USER MOD reduce.3.24.130724 H: found=0, std=0, add=716, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 717 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 45 LYS NZ :NH3+ 161:sc= 2.59 (180deg=0.969) USER MOD Set 1.2: A 59 MET CE :methyl -142:sc= -0.55 (180deg=-2.1!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -128:sc= 2.27 (180deg=-2.24) USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= 1.71 (180deg=1.63) USER MOD Single : A 29 GLN : amide:sc= -0.284 X(o=-0.28,f=-0.0051) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -77:sc= 1.35 USER MOD Single : A 35 HIS : no HD1:sc= -0.402 K(o=-0.4,f=-4.7!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 144:sc= 0 (180deg=-1.48!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.346 X(o=-0.35,f=-0.51) USER MOD Single : A 46 LYS NZ :NH3+ 162:sc= 1.24 (180deg=1.11) USER MOD Single : A 48 LYS NZ :NH3+ -159:sc= 0.95! (180deg=0.268) USER MOD Single : A 50 SER OG : rot 91:sc= 1.32 USER MOD Single : A 51 TYR OH : rot 30:sc= -0.0495 USER MOD Single : A 52 CYS SG : rot 68:sc= 0.822 USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 55 GLN : amide:sc= -0.0708 K(o=-0.071,f=-0.91) USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 97:sc= 0.994 USER MOD Single : A 69 GLN : amide:sc= -0.0981 K(o=-0.098,f=-1.8) USER MOD Single : A 74 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.59) USER MOD Single : A 75 HIS : no HD1:sc= 0.314 K(o=0.31,f=-2.8!) USER MOD Single : A 76 THR OG1 : rot 64:sc= 1.1 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 172:sc= 1.18 USER MOD Single : A 92 GLN : amide:sc= 0.767 K(o=0.77,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : B 357 ASN : amide:sc= -0.4 K(o=-0.4,f=1) USER MOD Single : B 358 ASN : amide:sc= -2.46! C(o=-2.5!,f=-5.7!) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 14.519 -5.233 -1.804 1.00 10.00 N ATOM 2 CA TYR A 21 13.090 -4.867 -1.916 1.00 10.00 C ATOM 3 C TYR A 21 12.362 -5.167 -0.613 1.00 10.00 C ATOM 4 O TYR A 21 12.683 -6.135 0.074 1.00 10.00 O ATOM 5 CB TYR A 21 12.427 -5.648 -3.054 1.00 10.00 C ATOM 6 CG TYR A 21 12.777 -5.155 -4.442 1.00 10.00 C ATOM 7 CD1 TYR A 21 12.083 -4.096 -5.019 1.00 10.00 C ATOM 8 CD2 TYR A 21 13.784 -5.758 -5.184 1.00 10.00 C ATOM 9 CE1 TYR A 21 12.390 -3.652 -6.291 1.00 10.00 C ATOM 10 CE2 TYR A 21 14.099 -5.318 -6.454 1.00 10.00 C ATOM 11 CZ TYR A 21 13.398 -4.267 -7.003 1.00 10.00 C ATOM 12 OH TYR A 21 13.711 -3.828 -8.270 1.00 10.00 O ATOM 0 HA TYR A 21 13.029 -3.799 -2.127 1.00 10.00 H new ATOM 0 HB2 TYR A 21 12.712 -6.697 -2.972 1.00 10.00 H new ATOM 0 HB3 TYR A 21 11.345 -5.601 -2.928 1.00 10.00 H new ATOM 0 HD1 TYR A 21 11.292 -3.614 -4.464 1.00 10.00 H new ATOM 0 HD2 TYR A 21 14.331 -6.587 -4.760 1.00 10.00 H new ATOM 0 HE1 TYR A 21 11.843 -2.828 -6.725 1.00 10.00 H new ATOM 0 HE2 TYR A 21 14.890 -5.795 -7.014 1.00 10.00 H new ATOM 0 HH TYR A 21 14.445 -4.368 -8.631 1.00 10.00 H new ATOM 22 N ILE A 22 11.386 -4.337 -0.280 1.00 10.00 N ATOM 23 CA ILE A 22 10.602 -4.524 0.932 1.00 10.00 C ATOM 24 C ILE A 22 9.224 -5.050 0.561 1.00 10.00 C ATOM 25 O ILE A 22 8.546 -4.479 -0.296 1.00 10.00 O ATOM 26 CB ILE A 22 10.463 -3.210 1.736 1.00 10.00 C ATOM 27 CG1 ILE A 22 11.845 -2.651 2.095 1.00 10.00 C ATOM 28 CG2 ILE A 22 9.630 -3.432 2.994 1.00 10.00 C ATOM 29 CD1 ILE A 22 12.657 -3.547 3.007 1.00 10.00 C ATOM 0 H ILE A 22 11.117 -3.524 -0.834 1.00 10.00 H new ATOM 0 HA ILE A 22 11.122 -5.243 1.565 1.00 10.00 H new ATOM 0 HB ILE A 22 9.948 -2.480 1.112 1.00 10.00 H new ATOM 0 HG12 ILE A 22 12.406 -2.482 1.176 1.00 10.00 H new ATOM 0 HG13 ILE A 22 11.719 -1.681 2.575 1.00 10.00 H new ATOM 0 HG21 ILE A 22 9.545 -2.495 3.544 1.00 10.00 H new ATOM 0 HG22 ILE A 22 8.636 -3.780 2.715 1.00 10.00 H new ATOM 0 HG23 ILE A 22 10.113 -4.180 3.623 1.00 10.00 H new ATOM 0 HD11 ILE A 22 13.620 -3.080 3.213 1.00 10.00 H new ATOM 0 HD12 ILE A 22 12.119 -3.697 3.943 1.00 10.00 H new ATOM 0 HD13 ILE A 22 12.817 -4.510 2.522 1.00 10.00 H new ATOM 41 N LYS A 23 8.819 -6.143 1.183 1.00 10.00 N ATOM 42 CA LYS A 23 7.530 -6.748 0.883 1.00 10.00 C ATOM 43 C LYS A 23 6.469 -6.367 1.908 1.00 10.00 C ATOM 44 O LYS A 23 6.516 -6.797 3.064 1.00 10.00 O ATOM 45 CB LYS A 23 7.666 -8.265 0.815 1.00 10.00 C ATOM 46 CG LYS A 23 8.213 -8.768 -0.511 1.00 10.00 C ATOM 47 CD LYS A 23 8.898 -10.120 -0.369 1.00 10.00 C ATOM 48 CE LYS A 23 8.042 -11.115 0.400 1.00 10.00 C ATOM 49 NZ LYS A 23 8.442 -11.204 1.828 1.00 10.00 N ATOM 0 H LYS A 23 9.361 -6.630 1.897 1.00 10.00 H new ATOM 0 HA LYS A 23 7.207 -6.366 -0.085 1.00 10.00 H new ATOM 0 HB2 LYS A 23 8.322 -8.599 1.619 1.00 10.00 H new ATOM 0 HB3 LYS A 23 6.690 -8.717 0.991 1.00 10.00 H new ATOM 0 HG2 LYS A 23 7.399 -8.848 -1.232 1.00 10.00 H new ATOM 0 HG3 LYS A 23 8.922 -8.042 -0.909 1.00 10.00 H new ATOM 0 HD2 LYS A 23 9.118 -10.520 -1.359 1.00 10.00 H new ATOM 0 HD3 LYS A 23 9.852 -9.991 0.142 1.00 10.00 H new ATOM 0 HE2 LYS A 23 6.995 -10.820 0.334 1.00 10.00 H new ATOM 0 HE3 LYS A 23 8.125 -12.099 -0.062 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 8.602 -12.200 2.082 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 9.318 -10.663 1.978 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 7.686 -10.812 2.425 1.00 10.00 H new ATOM 63 N LEU A 24 5.519 -5.554 1.475 1.00 10.00 N ATOM 64 CA LEU A 24 4.420 -5.133 2.329 1.00 10.00 C ATOM 65 C LEU A 24 3.183 -5.951 1.983 1.00 10.00 C ATOM 66 O LEU A 24 2.861 -6.123 0.807 1.00 10.00 O ATOM 67 CB LEU A 24 4.138 -3.638 2.152 1.00 10.00 C ATOM 68 CG LEU A 24 5.257 -2.702 2.614 1.00 10.00 C ATOM 69 CD1 LEU A 24 4.924 -1.263 2.262 1.00 10.00 C ATOM 70 CD2 LEU A 24 5.487 -2.839 4.110 1.00 10.00 C ATOM 0 H LEU A 24 5.487 -5.170 0.530 1.00 10.00 H new ATOM 0 HA LEU A 24 4.690 -5.300 3.372 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.938 -3.445 1.098 1.00 10.00 H new ATOM 0 HB3 LEU A 24 3.229 -3.389 2.700 1.00 10.00 H new ATOM 0 HG LEU A 24 6.174 -2.984 2.097 1.00 10.00 H new ATOM 0 HD11 LEU A 24 5.730 -0.610 2.598 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.808 -1.170 1.182 1.00 10.00 H new ATOM 0 HD13 LEU A 24 3.995 -0.974 2.753 1.00 10.00 H new ATOM 0 HD21 LEU A 24 6.286 -2.165 4.418 1.00 10.00 