 14.267 1.00 0.00 H new ATOM 0 HH22 ARG C 82 18.229 -5.240 13.023 1.00 0.00 H new ATOM 3126 N TYR C 83 13.171 -2.366 15.465 1.00 0.00 N ATOM 3127 CA TYR C 83 14.336 -1.629 16.028 1.00 0.00 C ATOM 3128 C TYR C 83 13.952 -0.992 17.366 1.00 0.00 C ATOM 3129 O TYR C 83 14.791 -0.493 18.090 1.00 0.00 O ATOM 3130 CB TYR C 83 14.668 -0.554 14.994 1.00 0.00 C ATOM 3131 CG TYR C 83 15.961 -0.910 14.301 1.00 0.00 C ATOM 3132 CD1 TYR C 83 15.965 -1.850 13.264 1.00 0.00 C ATOM 3133 CD2 TYR C 83 17.158 -0.302 14.698 1.00 0.00 C ATOM 3134 CE1 TYR C 83 17.166 -2.182 12.623 1.00 0.00 C ATOM 3135 CE2 TYR C 83 18.358 -0.634 14.058 1.00 0.00 C ATOM 3136 CZ TYR C 83 18.361 -1.573 13.021 1.00 0.00 C ATOM 3137 OH TYR C 83 19.545 -1.901 12.391 1.00 0.00 O ATOM 0 H TYR C 83 12.507 -1.796 14.941 1.00 0.00 H new ATOM 0 HA TYR C 83 15.188 -2.282 16.217 1.00 0.00 H new ATOM 0 HB2 TYR C 83 13.862 -0.473 14.265 1.00 0.00 H new ATOM 0 HB3 TYR C 83 14.758 0.418 15.479 1.00 0.00 H new ATOM 0 HD1 TYR C 83 15.042 -2.320 12.958 1.00 0.00 H new ATOM 0 HD2 TYR C 83 17.156 0.423 15.498 1.00 0.00 H new ATOM 0 HE1 TYR C 83 17.169 -2.907 11.823 1.00 0.00 H new ATOM 0 HE2 TYR C 83 19.281 -0.165 14.365 1.00 0.00 H new ATOM 0 HH TYR C 83 19.414 -1.887 11.420 1.00 0.00 H new ATOM 3274 N PHE C 93 17.501 6.369 8.413 1.00 0.00 N ATOM 3275 CA PHE C 93 16.899 6.125 7.071 1.00 0.00 C ATOM 3276 C PHE C 93 17.699 6.854 5.989 1.00 0.00 C ATOM 3277 O PHE C 93 18.123 7.977 6.179 1.00 0.00 O ATOM 3278 CB PHE C 93 15.482 6.689 7.164 1.00 0.00 C ATOM 3279 CG PHE C 93 14.494 5.628 6.741 1.00 0.00 C ATOM 3280 CD1 PHE C 93 14.627 4.319 7.219 1.00 0.00 C ATOM 3281 CD2 PHE C 93 13.446 5.954 5.873 1.00 0.00 C ATOM 3282 CE1 PHE C 93 13.713 3.335 6.827 1.00 0.00 C ATOM 3283 CE2 PHE C 93 12.531 4.970 5.482 1.00 0.00 C ATOM 3284 CZ PHE C 93 12.663 3.660 5.958 1.00 0.00 C ATOM 0 HA PHE C 93 16.900 5.068 6.805 1.00 0.00 H new ATOM 0 HB2 PHE C 93 15.273 7.011 8.184 1.00 0.00 H new ATOM 0 HB3 PHE C 93 15.385 7.567 6.526 1.00 0.00 H new ATOM 0 HD1 PHE C 93 15.435 4.069 7.890 1.00 0.00 H new ATOM 0 HD2 PHE C 93 13.343 6.964 5.505 1.00 0.00 H new ATOM 0 HE1 PHE C 93 13.817 2.325 7.194 1.00 0.00 H new ATOM 0 HE2 PHE C 93 11.722 5.221 4.812 1.00 0.00 H new ATOM 0 HZ PHE C 93 11.957 2.901 5.656 1.00 0.00 H new