H new ATOM 0 HD22 LEU A 24 4.571 -2.584 4.644 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.768 -3.866 4.342 1.00 10.00 H new ATOM 82 N LYS A 25 2.499 -6.457 2.995 1.00 10.00 N ATOM 83 CA LYS A 25 1.318 -7.277 2.771 1.00 10.00 C ATOM 84 C LYS A 25 0.041 -6.477 2.967 1.00 10.00 C ATOM 85 O LYS A 25 -0.276 -6.043 4.077 1.00 10.00 O ATOM 86 CB LYS A 25 1.327 -8.484 3.703 1.00 10.00 C ATOM 87 CG LYS A 25 2.652 -9.224 3.711 1.00 10.00 C ATOM 88 CD LYS A 25 2.679 -10.308 4.769 1.00 10.00 C ATOM 89 CE LYS A 25 1.991 -11.576 4.298 1.00 10.00 C ATOM 90 NZ LYS A 25 2.499 -12.773 5.019 1.00 10.00 N ATOM 0 H LYS A 25 2.739 -6.316 3.976 1.00 10.00 H new ATOM 0 HA LYS A 25 1.344 -7.622 1.737 1.00 10.00 H new ATOM 0 HB2 LYS A 25 1.096 -8.154 4.716 1.00 10.00 H new ATOM 0 HB3 LYS A 25 0.536 -9.172 3.404 1.00 10.00 H new ATOM 0 HG2 LYS A 25 2.828 -9.667 2.731 1.00 10.00 H new ATOM 0 HG3 LYS A 25 3.463 -8.518 3.892 1.00 10.00 H new ATOM 0 HD2 LYS A 25 3.713 -10.532 5.033 1.00 10.00 H new ATOM 0 HD3 LYS A 25 2.191 -9.945 5.673 1.00 10.00 H new ATOM 0 HE2 LYS A 25 0.916 -11.486 4.452 1.00 10.00 H new ATOM 0 HE3 LYS A 25 2.150 -11.701 3.227 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 1.887 -13.588 4.813 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 3.469 -12.981 4.707 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 2.497 -12.589 6.043 1.00 10.00 H new ATOM 104 N VAL A 26 -0.685 -6.283 1.879 1.00 10.00 N ATOM 105 CA VAL A 26 -1.938 -5.550 1.915 1.00 10.00 C ATOM 106 C VAL A 26 -3.101 -6.528 2.017 1.00 10.00 C ATOM 107 O VAL A 26 -3.289 -7.372 1.138 1.00 10.00 O ATOM 108 CB VAL A 26 -2.129 -4.665 0.663 1.00 10.00 C ATOM 109 CG1 VAL A 26 -3.222 -3.632 0.898 1.00 10.00 C ATOM 110 CG2 VAL A 26 -0.824 -3.988 0.266 1.00 10.00 C ATOM 0 H VAL A 26 -0.425 -6.626 0.954 1.00 10.00 H new ATOM 0 HA VAL A 26 -1.910 -4.898 2.788 1.00 10.00 H new ATOM 0 HB VAL A 26 -2.436 -5.309 -0.161 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -3.341 -3.019 0.005 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -4.161 -4.140 1.118 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -2.947 -2.997 1.740 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -0.988 -3.372 -0.618 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.475 -3.361 1.086 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -0.073 -4.747 0.045 1.00 10.00 H new ATOM 120 N ILE A 27 -3.860 -6.430 3.097 1.00 10.00 N ATOM 121 CA ILE A 27 -5.000 -7.310 3.301 1.00 10.00 C ATOM 122 C ILE A 27 -6.248 -6.712 2.664 1.00 10.00 C ATOM 123 O ILE A 27 -6.807 -5.732 3.164 1.00 10.00 O ATOM 124 CB ILE A 27 -5.258 -7.575 4.800 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.005 -8.159 5.463 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.445 -8.515 4.986 1.00 10.00 C ATOM 127 CD1 ILE A 27 -3.579 -9.502 4.903 1.00 10.00 C ATOM 0 H ILE A 27 -3.708 -5.752 3.844 1.00 10.00 H new ATOM 0 HA ILE A 27 -4.766 -8.262 2.825 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.495 -6.625 5.279 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -3.183 -7.452 5.349 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -4.188 -8.265 6.532 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.609 -8.688 6.050 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -7.337 -8.065 4.550 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.238 -9.464 4.492 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -2.686 -9.847 5.424 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -4.382 -10.225 5.042 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -3.362 -9.400 3.840 1.00 10.00 H new ATOM 139 N GLY A 28 -6.665 -7.297 1.548 1.00 10.00 N ATOM 140 CA GLY A 28 -7.839 -6.818 0.846 1.00 10.00 C ATOM 141 C GLY A 28 -9.127 -7.165 1.564 1.00 10.00 C ATOM 142 O GLY A 28 -9.111 -7.828 2.605 1.00 10.00 O ATOM 0 H GLY A 28 -6.208 -8.099 1.115 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -7.772 -5.736 0.729 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -7.859 -7.246 -0.156 1.00 10.00 H new ATOM 146 N GLN A 29 -10.247 -6.732 1.002 1.00 10.00 N ATOM 147 CA GLN A 29 -11.558 -6.991 1.592 1.00 10.00 C ATOM 148 C GLN A 29 -11.881 -8.485 1.595 1.00 10.00 C ATOM 149 O GLN A 29 -12.605 -8.972 2.464 1.00 10.00 O ATOM 150 CB GLN A 29 -12.640 -6.225 0.833 1.00 10.00 C ATOM 151 CG GLN A 29 -13.982 -6.184 1.545 1.00 10.00 C ATOM 152 CD GLN A 29 -14.009 -5.190 2.688 1.00 10.00 C ATOM 153 OE1 GLN A 29 -14.287 -4.007 2.489 1.00 10.00 O ATOM 154 NE2 GLN A 29 -13.735 -5.664 3.891 1.00 10.00 N ATOM 0 H GLN A 29 -10.276 -6.197 0.134 1.00 10.00 H new ATOM 0 HA GLN A 29 -11.533 -6.647 2.626 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -12.298 -5.204 0.665 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -12.774 -6.682 -0.148 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -14.761 -5.927 0.827 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -14.216 -7.177 1.928 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -13.510 -6.652 4.011 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -13.749 -5.042 4.699 1.00 10.00 H new ATOM 163 N ASP A 30 -11.332 -9.211 0.628 1.00 10.00 N ATOM 164 CA ASP A 30 -11.563 -10.648 0.523 1.00 10.00 C ATOM 165 C ASP A 30 -10.502 -11.423 1.299 1.00 10.00 C ATOM 166 O ASP A 30 -10.403 -12.642 1.181 1.00 10.00 O ATOM 167 CB ASP A 30 -11.574 -11.088 -0.947 1.00 10.00 C ATOM 168 CG ASP A 30 -10.186 -11.154 -1.555 1.00 10.00 C ATOM 169 OD1 ASP A 30 -9.439 -10.159 -1.444 1.00 10.00 O ATOM 170 OD2 ASP A 30 -9.844 -12.201 -2.150 1.00 10.00 O ATOM 0 H ASP A 30 -10.723 -8.828 -0.095 1.00 10.00 H new ATOM 0 HA ASP A 30 -12.538 -10.867 0.958 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -12.046 -12.068 -1.024 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -12.185 -10.394 -1.524 1.00 10.00 H new ATOM 175 N SER A 31 -9.720 -10.698 2.102 1.00 10.00 N ATOM 176 CA SER A 31 -8.658 -11.288 2.919 1.00 10.00 C ATOM 177 C SER A 31 -7.578 -11.939 2.052 1.00 10.00 C ATOM 178 O SER A 31 -7.255 -13.119 2.217 1.00 10.00 O ATOM 179 CB SER A 31 -9.246 -12.306 3.899 1.00 10.00 C ATOM 180 OG SER A 31 -10.294 -11.728 4.663 1.00 10.00 O ATOM 0 H SER A 31 -9.805 -9.687 2.204 1.00 10.00 H new ATOM 0 HA SER A 31 -8.186 -10.485 3.485 1.00 10.00 H new ATOM 0 HB2 SER A 31 -9.624 -13.169 3.350 1.00 10.00 H new ATOM 0 HB3 SER A 31 -8.463 -12.670 4.565 1.00 10.00 H new ATOM 0 HG SER A 31 -10.656 -12.397 5.281 1.00 10.00 H new ATOM 186 N SER A 32 -7.029 -11.160 1.132 1.00 10.00 N ATOM 187 CA SER A 32 -5.982 -11.638 0.242 1.00 10.00 C ATOM 188 C SER A 32 -4.600 -11.224 0.747 1.00 10.00 C ATOM 189 O SER A 32 -4.479 -10.298 1.552 1.00 10.00 O ATOM 190 CB SER A 32 -6.222 -11.078 -1.157 1.00 10.00 C ATOM 191 OG SER A 32 -6.895 -9.831 -1.088 1.00 10.00 O ATOM 0 H SER A 32 -7.294 -10.187 0.982 1.00 10.00 H new ATOM 0 HA SER A 32 -6.013 -12.727 0.214 1.00 10.00 H new ATOM 0 HB2 SER A 32 -5.270 -10.955 -1.673 1.00 10.00 H new ATOM 0 HB3 SER A 32 -6.813 -11.784 -1.741 1.00 10.00 H new ATOM 0 HG SER A 32 -7.846 -9.982 -0.905 1.00 10.00 H new ATOM 197 N GLU A 33 -3.561 -11.911 0.281 1.00 10.00 N ATOM 198 CA GLU A 33 -2.198 -11.604 0.681 1.00 10.00 C ATOM 199 C GLU A 33 -1.482 -10.863 -0.441 1.00 10.00 C ATOM 200 O GLU A 33 -0.627 -11.427 -1.130 1.00 10.00 O ATOM 201 CB GLU A 33 -1.424 -12.878 1.031 1.00 10.00 C ATOM 202 CG GLU A 33 -1.549 -13.311 2.485 1.00 10.00 C ATOM 203 CD GLU A 33 -0.563 -14.405 2.852 1.00 10.00 C ATOM 204 OE1 GLU A 33 0.281 -14.185 3.746 1.00 10.00 O ATOM 205 OE2 GLU A 33 -0.621 -15.494 2.238 1.00 10.00 O ATOM 0 H GLU A 33 -3.641 -12.687 -0.377 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.241 -10.973 1.569 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -1.775 -13.688 0.392 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -0.370 -12.723 0.800 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -1.388 -12.449 3.133 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -2.564 -13.664 2.670 1.00 10.00 H new ATOM 212 N ILE A 34 -1.840 -9.606 -0.634 1.00 10.00 N ATOM 213 CA ILE A 34 -1.232 -8.801 -1.680 1.00 10.00 C ATOM 214 C ILE A 34 0.176 -8.387 -1.269 1.00 10.00 C ATOM 215 O ILE A 34 0.354 -7.568 -0.370 1.00 10.00 O ATOM 216 CB ILE A 34 -2.071 -7.543 -1.992 1.00 10.00 C ATOM 217 CG1 ILE A 34 -3.537 -7.919 -2.247 1.00 10.00 C ATOM 218 CG2 ILE A 34 -1.490 -6.801 -3.188 1.00 10.00 C ATOM 219 CD1 ILE A 34 -3.734 -8.867 -3.413 1.00 10.00 C ATOM 0 H ILE A 34 -2.547 -9.121 -0.082 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.189 -9.411 -2.582 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.036 -6.882 -1.126 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -3.946 -8.376 -1.346 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -4.109 -7.009 -2.431 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -2.093 -5.917 -3.395 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.466 -6.499 -2.967 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.495 -7.456 -4.060 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -4.796 -9.085 -3.529 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -3.356 -8.405 -4.325 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -3.192 -9.794 -3.224 1.00 10.00 H new ATOM 231 N HIS A 35 1.171 -8.972 -1.922 1.00 10.00 N ATOM 232 CA HIS A 35 2.563 -8.678 -1.617 1.00 10.00 C ATOM 233 C HIS A 35 3.086 -7.546 -2.487 1.00 10.00 C ATOM 234 O HIS A 35 3.471 -7.759 -3.637 1.00 10.00 O ATOM 235 CB HIS A 35 3.430 -9.927 -1.818 1.00 10.00 C ATOM 236 CG HIS A 35 3.785 -10.628 -0.544 1.00 10.00 C ATOM 237 ND1 HIS A 35 3.654 -11.989 -0.416 1.00 10.00 N ATOM 238 CD2 HIS A 35 4.270 -10.120 0.615 1.00 10.00 C ATOM 239 CE1 HIS A 35 4.056 -12.279 0.807 1.00 10.00 C ATOM 240 NE2 HIS A 35 4.441 -11.179 1.470 1.00 10.00 N ATOM 0 H HIS A 35 1.039 -9.655 -2.668 1.00 10.00 H new ATOM 0 HA HIS A 35 2.617 -8.367 -0.574 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.902 -10.623 -2.470 1.00 10.00 H new ATOM 0 HB3 HIS A 35 4.348 -9.642 -2.333 1.00 10.00 H new ATOM 0 HD2 HIS A 35 4.481 -9.082 0.825 1.00 10.00 H new ATOM 0 HE1 HIS A 35 4.073 -13.276 1.221 1.00 10.00 H new ATOM 0 HE2 HIS A 35 4.793 -11.138 2.426 1.00 10.00 H new ATOM 248 N PHE A 36 3.097 -6.342 -1.949 1.00 10.00 N ATOM 249 CA PHE A 36 3.587 -5.202 -2.694 1.00 10.00 C ATOM 250 C PHE A 36 5.093 -5.086 -2.525 1.00 10.00 C ATOM 251 O PHE A 36 5.589 -4.837 -1.424 1.00 10.00 O ATOM 252 CB PHE A 36 2.900 -3.911 -2.245 1.00 10.00 C ATOM 253 CG PHE A 36 2.652 -2.948 -3.375 1.00 10.00 C ATOM 254 CD1 PHE A 36 3.690 -2.545 -4.203 1.00 10.00 C ATOM 255 CD2 PHE A 36 1.380 -2.453 -3.614 1.00 10.00 C ATOM 256 CE1 PHE A 36 3.461 -1.665 -5.245 1.00 10.00 C ATOM 257 CE2 PHE A 36 1.147 -1.572 -4.653 1.00 10.00 C ATOM 258 CZ PHE A 36 2.188 -1.180 -5.470 1.00 10.00 C ATOM 0 H PHE A 36 2.774 -6.130 -1.005 1.00 10.00 H new ATOM 0 HA PHE A 36 3.354 -5.354 -3.748 1.00 10.00 H new ATOM 0 HB2 PHE A 36 1.950 -4.158 -1.772 1.00 10.00 H new ATOM 0 HB3 PHE A 36 3.515 -3.423 -1.489 1.00 10.00 H new ATOM 0 HD1 PHE A 36 4.687 -2.923 -4.032 1.00 10.00 H new ATOM 0 HD2 PHE A 36 0.561 -2.759 -2.981 1.00 10.00 H new ATOM 0 HE1 PHE A 36 4.277 -1.357 -5.882 1.00 10.00 H new ATOM 0 HE2 PHE A 36 0.151 -1.191 -4.825 1.00 10.00 H new ATOM 0 HZ PHE A 36 2.007 -0.494 -6.285 1.00 10.00 H new ATOM 268 N LYS A 37 5.816 -5.292 -3.613 1.00 10.00 N ATOM 269 CA LYS A 37 7.263 -5.214 -3.588 1.00 10.00 C ATOM 270 C LYS A 37 7.695 -3.765 -3.779 1.00 10.00 C ATOM 271 O LYS A 37 7.848 -3.288 -4.905 1.00 10.00 O ATOM 272 CB LYS A 37 7.863 -6.116 -4.671 1.00 10.00 C ATOM 273 CG LYS A 37 9.336 -6.419 -4.468 1.00 10.00 C ATOM 274 CD LYS A 37 9.844 -7.445 -5.470 1.00 10.00 C ATOM 275 CE LYS A 37 9.404 -8.857 -5.106 1.00 10.00 C ATOM 276 NZ LYS A 37 10.099 -9.882 -5.926 1.00 10.00 N ATOM 0 H LYS A 37 5.421 -5.515 -4.527 1.00 10.00 H new ATOM 0 HA LYS A 37 7.630 -5.564 -2.623 1.00 10.00 H new ATOM 0 HB2 LYS A 37 7.309 -7.054 -4.698 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.730 -5.640 -5.642 1.00 10.00 H new ATOM 0 HG2 LYS A 37 9.913 -5.499 -4.565 1.00 10.00 H new ATOM 0 HG3 LYS A 37 9.495 -6.790 -3.455 1.00 10.00 H new ATOM 0 HD2 LYS A 37 9.476 -7.195 -6.465 1.00 10.00 H new ATOM 0 HD3 LYS A 37 10.932 -7.403 -5.513 1.00 10.00 H new ATOM 0 HE2 LYS A 37 9.605 -9.039 -4.050 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.327 -8.949 -5.246 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 