ATOM 3294 N PRO C 94 17.877 6.184 4.884 1.00 0.00 N ATOM 3295 CA PRO C 94 18.635 6.766 3.750 1.00 0.00 C ATOM 3296 C PRO C 94 17.805 7.842 3.040 1.00 0.00 C ATOM 3297 O PRO C 94 16.639 7.653 2.755 1.00 0.00 O ATOM 3298 CB PRO C 94 18.875 5.572 2.831 1.00 0.00 C ATOM 3299 CG PRO C 94 17.777 4.607 3.150 1.00 0.00 C ATOM 3300 CD PRO C 94 17.394 4.830 4.591 1.00 0.00 C ATOM 0 HA PRO C 94 19.559 7.254 4.060 1.00 0.00 H new ATOM 0 HB2 PRO C 94 18.846 5.869 1.783 1.00 0.00 H new ATOM 0 HB3 PRO C 94 19.854 5.128 3.009 1.00 0.00 H new ATOM 0 HG2 PRO C 94 16.921 4.768 2.495 1.00 0.00 H new ATOM 0 HG3 PRO C 94 18.109 3.581 2.994 1.00 0.00 H new ATOM 0 HD2 PRO C 94 16.316 4.752 4.734 1.00 0.00 H new ATOM 0 HD3 PRO C 94 17.857 4.091 5.245 1.00 0.00 H new ATOM 3308 N ILE C 95 18.403 8.964 2.749 1.00 0.00 N ATOM 3309 CA ILE C 95 17.658 10.054 2.054 1.00 0.00 C ATOM 3310 C ILE C 95 18.531 10.650 0.943 1.00 0.00 C ATOM 3311 O ILE C 95 19.710 10.881 1.126 1.00 0.00 O ATOM 3312 CB ILE C 95 17.365 11.090 3.145 1.00 0.00 C ATOM 3313 CG1 ILE C 95 15.941 10.883 3.670 1.00 0.00 C ATOM 3314 CG2 ILE C 95 17.490 12.503 2.570 1.00 0.00 C ATOM 3315 CD1 ILE C 95 15.982 10.059 4.958 1.00 0.00 C ATOM 0 H ILE C 95 19.378 9.175 2.963 1.00 0.00 H new ATOM 0 HA ILE C 95 16.741 9.705 1.580 1.00 0.00 H new ATOM 0 HB ILE C 95 18.081 10.968 3.957 1.00 0.00 H new ATOM 0 HG12 ILE C 95 15.469 11.847 3.858 1.00 0.00 H new ATOM 0 HG13 ILE C 95 15.337 10.373 2.920 1.00 0.00 H new ATOM 0 HG21 ILE C 95 17.280 13.234 3.351 1.00 0.00 H new ATOM 0 HG22 ILE C 95 18.502 12.654 2.194 1.00 0.00 H new ATOM 0 HG23 ILE C 95 16.777 12.629 1.755 1.00 0.00 H new ATOM 0 HD11 ILE C 95 14.968 9.913 5.329 1.00 0.00 H new ATOM 0 HD12 ILE C 95 16.437 9.089 4.755 1.00 0.00 H new ATOM 0 HD13 ILE C 95 16.571 10.586 5.709 1.00 0.00 H new ATOM 3327 N ALA C 96 17.966 10.890 -0.210 1.00 0.00 N ATOM 3328 CA ALA C 96 18.773 11.459 -1.330 1.00 0.00 C ATOM 3329 C ALA C 96 17.993 12.561 -2.054 1.00 0.00 C ATOM 3330 O ALA C 96 16.869 12.862 -1.702 1.00 0.00 O ATOM 3331 CB ALA C 96 19.017 10.280 -2.270 1.00 0.00 C ATOM 0 H ALA C 96 16.984 10.718 -0.425 1.00 0.00 H new ATOM 0 HA ALA C 96 19.700 11.911 -0.978 1.00 0.00 H new ATOM 0 HB1 ALA C 96 19.606 10.612 -3.125 1.00 0.00 H new ATOM 0 HB2 ALA C 96 19.558 