9.772 -10.829 -5.648 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 9.887 -9.724 -6.932 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 11.125 -9.811 -5.773 1.00 10.00 H new ATOM 290 N VAL A 38 7.875 -3.064 -2.672 1.00 10.00 N ATOM 291 CA VAL A 38 8.254 -1.663 -2.714 1.00 10.00 C ATOM 292 C VAL A 38 9.762 -1.479 -2.569 1.00 10.00 C ATOM 293 O VAL A 38 10.485 -2.396 -2.163 1.00 10.00 O ATOM 294 CB VAL A 38 7.528 -0.850 -1.615 1.00 10.00 C ATOM 295 CG1 VAL A 38 6.031 -1.109 -1.660 1.00 10.00 C ATOM 296 CG2 VAL A 38 8.086 -1.172 -0.234 1.00 10.00 C ATOM 0 H VAL A 38 7.764 -3.444 -1.732 1.00 10.00 H new ATOM 0 HA VAL A 38 7.951 -1.289 -3.692 1.00 10.00 H new ATOM 0 HB VAL A 38 7.703 0.208 -1.809 1.00 10.00 H new ATOM 0 HG11 VAL A 38 5.538 -0.529 -0.880 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.640 -0.814 -2.634 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.840 -2.170 -1.498 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.557 -0.586 0.518 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.953 -2.234 -0.026 1.00 10.00 H new ATOM 0 HG23 VAL A 38 9.148 -0.927 -0.204 1.00 10.00 H new ATOM 306 N LYS A 39 10.222 -0.287 -2.910 1.00 10.00 N ATOM 307 CA LYS A 39 11.628 0.055 -2.820 1.00 10.00 C ATOM 308 C LYS A 39 11.834 1.022 -1.662 1.00 10.00 C ATOM 309 O LYS A 39 11.151 2.044 -1.571 1.00 10.00 O ATOM 310 CB LYS A 39 12.098 0.685 -4.130 1.00 10.00 C ATOM 311 CG LYS A 39 13.606 0.810 -4.249 1.00 10.00 C ATOM 312 CD LYS A 39 13.992 1.461 -5.566 1.00 10.00 C ATOM 313 CE LYS A 39 15.496 1.591 -5.707 1.00 10.00 C ATOM 314 NZ LYS A 39 15.888 2.008 -7.079 1.00 10.00 N ATOM 0 H LYS A 39 9.631 0.469 -3.256 1.00 10.00 H new ATOM 0 HA LYS A 39 12.214 -0.847 -2.643 1.00 10.00 H new ATOM 0 HB2 LYS A 39 11.726 0.087 -4.962 1.00 10.00 H new ATOM 0 HB3 LYS A 39 11.653 1.675 -4.225 1.00 10.00 H new ATOM 0 HG2 LYS A 39 13.993 1.401 -3.419 1.00 10.00 H new ATOM 0 HG3 LYS A 39 14.064 -0.177 -4.178 1.00 10.00 H new ATOM 0 HD2 LYS A 39 13.599 0.870 -6.393 1.00 10.00 H new ATOM 0 HD3 LYS A 39 13.533 2.448 -5.633 1.00 10.00 H new ATOM 0 HE2 LYS A 39 15.867 2.319 -4.986 1.00 10.00 H new ATOM 0 HE3 LYS A 39 15.967 0.638 -5.468 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 16.924 2.086 -7.136 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 15.556 1.300 -7.765 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 15.459 2.930 -7.298 1.00 10.00 H new ATOM 328 N MET A 40 12.771 0.698 -0.781 1.00 10.00 N ATOM 329 CA MET A 40 13.042 1.539 0.378 1.00 10.00 C ATOM 330 C MET A 40 13.826 2.790 -0.015 1.00 10.00 C ATOM 331 O MET A 40 15.056 2.822 0.056 1.00 10.00 O ATOM 332 CB MET A 40 13.787 0.752 1.461 1.00 10.00 C ATOM 333 CG MET A 40 14.067 1.564 2.720 1.00 10.00 C ATOM 334 SD MET A 40 12.578 2.250 3.476 1.00 10.00 S ATOM 335 CE MET A 40 11.848 0.778 4.190 1.00 10.00 C ATOM 0 H MET A 40 13.354 -0.137 -0.846 1.00 10.00 H new ATOM 0 HA MET A 40 12.083 1.859 0.785 1.00 10.00 H new ATOM 0 HB2 MET A 40 13.200 -0.127 1.728 1.00 10.00 H new ATOM 0 HB3 MET A 40 14.732 0.393 1.053 1.00 10.00 H new ATOM 0 HG2 MET A 40 14.576 0.930 3.447 1.00 10.00 H new ATOM 0 HG3 MET A 40 14.749 2.378 2.474 1.00 10.00 H new ATOM 0 HE1 MET A 40 11.372 1.031 5.137 1.00 10.00 H new ATOM 0 HE2 MET A 40 11.102 0.373 3.506 1.00 10.00 H new ATOM 0 HE3 MET A 40 12.625 0.033 4.362 1.00 10.00 H new ATOM 345 N THR A 41 13.086 3.803 -0.458 1.00 10.00 N ATOM 346 CA THR A 41 13.649 5.087 -0.867 1.00 10.00 C ATOM 347 C THR A 41 12.575 5.928 -1.552 1.00 10.00 C ATOM 348 O THR A 41 12.584 7.156 -1.466 1.00 10.00 O ATOM 349 CB THR A 41 14.867 4.929 -1.817 1.00 10.00 C ATOM 350 OG1 THR A 41 15.500 6.199 -2.028 1.00 10.00 O ATOM 351 CG2 THR A 41 14.463 4.336 -3.159 1.00 10.00 C ATOM 0 H THR A 41 12.071 3.756 -0.544 1.00 10.00 H new ATOM 0 HA THR A 41 14.002 5.585 0.036 1.00 10.00 H new ATOM 0 HB THR A 41 15.566 4.243 -1.338 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.267 6.087 -2.627 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.343 4.242 -3.795 1.00 10.00 H new ATOM 0 HG22 THR A 41 14.020 3.352 -3.004 1.00 10.00 H new ATOM 0 HG23 THR A 41 13.736 4.989 -3.641 1.00 10.00 H new ATOM 359 N THR A 42 11.649 5.255 -2.217 1.00 10.00 N ATOM 360 CA THR A 42 10.570 5.924 -2.917 1.00 10.00 C ATOM 361 C THR A 42 9.426 6.238 -1.961 1.00 10.00 C ATOM 362 O THR A 42 9.152 5.471 -1.034 1.00 10.00 O ATOM 363 CB THR A 42 10.060 5.047 -4.076 1.00 10.00 C ATOM 364 OG1 THR A 42 11.160 4.325 -4.651 1.00 10.00 O ATOM 365 CG2 THR A 42 9.388 5.893 -5.148 1.00 10.00 C ATOM 0 H THR A 42 11.626 4.238 -2.285 1.00 10.00 H new ATOM 0 HA THR A 42 10.953 6.860 -3.323 1.00 10.00 H new ATOM 0 HB THR A 42 9.323 4.348 -3.680 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.835 3.766 -5.387 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.038 5.248 -5.954 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.541 6.424 -4.714 1.00 10.00 H new ATOM 0 HG23 THR A 42 10.104 6.613 -5.545 1.00 10.00 H new ATOM 373 N HIS A 43 8.776 7.374 -2.175 1.00 10.00 N ATOM 374 CA HIS A 43 7.661 7.786 -1.337 1.00 10.00 C ATOM 375 C HIS A 43 6.466 6.864 -1.541 1.00 10.00 C ATOM 376 O HIS A 43 6.234 6.368 -2.647 1.00 10.00 O ATOM 377 CB HIS A 43 7.266 9.230 -1.654 1.00 10.00 C ATOM 378 CG HIS A 43 7.473 10.164 -0.505 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.434 11.144 -0.539 1.00 10.00 N ATOM 380 CD2 HIS A 43 6.826 10.219 0.680 1.00 10.00 C ATOM 381 CE1 HIS A 43 8.352 11.768 0.622 1.00 10.00 C ATOM 382 NE2 HIS A 43 7.391 11.241 1.394 1.00 10.00 N ATOM 0 H HIS A 43 9.004 8.027 -2.924 1.00 10.00 H new ATOM 0 HA HIS A 43 7.975 7.724 -0.295 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.847 9.580 -2.507 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.217 9.256 -1.950 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.018 9.579 1.002 1.00 10.00 H new ATOM 0 HE1 HIS A 43 8.979 12.598 0.913 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.131 11.543 2.333 1.00 10.00 H new ATOM 390 N LEU A 44 5.699 6.649 -0.474 1.00 10.00 N ATOM 391 CA LEU A 44 4.525 5.786 -0.537 1.00 10.00 C ATOM 392 C LEU A 44 3.496 6.339 -1.513 1.00 10.00 C ATOM 393 O LEU A 44 2.603 5.621 -1.950 1.00 10.00 