9.497 -1.739 1.00 0.00 H new ATOM 0 HB3 ALA C 96 18.061 9.888 -2.618 1.00 0.00 H new ATOM 3337 N PRO C 97 18.622 13.121 -3.053 1.00 0.00 N ATOM 3338 CA PRO C 97 17.984 14.197 -3.851 1.00 0.00 C ATOM 3339 C PRO C 97 16.900 13.607 -4.756 1.00 0.00 C ATOM 3340 O PRO C 97 17.087 13.444 -5.945 1.00 0.00 O ATOM 3341 CB PRO C 97 19.137 14.761 -4.678 1.00 0.00 C ATOM 3342 CG PRO C 97 20.129 13.645 -4.772 1.00 0.00 C ATOM 3343 CD PRO C 97 19.973 12.806 -3.529 1.00 0.00 C ATOM 0 HA PRO C 97 17.495 14.957 -3.241 1.00 0.00 H new ATOM 0 HB2 PRO C 97 18.798 15.072 -5.666 1.00 0.00 H new ATOM 0 HB3 PRO C 97 19.574 15.638 -4.200 1.00 0.00 H new ATOM 0 HG2 PRO C 97 19.951 13.046 -5.665 1.00 0.00 H new ATOM 0 HG3 PRO C 97 21.143 14.037 -4.847 1.00 0.00 H new ATOM 0 HD2 PRO C 97 20.081 11.744 -3.749 1.00 0.00 H new ATOM 0 HD3 PRO C 97 20.727 13.055 -2.782 1.00 0.00 H new ATOM 3351 N GLU C 98 15.771 13.280 -4.194 1.00 0.00 N ATOM 3352 CA GLU C 98 14.666 12.691 -4.998 1.00 0.00 C ATOM 3353 C GLU C 98 13.589 12.245 -4.025 1.00 0.00 C ATOM 3354 O GLU C 98 12.406 12.298 -4.300 1.00 0.00 O ATOM 3355 CB GLU C 98 15.278 11.493 -5.724 1.00 0.00 C ATOM 3356 CG GLU C 98 14.925 11.563 -7.211 1.00 0.00 C ATOM 3357 CD GLU C 98 15.320 12.933 -7.766 1.00 0.00 C ATOM 3358 OE1 GLU C 98 16.459 13.077 -8.177 1.00 0.00 O ATOM 3359 OE2 GLU C 98 14.476 13.814 -7.769 1.00 0.00 O ATOM 0 H GLU C 98 15.565 13.397 -3.202 1.00 0.00 H new ATOM 0 HA GLU C 98 14.225 13.383 -5.715 1.00 0.00 H new ATOM 0 HB2 GLU C 98 16.360 11.491 -5.596 1.00 0.00 H new ATOM 0 HB3 GLU C 98 14.904 10.564 -5.294 1.00 0.00 H new ATOM 0 HG2 GLU C 98 15.444 10.775 -7.756 1.00 0.00 H new ATOM 0 HG3 GLU C 98 13.857 11.397 -7.350 1.00 0.00 H new ATOM 3366 N ILE C 99 14.012 11.842 -2.864 1.00 0.00 N ATOM 3367 CA ILE C 99 13.057 11.427 -1.816 1.00 0.00 C ATOM 3368 C ILE C 99 13.615 11.865 -0.466 1.00 0.00 C ATOM 3369 O ILE C 99 14.795 11.748 -0.210 1.00 0.00 O ATOM 3370 CB ILE C 99 12.990 9.903 -1.910 1.00 0.00 C ATOM 3371 CG1 ILE C 99 12.091 9.364 -0.795 1.00 0.00 C ATOM 3372 CG2 ILE C 99 14.395 9.319 -1.757 1.00 0.00 C ATOM 3373 CD1 ILE C 99 10.778 10.149 -0.772 1.00 0.00 C ATOM 0 H ILE C 99 14.995 11.783 -2.597 1.00 0.00 H new ATOM 0 HA ILE C 99 12.066 11.866 -1.933 1.00 0.00 H new ATOM 0 HB ILE C 99 12.582 