O ATOM 394 CB LEU A 44 3.902 5.616 0.849 1.00 10.00 C ATOM 395 CG LEU A 44 4.611 4.608 1.758 1.00 10.00 C ATOM 396 CD1 LEU A 44 4.063 4.683 3.174 1.00 10.00 C ATOM 397 CD2 LEU A 44 4.470 3.197 1.208 1.00 10.00 C ATOM 0 H LEU A 44 5.871 7.061 0.443 1.00 10.00 H new ATOM 0 HA LEU A 44 4.848 4.808 -0.894 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.890 6.586 1.347 1.00 10.00 H new ATOM 0 HB3 LEU A 44 2.864 5.307 0.729 1.00 10.00 H new ATOM 0 HG LEU A 44 5.671 4.863 1.785 1.00 10.00 H new ATOM 0 HD11 LEU A 44 4.580 3.959 3.803 1.00 10.00 H new ATOM 0 HD12 LEU A 44 4.219 5.686 3.572 1.00 10.00 H new ATOM 0 HD13 LEU A 44 2.996 4.458 3.164 1.00 10.00 H new ATOM 0 HD21 LEU A 44 4.981 2.496 1.869 1.00 10.00 H new ATOM 0 HD22 LEU A 44 3.414 2.934 1.147 1.00 10.00 H new ATOM 0 HD23 LEU A 44 4.914 3.148 0.214 1.00 10.00 H new ATOM 409 N LYS A 45 3.640 7.617 -1.849 1.00 10.00 N ATOM 410 CA LYS A 45 2.751 8.284 -2.790 1.00 10.00 C ATOM 411 C LYS A 45 2.638 7.487 -4.086 1.00 10.00 C ATOM 412 O LYS A 45 1.536 7.172 -4.542 1.00 10.00 O ATOM 413 CB LYS A 45 3.284 9.689 -3.092 1.00 10.00 C ATOM 414 CG LYS A 45 2.638 10.356 -4.298 1.00 10.00 C ATOM 415 CD LYS A 45 1.186 10.712 -4.032 1.00 10.00 C ATOM 416 CE LYS A 45 0.515 11.291 -5.269 1.00 10.00 C ATOM 417 NZ LYS A 45 -0.905 11.649 -5.005 1.00 10.00 N ATOM 0 H LYS A 45 4.376 8.217 -1.476 1.00 10.00 H new ATOM 0 HA LYS A 45 1.760 8.355 -2.341 1.00 10.00 H new ATOM 0 HB2 LYS A 45 3.130 10.320 -2.216 1.00 10.00 H new ATOM 0 HB3 LYS A 45 4.360 9.630 -3.257 1.00 10.00 H new ATOM 0 HG2 LYS A 45 3.193 11.258 -4.555 1.00 10.00 H new ATOM 0 HG3 LYS A 45 2.698 9.689 -5.158 1.00 10.00 H new ATOM 0 HD2 LYS A 45 0.646 9.822 -3.708 1.00 10.00 H new ATOM 0 HD3 LYS A 45 1.131 11.433 -3.217 1.00 10.00 H new ATOM 0 HE2 LYS A 45 1.059 12.176 -5.598 1.00 10.00 H new ATOM 0 HE3 LYS A 45 0.563 10.567 -6.082 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -1.235 12.317 -5.731 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -1.491 10.790 -5.033 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 -0.983 12.091 -4.067 1.00 10.00 H new ATOM 431 N LYS A 46 3.788 7.134 -4.652 1.00 10.00 N ATOM 432 CA LYS A 46 3.828 6.387 -5.902 1.00 10.00 C ATOM 433 C LYS A 46 3.238 4.991 -5.732 1.00 10.00 C ATOM 434 O LYS A 46 2.573 4.475 -6.628 1.00 10.00 O ATOM 435 CB LYS A 46 5.265 6.284 -6.419 1.00 10.00 C ATOM 436 CG LYS A 46 5.352 5.987 -7.906 1.00 10.00 C ATOM 437 CD LYS A 46 4.848 7.157 -8.730 1.00 10.00 C ATOM 438 CE LYS A 46 4.611 6.766 -10.178 1.00 10.00 C ATOM 439 NZ LYS A 46 3.801 7.787 -10.890 1.00 10.00 N ATOM 0 H LYS A 46 4.705 7.354 -4.263 1.00 10.00 H new ATOM 0 HA LYS A 46 3.224 6.928 -6.630 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.786 7.219 -6.212 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.786 5.501 -5.869 1.00 10.00 H new ATOM 0 HG2 LYS A 46 6.385 5.767 -8.176 1.00 10.00 H new ATOM 0 HG3 LYS A 46 4.766 5.097 -8.137 1.00 10.00 H new ATOM 0 HD2 LYS A 46 3.920 7.533 -8.298 1.00 10.00 H new ATOM 0 HD3 LYS A 46 5.572 7.971 -8.687 1.00 10.00 H new ATOM 0 HE2 LYS A 46 5.568 6.641 -10.684 1.00 10.00 H new ATOM 0 HE3 LYS A 46 4.102 5.803 -10.218 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 3.908 7.661 -11.917 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 2.800 7.678 -10.631 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 4.127 8.738 -10.622 1.00 10.00 H new ATOM 453 N LEU A 47 3.476 4.387 -4.581 1.00 10.00 N ATOM 454 CA LEU A 47 2.967 3.050 -4.305 1.00 10.00 C ATOM 455 C LEU A 47 1.446 3.071 -4.162 1.00 10.00 C ATOM 456 O LEU A 47 0.752 2.168 -4.635 1.00 10.00 O ATOM 457 CB LEU A 47 3.613 2.475 -3.035 1.00 10.00 C ATOM 458 CG LEU A 47 5.076 2.019 -3.171 1.00 10.00 C ATOM 459 CD1 LEU A 47 5.285 1.243 -4.460 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.030 3.201 -3.107 1.00 10.00 C ATOM 0 H LEU A 47 4.018 4.799 -3.821 1.00 10.00 H new ATOM 0 HA LEU A 47 3.227 2.408 -5.147 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.560 3.230 -2.250 1.00 10.00 H new ATOM 0 HB3 LEU A 47 3.018 1.625 -2.701 1.00 10.00 H new ATOM 0 HG LEU A 47 5.294 1.360 -2.330 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.327 0.932 -4.532 1.00 10.00 H new ATOM 0 HD12 LEU A 47 4.642 0.363 -4.463 1.00 10.00 H new ATOM 0 HD13 LEU A 47 5.036 1.877 -5.311 1.00 10.00 H new ATOM 0 HD21 LEU A 47 7.056 2.846 -3.206 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.806 3.894 -3.918 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.913 3.711 -2.151 1.00 10.00 H new ATOM 472 N LYS A 48 0.934 4.117 -3.523 1.00 10.00 N ATOM 473 CA LYS A 48 -0.498 4.269 -3.306 1.00 10.00 C ATOM 474 C LYS A 48 -1.250 4.467 -4.620 1.00 10.00 C ATOM 475 O LYS A 48 -2.277 3.824 -4.854 1.00 10.00 O ATOM 476 CB LYS A 48 -0.770 5.450 -2.368 1.00 10.00 C ATOM 477 CG LYS A 48 -0.303 5.219 -0.939 1.00 10.00 C ATOM 478 CD LYS A 48 -0.400 6.490 -0.106 1.00 10.00 C ATOM 479 CE LYS A 48 -1.844 6.836 0.234 1.00 10.00 C ATOM 480 NZ LYS A 48 -1.963 8.189 0.839 1.00 10.00 N ATOM 0 H LYS A 48 1.497 4.878 -3.143 1.00 10.00 H new ATOM 0 HA LYS A 48 -0.860 3.349 -2.847 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.275 6.337 -2.763 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -1.840 5.658 -2.362 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -0.906 4.436 -0.480 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.728 4.865 -0.945 1.00 10.00 H new ATOM 0 HD2 LYS A 48 0.170 6.365 0.815 1.00 10.00 H new ATOM 0 HD3 LYS A 48 0.053 7.318 -0.652 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.451 6.788 -0.670 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.242 6.093 0.925 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -2.855 8.254 1.370 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -1.163 8.353 1.483 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -1.955 8.907 0.087 1.00 10.00 H new ATOM 494 N GLU A 49 -0.738 5.344 -5.483 1.00 10.00 N ATOM 495 CA GLU A 49 -1.389 5.616 -6.764 1.00 10.00 C ATOM 496 C GLU A 49 -1.333 4.389 -7.675 1.00 10.00 C ATOM 497 O GLU A 49 -2.296 4.093 -8.385 1.00 10.00 O ATOM 498 CB GLU A 49 -0.770 6.841 -7.452 1.00 10.00 C ATOM 499 CG GLU A 49 0.723 6.728 -7.706 1.00 