9.617 -2.879 1.00 0.00 H new ATOM 0 HG12 ILE C 99 11.891 8.305 -0.955 1.00 0.00 H new ATOM 0 HG13 ILE C 99 12.596 9.451 0.167 1.00 0.00 H new ATOM 0 HG21 ILE C 99 14.347 8.232 -1.824 1.00 0.00 H new ATOM 0 HG22 ILE C 99 15.037 9.703 -2.550 1.00 0.00 H new ATOM 0 HG23 ILE C 99 14.804 9.605 -0.788 1.00 0.00 H new ATOM 0 HD11 ILE C 99 10.138 9.765 0.022 1.00 0.00 H new ATOM 0 HD12 ILE C 99 10.988 11.203 -0.591 1.00 0.00 H new ATOM 0 HD13 ILE C 99 10.272 10.039 -1.731 1.00 0.00 H new ATOM 3385 N ALA C 100 12.766 12.374 0.377 1.00 0.00 N ATOM 3386 CA ALA C 100 13.181 12.861 1.735 1.00 0.00 C ATOM 3387 C ALA C 100 12.707 14.301 1.913 1.00 0.00 C ATOM 3388 O ALA C 100 12.296 14.705 2.982 1.00 0.00 O ATOM 3389 CB ALA C 100 14.711 12.807 1.787 1.00 0.00 C ATOM 0 H ALA C 100 11.770 12.479 0.183 1.00 0.00 H new ATOM 0 HA ALA C 100 12.749 12.248 2.526 1.00 0.00 H new ATOM 0 HB1 ALA C 100 15.054 13.154 2.761 1.00 0.00 H new ATOM 0 HB2 ALA C 100 15.044 11.781 1.629 1.00 0.00 H new ATOM 0 HB3 ALA C 100 15.124 13.447 1.007 1.00 0.00 H new ATOM 3395 N LEU C 101 12.757 15.077 0.864 1.00 0.00 N ATOM 3396 CA LEU C 101 12.303 16.492 0.967 1.00 0.00 C ATOM 3397 C LEU C 101 10.851 16.534 1.452 1.00 0.00 C ATOM 3398 O LEU C 101 10.487 17.340 2.285 1.00 0.00 O ATOM 3399 CB LEU C 101 12.414 17.050 -0.453 1.00 0.00 C ATOM 3400 CG LEU C 101 12.728 18.546 -0.391 1.00 0.00 C ATOM 3401 CD1 LEU C 101 14.031 18.763 0.382 1.00 0.00 C ATOM 3402 CD2 LEU C 101 12.884 19.092 -1.813 1.00 0.00 C ATOM 0 H LEU C 101 13.092 14.793 -0.057 1.00 0.00 H new ATOM 0 HA LEU C 101 12.896 17.072 1.674 1.00 0.00 H new ATOM 0 HB2 LEU C 101 13.197 16.526 -1.001 1.00 0.00 H new ATOM 0 HB3 LEU C 101 11.482 16.885 -0.994 1.00 0.00 H new ATOM 0 HG LEU C 101 11.915 19.067 0.114 1.00 0.00 H new ATOM 0 HD11 LEU C 101 14.255 19.829 0.426 1.00 0.00 H new ATOM 0 HD12 LEU C 101 13.923 18.373 1.394 1.00 0.00 H new ATOM 0 HD13 LEU C 101 14.845 18.242 -0.123 1.00 0.00 H new ATOM 0 HD21 LEU C 101 13.108 20.158 -1.771 1.00 0.00 H new ATOM 0 HD22 LEU C 101 13.698 18.570 -2.316 1.00 0.00 H new ATOM 0 HD23 LEU C 101 11.957 18.937 -2.366 1.00 0.00 H new ATOM 3414 N GLU C 102 10.022 15.664 0.941 1.00 0.00 N ATOM 3415 CA GLU C 102 8.597 15.645 1.376 1.00 0.00 C ATOM 3416 C GLU C 102 8.496 15.145 2.821 1.00 