10.00 C ATOM 500 CD GLU A 49 1.315 7.974 -8.335 1.00 10.00 C ATOM 501 OE1 GLU A 49 1.566 8.953 -7.603 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.555 7.971 -9.560 1.00 10.00 O ATOM 0 H GLU A 49 0.118 5.874 -5.321 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.437 5.841 -6.565 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.277 7.004 -8.403 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -0.956 7.721 -6.837 1.00 10.00 H new ATOM 0 HG2 GLU A 49 1.232 6.527 -6.763 1.00 10.00 H new ATOM 0 HG3 GLU A 49 0.911 5.875 -8.358 1.00 10.00 H new ATOM 509 N SER A 50 -0.218 3.664 -7.632 1.00 10.00 N ATOM 510 CA SER A 50 -0.056 2.469 -8.451 1.00 10.00 C ATOM 511 C SER A 50 -1.067 1.398 -8.045 1.00 10.00 C ATOM 512 O SER A 50 -1.606 0.683 -8.892 1.00 10.00 O ATOM 513 CB SER A 50 1.369 1.927 -8.331 1.00 10.00 C ATOM 514 OG SER A 50 2.316 2.906 -8.720 1.00 10.00 O ATOM 0 H SER A 50 0.583 3.883 -7.040 1.00 10.00 H new ATOM 0 HA SER A 50 -0.238 2.740 -9.491 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.560 1.619 -7.303 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.479 1.040 -8.955 1.00 10.00 H new ATOM 0 HG SER A 50 2.593 3.424 -7.935 1.00 10.00 H new ATOM 520 N TYR A 51 -1.333 1.301 -6.744 1.00 10.00 N ATOM 521 CA TYR A 51 -2.290 0.331 -6.233 1.00 10.00 C ATOM 522 C TYR A 51 -3.684 0.638 -6.770 1.00 10.00 C ATOM 523 O TYR A 51 -4.411 -0.260 -7.196 1.00 10.00 O ATOM 524 CB TYR A 51 -2.301 0.336 -4.700 1.00 10.00 C ATOM 525 CG TYR A 51 -3.232 -0.693 -4.096 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.855 -2.028 -3.998 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.487 -0.329 -3.628 1.00 10.00 C ATOM 528 CE1 TYR A 51 -3.708 -2.970 -3.453 1.00 10.00 C ATOM 529 CE2 TYR A 51 -5.344 -1.264 -3.081 1.00 10.00 C ATOM 530 CZ TYR A 51 -4.949 -2.582 -2.995 1.00 10.00 C ATOM 531 OH TYR A 51 -5.801 -3.516 -2.453 1.00 10.00 O ATOM 0 H TYR A 51 -0.898 1.883 -6.028 1.00 10.00 H new ATOM 0 HA TYR A 51 -1.990 -0.661 -6.571 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -1.289 0.155 -4.337 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.592 1.326 -4.351 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.882 -2.333 -4.353 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -4.799 0.703 -3.693 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -3.404 -4.004 -3.387 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -6.318 -0.964 -2.723 1.00 10.00 H new ATOM 0 HH TYR A 51 -5.278 -4.230 -2.032 1.00 10.00 H new ATOM 541 N CYS A 52 -4.031 1.918 -6.770 1.00 10.00 N ATOM 542 CA CYS A 52 -5.330 2.364 -7.253 1.00 10.00 C ATOM 543 C CYS A 52 -5.502 2.023 -8.731 1.00 10.00 C ATOM 544 O CYS A 52 -6.561 1.548 -9.148 1.00 10.00 O ATOM 545 CB CYS A 52 -5.486 3.871 -7.035 1.00 10.00 C ATOM 546 SG CYS A 52 -5.185 4.412 -5.334 1.00 10.00 S ATOM 0 H CYS A 52 -3.426 2.670 -6.439 1.00 10.00 H new ATOM 0 HA CYS A 52 -6.104 1.844 -6.689 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -4.798 4.395 -7.698 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.495 4.166 -7.325 1.00 10.00 H new ATOM 0 HG CYS A 52 -3.927 4.255 -5.045 1.00 10.00 H new ATOM 552 N GLN A 53 -4.447 2.246 -9.514 1.00 10.00 N ATOM 553 CA GLN A 53 -4.480 1.961 -10.944 1.00 10.00 C ATOM 554 C GLN A 53 -4.717 0.475 -11.194 1.00 10.00 C ATOM 555 O GLN A 53 -5.468 0.100 -12.096 1.00 10.00 O ATOM 556 CB GLN A 53 -3.173 2.387 -11.612 1.00 10.00 C ATOM 557 CG GLN A 53 -2.856 3.866 -11.462 1.00 10.00 C ATOM 558 CD GLN A 53 -1.563 4.255 -12.151 1.00 10.00 C ATOM 559 OE1 GLN A 53 -0.667 3.429 -12.328 1.00 10.00 O ATOM 560 NE2 GLN A 53 -1.453 5.514 -12.538 1.00 10.00 N ATOM 0 H GLN A 53 -3.560 2.623 -9.180 1.00 10.00 H new ATOM 0 HA GLN A 53 -5.303 2.530 -11.376 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -2.354 1.806 -11.189 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -3.222 2.142 -12.673 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -3.675 4.454 -11.876 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -2.789 4.114 -10.403 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -2.219 6.167 -12.373 1.00 10.00 H new ATOM 0 HE22 GLN A 53 -0.602 5.832 -13.002 1.00 10.00 H new ATOM 569 N ARG A 54 -4.077 -0.365 -10.384 1.00 10.00 N ATOM 570 CA ARG A 54 -4.216 -1.811 -10.513 1.00 10.00 C ATOM 571 C ARG A 54 -5.647 -2.249 -10.210 1.00 10.00 C ATOM 572 O ARG A 54 -6.192 -3.128 -10.874 1.00 10.00 O ATOM 573 CB ARG A 54 -3.245 -2.529 -9.569 1.00 10.00 C ATOM 574 CG ARG A 54 -3.451 -4.035 -9.525 1.00 10.00 C ATOM 575 CD ARG A 54 -2.841 -4.653 -8.280 1.00 10.00 C ATOM 576 NE ARG A 54 -3.542 -5.872 -7.883 1.00 10.00 N ATOM 577 CZ ARG A 54 -3.030 -7.099 -7.974 1.00 10.00 C ATOM 578 NH1 ARG A 54 -1.804 -7.284 -8.453 1.00 10.00 N ATOM 579 NH2 ARG A 54 -3.748 -8.146 -7.594 1.00 10.00 N ATOM 0 H ARG A 54 -3.457 -0.067 -9.631 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.978 -2.080 -11.542 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -2.222 -2.318 -9.882 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -3.360 -2.124 -8.564 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -4.518 -4.257 -9.555 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -3.006 -4.488 -10.411 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -1.791 -4.880 -8.464 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -2.873 -3.932 -7.463 1.00 10.00 H new ATOM 0 HE ARG A 54 -4.487 -5.777 -7.511 1.00 10.00 H new ATOM 0 HH11 ARG A 54 -1.248 -6.484 -8.754 1.00 10.00 H new ATOM 0 HH12 ARG A 54 -1.419 -8.226 -8.519 1.00 10.00 H new ATOM 0 HH21 ARG A 54 -4.692 -8.013 -7.232 1.00 10.00 H new ATOM 0 HH22 ARG A 54 -3.356 -9.085 -7.664 1.00 10.00 H new ATOM 593 N GLN A 55 -6.250 -1.622 -9.211 1.00 10.00 N ATOM 594 CA GLN A 55 -7.614 -1.955 -8.817 1.00 10.00 C ATOM 595 C GLN A 55 -8.631 -1.346 -9.782 1.00 10.00 C ATOM 596 O GLN A 55 -9.803 -1.729 -9.788 1.00 10.00 O ATOM 597 CB GLN A 55 -7.883 -1.487 -7.387 1.00 10.00 C ATOM 598 CG GLN A 55 -6.933 -2.091 -6.361 1.00 10.00 C ATOM 599 CD GLN A 55 -6.919 -3.609 -6.383 1.00 10.00 C ATOM 600 OE1 GLN A 55 -6.133 -4.224 -7.104 1.00 10.00 O ATOM 601 NE2 GLN A 55 -7.780 -4.220 -5.590 1.00 10.00 N ATOM 0 H GLN A 55 -5.819 -0.881 -8.658 