0.00 C ATOM 3417 O GLU C 102 7.667 15.594 3.587 1.00 0.00 O ATOM 3418 CB GLU C 102 7.901 14.675 0.421 1.00 0.00 C ATOM 3419 CG GLU C 102 7.610 15.383 -0.903 1.00 0.00 C ATOM 3420 CD GLU C 102 6.249 16.079 -0.823 1.00 0.00 C ATOM 3421 OE1 GLU C 102 5.802 16.335 0.283 1.00 0.00 O ATOM 3422 OE2 GLU C 102 5.678 16.341 -1.868 1.00 0.00 O ATOM 0 H GLU C 102 10.271 14.965 0.241 1.00 0.00 H new ATOM 0 HA GLU C 102 8.142 16.635 1.348 1.00 0.00 H new ATOM 0 HB2 GLU C 102 8.532 13.803 0.248 1.00 0.00 H new ATOM 0 HB3 GLU C 102 6.973 14.315 0.864 1.00 0.00 H new ATOM 0 HG2 GLU C 102 8.391 16.113 -1.117 1.00 0.00 H new ATOM 0 HG3 GLU C 102 7.614 14.663 -1.721 1.00 0.00 H new ATOM 3429 N LEU C 103 9.337 14.219 3.197 1.00 0.00 N ATOM 3430 CA LEU C 103 9.290 13.692 4.590 1.00 0.00 C ATOM 3431 C LEU C 103 9.556 14.821 5.589 1.00 0.00 C ATOM 3432 O LEU C 103 9.151 14.759 6.732 1.00 0.00 O ATOM 3433 CB LEU C 103 10.404 12.646 4.656 1.00 0.00 C ATOM 3434 CG LEU C 103 10.122 11.535 3.643 1.00 0.00 C ATOM 3435 CD1 LEU C 103 11.369 10.667 3.476 1.00 0.00 C ATOM 3436 CD2 LEU C 103 8.964 10.671 4.147 1.00 0.00 C ATOM 0 H LEU C 103 10.053 13.806 2.600 1.00 0.00 H new ATOM 0 HA LEU C 103 8.317 13.268 4.839 1.00 0.00 H new ATOM 0 HB2 LEU C 103 11.367 13.111 4.443 1.00 0.00 H new ATOM 0 HB3 LEU C 103 10.467 12.229 5.661 1.00 0.00 H new ATOM 0 HG LEU C 103 9.857 11.977 2.683 1.00 0.00 H new ATOM 0 HD11 LEU C 103 11.167 9.876 2.754 1.00 0.00 H new ATOM 0 HD12 LEU C 103 12.195 11.282 3.119 1.00 0.00 H new ATOM 0 HD13 LEU C 103 11.635 10.224 4.436 1.00 0.00 H new ATOM 0 HD21 LEU C 103 8.761 9.878 3.427 1.00 0.00 H new ATOM 0 HD22 LEU C 103 9.231 10.229 5.107 1.00 0.00 H new ATOM 0 HD23 LEU C 103 8.074 11.289 4.267 1.00 0.00 H new ATOM 3448 N LEU C 104 10.227 15.856 5.165 1.00 0.00 N ATOM 3449 CA LEU C 104 10.508 16.988 6.093 1.00 0.00 C ATOM 3450 C LEU C 104 9.243 17.342 6.878 1.00 0.00 C ATOM 3451 O LEU C 104 9.183 17.187 8.081 1.00 0.00 O ATOM 3452 CB LEU C 104 10.924 18.149 5.190 1.00 0.00 C ATOM 3453 CG LEU C 104 10.873 19.456 5.982 1.00 0.00 C ATOM 3454 CD1 LEU C 104 11.742 19.329 7.234 1.00 0.00 C ATOM 3455 CD2 LEU C 104 11.400 20.600 5.111 1.00 0.00 C ATOM 0 H LEU C 104 10.592 15.967 4.219 1.00 0.00 H new ATOM 0 HA LEU C 104 11.282 16.747 6.822 1.00 0.00 H new ATOM 0 HB2 LEU C 104 11.931 17.983 4.807 1.00 0.00 H new ATOM 0 HB3 LEU C 104 10.260 18.208 4.327 1.00 0.00 H new ATOM 0 HG LEU C 104 9.844 19.664 6.274 1.00 0.00 H new ATOM 0 HD11 LEU C 104 11.705 20.261 7.798 1.00 0.00 H new ATOM 0 HD12 LEU C 104 11.369 18.514 7.855 1.00 0.00 H new ATOM 0 HD13 LEU C 104 12.772 19.121 6.943 1.00 0.00 H new ATOM 0 HD21 LEU C 104 11.364 21.532 5.674 1.00 0.00 H new ATOM 0 HD22 LEU C 104 12.429 20.391 4.820 1.00 0.00 H new ATOM 0 HD23 LEU C 104 10.782 20.692 4.218 1.00 0.00 H new ATOM 3467 N MET C 105 8.229 17.810 6.203 1.00 0.00 N ATOM 3468 CA MET C 105 6.966 18.166 6.909 1.00 0.00 C ATOM 3469 C MET C 105 6.076 16.928 7.046 1.00 0.00 C ATOM 3470 O MET C 105 5.228 16.853 7.913 1.00 0.00 O ATOM 3471 CB MET C 105 6.295 19.213 6.018 1.00 0.00 C ATOM 3472 CG MET C 105 6.763 20.609 6.431 1.00 0.00 C ATOM 3473 SD MET C 105 6.284 20.922 8.149 1.00 0.00 S ATOM 3474 CE MET C 105 7.131 22.510 8.335 1.00 0.00 C ATOM 0 H MET C 105 8.221 17.961 5.194 1.00 0.00 H new ATOM 0 HA MET C 105 7.145 18.544 7.915 1.00 0.00 H new ATOM 0 HB2 MET C 105 6.543 19.029 4.973 1.00 0.00 H new ATOM 0 HB3 MET C 105 5.211 19.140 6.106 1.00 0.00 H new ATOM 0 HG2 MET C 105 7.845 20.688 6.324 1.00 0.00 H new ATOM 0 HG3 MET C 105 6.322 21.361 5.776 1.00 0.00 H new ATOM 0 HE1 MET C 105 6.967 22.894 9.342 1.00 0.00 H new ATOM 0 HE2 MET C 105 8.200 22.374 8.169 1.00 0.00 H new ATOM 0 HE3 MET C 105 6.738 23.220 7.607 1.00 0.00 H new ATOM 3484 N ALA C 106 6.267 15.954 6.197 1.00 0.00 N ATOM 3485 CA ALA C 106 5.436 14.719 6.277 1.00 0.00 C ATOM 3486 C ALA C 106 5.895 13.851 7.453 1.00 0.00 C ATOM 3487 O ALA C 106 5.093 13.322 8.195 1.00 0.00 O ATOM 3488 CB ALA C 106 5.671 13.996 4.952 1.00 0.00 C ATOM 0 H ALA C 106 6.963 15.961 5.451 1.00 0.00 H new ATOM 0 HA ALA C 106 4.381 14.940 6.437 1.00 0.00 H new ATOM 0 HB1 ALA C 106 5.091 13.073 4.933 1.00 0.00 H new ATOM 0 HB2 ALA C 106 5.359 14.637 4.127 1.00 0.00 H new ATOM 0 HB3 ALA C 106 6.730 13.761 4.849 1.00 0.00 H new ATOM 3494 N ALA C 107 7.181 13.707 7.631 1.00 0.00 N ATOM 3495 CA ALA C 107 7.685 12.882 8.763 1.00 0.00 C ATOM 3496 C ALA C 107 7.298 13.538 10.087 1.00 0.00 C ATOM 3497 O ALA C 107 6.765 12.907 10.978 1.00 0.00 O ATOM 3498 CB ALA C 107 9.200 12.881 8.602 1.00 0.00 C ATOM 0 H ALA C 107 7.902 14.125 7.042 1.00 0.00 H new ATOM 0 HA ALA C 107 7.272 11.873 8.762 1.00 0.00 H new ATOM 0 HB1 ALA C 107 9.650 12.292 9.401 1.00 0.00 H new ATOM 0 HB2 ALA C 107 9.463 12.446 7.638 1.00 0.00 H new ATOM 0 HB3 ALA C 107 9.572 13.904 8.652 1.00 0.00 H new ATOM 3504 N ASN C 108 7.565 14.810 10.217 1.00 0.00 N ATOM 3505 CA ASN C 108 7.218 15.524 11.477 1.00 0.00 C ATOM 3506 C ASN C 108 5.699 15.589 11.645 1.00 0.00 C ATOM 3507 O ASN C 108 5.181 15.481 12.739 1.00 0.00 O ATOM 3508 CB ASN C 108 7.800 16.927 11.307 1.00 0.00 C ATOM 3509 CG ASN C 108 7.527 17.749 12.569 1.00 0.00 C ATOM 3510 OD1 ASN C 108 8.410 17.948 13.380 1.00 0.00 O ATOM 3511 ND2 ASN C 108 6.334 18.238 12.769 1.00 0.00 N ATOM 0 H ASN C 108 8.010 15.386 9.502 1.00 0.00 H new ATOM 0 HA ASN C 108 7.613 15.023 12.360 1.00 0.00 H new ATOM 0 HB2 ASN C 108 8.873 16.868 11.124 1.00 0.00 H new ATOM 0 HB3 ASN C 108 7.355 17.414 10.439 1.00 0.00 H new ATOM 0 HD21 ASN C 108 6.142 18.788 13.606 1.00 0.00 H new ATOM 0 HD22 ASN C 108 5.593 18.071 12.088 1.00 0.00 H new ATOM 3518 N PHE C 109 4.980 15.762 10.569 1.00 0.00 N ATOM 3519 CA PHE C 109 3.495 15.831 10.671 1.00 0.00 C ATOM 3520 C PHE C 109 2.955 14.520 11.246 1.00 0.00 C ATOM 3521 O PHE C 109 1.916 14.485 11.873 1.00 0.00 O ATOM 3522 CB PHE C 109 3.005 16.030 9.236 1.00 0.00 C ATOM 3523 CG PHE C 109 1.516 15.789 9.174 1.00 0.00 C ATOM 3524 CD1 PHE C 109 0.657 16.492 10.028 1.00 0.00 C ATOM 3525 CD2 PHE C 109 0.994 14.864 8.262 1.00 0.00 C ATOM 3526 CE1 PHE C 109 -0.724 16.268 9.969 1.00 0.00 C ATOM 3527 CE2 PHE C 109 -0.386 14.640 8.205 1.00 0.00 C ATOM 3528 CZ PHE C 109 -1.246 15.343 9.058 1.00 0.00 C ATOM 0 H PHE C 109 5.356 15.858 9.626 1.00 0.00 H new ATOM 0 HA PHE C 109 3.159 16.634 11.327 1.00 0.00 H new ATOM 0 HB2 PHE C 109 3.235 17.041 8.899 1.00 0.00 H new ATOM 0 HB3 PHE C 109 3.523 15.345 8.565 1.00 0.00 H new ATOM 0 HD1 PHE C 109 1.059 17.206 10.731 1.00 0.00 H new ATOM 0 HD2 PHE C 109 1.657 14.323 7.602 1.00 0.00 H new ATOM 0 HE1 PHE C 109 -1.387 16.810 10.627 1.00 0.00 H new ATOM 0 HE2 PHE C 109 -0.788 13.925 7.503 1.00 0.00 H new ATOM 0 HZ PHE C 109 -2.311 15.171 9.013 1.00 0.00 H new ATOM 3538 N LEU C 110 3.661 13.442 11.040 1.00 0.00 N ATOM 3539 CA LEU C 110 3.196 12.133 11.577 1.00 0.00 C ATOM 3540 C LEU C 110 3.741 11.926 12.993 1.00 0.00 C ATOM 3541 O LEU C 110 4.457 10.980 13.260 1.00 0.00 O ATOM 3542 CB LEU C 110 3.768 11.086 10.622 1.00 0.00 C ATOM 3543 CG LEU C 110 2.675 10.623 9.659 1.00 0.00 C ATOM 3544 CD1 LEU C 110 2.100 11.832 8.918 1.00 0.00 C ATOM 3545 CD2 LEU C 110 3.270 9.642 8.646 1.00 0.00 C ATOM 0 H LEU C 110 4.540 13.412 10.523 1.00 0.00 H new ATOM 0 HA LEU C 110 2.110 12.072 11.640 1.00 0.00 H new ATOM 0 HB2 LEU C 110 4.605 11.506 10.064 1.00 0.00 H new ATOM 0 HB3 LEU C 110 4.155 10.237 11.186 1.00 0.00 H new ATOM 0 HG LEU C 110 1.882 10.130 10.221 1.00 0.00 H new ATOM 0 HD11 LEU C 110 1.321 11.501 8.231 1.00 0.00 H new ATOM 0 HD12 LEU C 110 1.676 12.532 9.638 1.00 0.00 H new ATOM 0 HD13 LEU C 110 2.893 12.325 8.356 1.00 0.00 H new ATOM 0 HD21 LEU C 110 2.491 9.311 7.959 1.00 0.00 H new ATOM 0 HD22 LEU C 110 4.064 10.135 8.085 1.00 0.00 H new ATOM 0 HD23 LEU C 110 3.680 8.780 9.172 1.00 0.00 H new ATOM 3557 N ASP C 111 3.408 12.803 13.901 1.00 0.00 N ATOM 3558 CA ASP C 111 3.906 12.660 15.299 1.00 0.00 C ATOM 3559 C ASP C 111 5.370 12.214 15.300 1.00 0.00 C ATOM 3560 O ASP C 111 6.063 12.321 14.307 1.00 0.00 O ATOM 3561 CB ASP C 111 3.017 11.586 15.928 1.00 0.00 C ATOM 3562 CG ASP C 111 2.268 12.177 17.123 1.00 0.00 C ATOM 3563 OD1 ASP C 111 1.234 12.786 16.907 1.00 0.00 O ATOM 3564 OD2 ASP C 111 2.743 12.010 18.235 1.00 0.00 O ATOM 0 H ASP C 111 2.812 13.614 13.735 1.00 0.00 H new ATOM 0 HA ASP C 111 3.863 13.600 15.849 1.00 0.00 H new ATOM 0 HB2 ASP C 111 2.308 11.209 15.191 1.00 0.00 H new ATOM 0 HB3 ASP C 111 3.624 10.739 16.249 1.00 0.00 H new ATOM 3569 N CYS C 112 5.847 11.714 16.407 1.00 0.00 N ATOM 3570 CA CYS C 112 7.267 11.261 16.471 1.00 0.00 C ATOM 3571 C CYS C 112 7.378 9.981 17.304 1.00 0.00 C ATOM 3572 O CYS C 112 8.493 9.558 17.560 1.00 0.00 O ATOM 3573 CB CYS C 112 8.018 12.408 17.148 1.00 0.00 C ATOM 3574 SG CYS C 112 9.793 12.050 17.147 1.00 0.00 S ATOM 3575 OXT CYS C 112 6.345 9.446 17.671 1.00 0.00 O ATOM 0 H CYS C 112 5.316 11.599 17.270 1.00 0.00 H new ATOM 0 HA CYS C 112 7.672 11.033 15.485 1.00 0.00 H new ATOM 0 HB2 CYS C 112 7.824 13.344 16.623 1.00 0.00 H new ATOM 0 HB3 CYS C 112 7.663 12.536 18.170 1.00 0.00 H new ATOM 0 HG CYS C 112 9.980 10.780 17.355 1.00 0.00 H new