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.723 -3.039 -8.857 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.804 -0.401 -7.348 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -8.908 -1.742 -7.116 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -5.924 -1.722 -6.547 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -7.219 -1.751 -5.366 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -8.414 -3.673 -5.008 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -7.811 -5.239 -5.559 1.00 10.00 H new ATOM 610 N GLY A 56 -8.176 -0.395 -10.593 1.00 10.00 N ATOM 611 CA GLY A 56 -9.043 0.246 -11.562 1.00 10.00 C ATOM 612 C GLY A 56 -9.897 1.336 -10.949 1.00 10.00 C ATOM 613 O GLY A 56 -11.017 1.585 -11.401 1.00 10.00 O ATOM 0 H GLY A 56 -7.214 -0.056 -10.594 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -8.436 0.671 -12.361 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -9.690 -0.504 -12.017 1.00 10.00 H new ATOM 617 N VAL A 57 -9.379 1.980 -9.916 1.00 10.00 N ATOM 618 CA VAL A 57 -10.098 3.054 -9.243 1.00 10.00 C ATOM 619 C VAL A 57 -9.195 4.270 -9.069 1.00 10.00 C ATOM 620 O VAL A 57 -7.971 4.141 -9.069 1.00 10.00 O ATOM 621 CB VAL A 57 -10.633 2.608 -7.860 1.00 10.00 C ATOM 622 CG1 VAL A 57 -11.795 1.637 -8.020 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.522 1.985 -7.026 1.00 10.00 C ATOM 0 H VAL A 57 -8.460 1.778 -9.523 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.950 3.316 -9.871 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.996 3.492 -7.335 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -12.156 1.336 -7.036 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.602 2.122 -8.570 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -11.461 0.757 -8.569 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -9.921 1.679 -6.059 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -9.122 1.114 -7.545 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.727 2.715 -6.876 1.00 10.00 H new ATOM 633 N PRO A 58 -9.774 5.474 -8.948 1.00 10.00 N ATOM 634 CA PRO A 58 -9.000 6.700 -8.758 1.00 10.00 C ATOM 635 C PRO A 58 -8.398 6.770 -7.359 1.00 10.00 C ATOM 636 O PRO A 58 -8.812 6.036 -6.456 1.00 10.00 O ATOM 637 CB PRO A 58 -10.026 7.828 -8.948 1.00 10.00 C ATOM 638 CG PRO A 58 -11.263 7.173 -9.470 1.00 10.00 C ATOM 639 CD PRO A 58 -11.217 5.749 -9.000 1.00 10.00 C ATOM 0 HA PRO A 58 -8.162 6.761 -9.452 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -10.223 8.340 -8.006 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -9.657 8.578 -9.647 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -12.156 7.676 -9.098 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -11.299 7.222 -10.558 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.688 5.629 -8.024 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.733 5.079 -9.687 1.00 10.00 H new ATOM 647 N MET A 59 -7.425 7.646 -7.178 1.00 10.00 N ATOM 648 CA MET A 59 -6.784 7.804 -5.883 1.00 10.00 C ATOM 649 C MET A 59 -7.729 8.513 -4.914 1.00 10.00 C ATOM 650 O MET A 59 -8.666 9.183 -5.343 1.00 10.00 O ATOM 651 CB MET A 59 -5.484 8.593 -6.023 1.00 10.00 C ATOM 652 CG MET A 59 -4.447 8.235 -4.971 1.00 10.00 C ATOM 653 SD MET A 59 -2.948 9.225 -5.101 1.00 10.00 S ATOM 654 CE MET A 59 -1.959 8.467 -3.818 1.00 10.00 C ATOM 0 H MET A 59 -7.062 8.258 -7.909 1.00 10.00 H new ATOM 0 HA MET A 59 -6.548 6.816 -5.488 1.00 10.00 H new ATOM 0 HB2 MET A 59 -5.064 8.415 -7.013 1.00 10.00 H new ATOM 0 HB3 MET A 59 -5.705 9.658 -5.958 1.00 10.00 H new ATOM 0 HG2 MET A 59 -4.881 8.369 -3.980 1.00 10.00 H new ATOM 0 HG3 MET A 59 -4.189 7.180 -5.066 1.00 10.00 H new ATOM 0 HE1 MET A 59 -1.387 9.235 -3.298 1.00 10.00 H new ATOM 0 HE2 MET A 59 -2.611 7.958 -3.109 1.00 10.00 H new ATOM 0 HE3 MET A 59 -1.275 7.745 -4.264 1.00 10.00 H new ATOM 664 N ASN A 60 -7.484 8.323 -3.616 1.00 10.00 N ATOM 665 CA ASN A 60 -8.287 8.929 -2.538 1.00 10.00 C ATOM 666 C ASN A 60 -9.589 8.165 -2.311 1.00 10.00 C ATOM 667 O ASN A 60 -10.248 8.344 -1.289 1.00 10.00 O ATOM 668 CB ASN A 60 -8.582 10.413 -2.804 1.00 10.00 C ATOM 669 CG ASN A 60 -8.208 11.295 -1.629 1.00 10.00 C ATOM 670 OD1 ASN A 60 -7.066 11.735 -1.513 1.00 10.00 O ATOM 671 ND2 ASN A 60 -9.163 11.568 -0.755 1.00 10.00 N ATOM 0 H ASN A 60 -6.719 7.741 -3.275 1.00 10.00 H new ATOM 0 HA ASN A 60 -7.686 8.864 -1.631 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -8.033 10.737 -3.688 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -9.642 10.536 -3.025 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -8.963 12.163 0.049 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -10.099 11.184 -0.886 1.00 10.00 H new ATOM 678 N SER A 61 -9.959 7.317 -3.264 1.00 10.00 N ATOM 679 CA SER A 61 -11.172 6.517 -3.144 1.00 10.00 C ATOM 680 C SER A 61 -10.991 5.451 -2.071 1.00 10.00 C ATOM 681 O SER A 61 -11.937 5.070 -1.377 1.00 10.00 O ATOM 682 CB SER A 61 -11.505 5.865 -4.486 1.00 10.00 C ATOM 683 OG SER A 61 -11.223 6.747 -5.558 1.00 10.00 O ATOM 0 H SER A 61 -9.437 7.166 -4.127 1.00 10.00 H new ATOM 0 HA SER A 61 -11.998 7.168 -2.856 1.00 10.00 H new ATOM 0 HB2 SER A 61 -10.928 4.948 -4.603 1.00 10.00 H new ATOM 0 HB3 SER A 61 -12.558 5.584 -4.508 1.00 10.00 H new ATOM 0 HG SER A 61 -10.342 6.536 -5.932 1.00 10.00 H new ATOM 689 N LEU A 62 -9.762 4.986 -1.937 1.00 10.00 N ATOM 690 CA LEU A 62 -9.427 3.973 -0.955 1.00 10.00 C ATOM 691 C LEU A 62 -8.571 4.580 0.146 1.00 10.00 C ATOM 692 O LEU A 62 -7.781 5.492 -0.103 1.00 10.00 O ATOM 693 CB LEU A 62 -8.680 2.809 -1.611 1.00 10.00 C ATOM 694 CG LEU A 62 -9.451 2.048 -2.695 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.557 1.012 -3.355 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.686 1.381 -2.108 1.00 10.00 C ATOM 0 H LEU A 62 -8.973 5.298 -2.503 1.00 10.00 H new ATOM 0 HA LEU A 62 -10.353 3.592 -0.524 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.759 3.194 -2.049 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.392 2.102 -0.833 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.772 2.764 -3.451 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -9.120 0.481 -4.122 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -7.701 1.508 -3.812 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -8.207 0.302 -2.605 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -11.219 0.846 -2.894 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.385 0.678 -1.331 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -11.340 2.140 -1.678 1.00 10.00 H new ATOM 708 N ARG A 63 -8.746 4.087 1.357 1.00 10.00 N ATOM 709 CA ARG A 63 -7.985 4.569 2.494 1.00 10.00 C ATOM 710 C ARG A 63 -7.108 3.459 3.051 1.00 10.00 C ATOM 711 O ARG A 63 -7.584 2.358 3.339 1.00 10.00 O ATOM 712 CB ARG A 63 -8.911 5.119 3.589 1.00 10.00 C ATOM 713 CG ARG A 63 -10.026 4.174 4.018 1.00 10.00 C ATOM 714 CD ARG A 63 -10.890 4.805 5.099 1.00 10.00 C ATOM 715 NE ARG A 63 -12.045 3.980 5.459 1.00 10.00 N ATOM 716 CZ ARG A 63 -13.298 4.444 5.546 1.00 10.00 C ATOM 717 NH1 ARG A 63 -13.574 5.704 5.227 1.00 10.00 N ATOM 718 NH2 ARG A 63 -14.276 3.643 5.947 1.00 10.00 N ATOM 0 H ARG A 63 -9.413 3.348 1.580 1.00 10.00 H new ATOM 0 HA ARG A 63 -7.348 5.384 2.152 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -8.309 5.368 4.463 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -9.358 6.048 3.234 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.643 3.920 3.156 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -9.596 3.243 4.388 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -10.283 4.978 5.987 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -11.238 5.779 4.756 1.00 10.00 H new ATOM 0 HE ARG A 63 -11.885 2.992 5.655 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.829 6.326 4.913 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -14.531 6.050 5.296 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -14.074 2.673 6.189 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -15.230 3.997 6.013 1.00 10.00 H new ATOM 732 N PHE A 64 -5.822 3.749 3.176 1.00 10.00 N ATOM 733 CA PHE A 64 -4.868 2.785 3.701 1.00 10.00 C ATOM 734 C PHE A 64 -4.754 2.938 5.210 1.00 10.00 C ATOM 735 O PHE A 64 -4.422 4.015 5.708 1.00 10.00 O ATOM 736 CB PHE A 64 -3.496 2.973 3.052 1.00 10.00 C ATOM 737 CG PHE A 64 -3.412 2.438 1.652 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.578 3.280 0.565 1.00 10.00 C ATOM 739 CD2 PHE A 64 -3.165 1.093 1.422 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.501 2.792 -0.724 1.00 10.00 C ATOM 741 CE2 PHE A 64 -3.086 0.600 0.133 1.00 10.00 C ATOM 742 CZ PHE A 64 -3.254 1.451 -0.941 1.00 10.00 C ATOM 0 H PHE A 64 -5.414 4.648 2.920 1.00 10.00 H new ATOM 0 HA PHE A 64 -5.226 1.782 3.467 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -3.252 4.035 3.041 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.743 2.479 3.666 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -3.770 4.330 0.728 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -3.033 0.423 2.259 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -3.634 3.459 -1.563 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -2.893 -0.449 -0.034 1.00 10.00 H new ATOM 0 HZ PHE A 64 -3.192 1.068 -1.949 1.00 10.00 H new ATOM 752 N LEU A 65 -5.033 1.864 5.931 1.00 10.00 N ATOM 753 CA LEU A 65 -4.979 1.883 7.383 1.00 10.00 C ATOM 754 C LEU A 65 -3.797 1.071 7.891 1.00 10.00 C ATOM 755 O LEU A 65 -3.609 -0.086 7.511 1.00 10.00 O ATOM 756 CB LEU A 65 -6.289 1.349 7.973 1.00 10.00 C ATOM 757 CG LEU A 65 -7.545 2.130 7.570 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.784 1.506 8.192 1.00 10.00 C ATOM 759 CD2 LEU A 65 -7.422 3.594 7.978 1.00 10.00 C ATOM 0 H LEU A 65 -5.300 0.964 5.532 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.846 2.915 7.706 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -6.411 0.310 7.667 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.209 1.354 9.060 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.643 2.084 6.485 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.666 2.074 7.895 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.883 0.476 7.850 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -8.692 1.520 9.278 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -8.324 4.131 7.683 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -7.297 3.661 9.059 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -6.558 4.038 7.484 1.00 10.00 H new ATOM 771 N PHE A 66 -2.998 1.696 8.740 1.00 10.00 N ATOM 772 CA PHE A 66 -1.825 1.062 9.313 1.00 10.00 C ATOM 773 C PHE A 66 -1.760 1.353 10.808 1.00 10.00 C ATOM 774 O PHE A 66 -1.614 2.508 11.211 1.00 10.00 O ATOM 775 CB PHE A 66 -0.562 1.576 8.617 1.00 10.00 C ATOM 776 CG PHE A 66 0.664 0.749 8.874 1.00 10.00 C ATOM 777 CD1 PHE A 66 0.829 -0.480 8.257 1.00 10.00 C ATOM 778 CD2 PHE A 66 1.657 1.208 9.725 1.00 10.00 C ATOM 779 CE1 PHE A 66 1.959 -1.238 8.485 1.00 10.00 C ATOM 780 CE2 PHE A 66 2.790 0.453 9.957 1.00 10.00 C ATOM 781 CZ PHE A 66 2.943 -0.771 9.336 1.00 10.00 C ATOM 0 H PHE A 66 -3.145 2.656 9.050 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.891 -0.016 9.166 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.743 1.613 7.543 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -0.372 2.598 8.944 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.064 -0.849 7.590 1.00 10.00 H new ATOM 0 HD2 PHE A 66 1.544 2.166 10.212 1.00 10.00 H new ATOM 0 HE1 PHE A 66 2.075 -2.195 7.999 1.00 10.00 H new ATOM 0 HE2 PHE A 66 3.556 0.820 10.624 1.00 10.00 H new ATOM 0 HZ PHE A 66 3.829 -1.362 9.515 1.00 10.00 H new ATOM 791 N GLU A 67 -1.910 0.306 11.618 1.00 10.00 N ATOM 792 CA GLU A 67 -1.868 0.424 13.080 1.00 10.00 C ATOM 793 C GLU A 67 -3.014 1.283 13.616 1.00 10.00 C ATOM 794 O GLU A 67 -3.003 1.693 14.776 1.00 10.00 O ATOM 795 CB GLU A 67 -0.522 0.997 13.539 1.00 10.00 C ATOM 796 CG GLU A 67 0.651 0.072 13.270 1.00 10.00 C ATOM 797 CD GLU A 67 0.665 -1.132 14.187 1.00 10.00 C ATOM 798 OE1 GLU A 67 -0.251 -1.974 14.090 1.00 10.00 O ATOM 799 OE2 GLU A 67 1.603 -1.250 15.007 1.00 10.00 O ATOM 0 H GLU A 67 -2.064 -0.645 11.284 1.00 10.00 H new ATOM 0 HA GLU A 67 -1.985 -0.580 13.487 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -0.349 1.947 13.034 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -0.571 1.208 14.607 1.00 10.00 H new ATOM 0 HG2 GLU A 67 0.613 -0.265 12.234 1.00 10.00 H new ATOM 0 HG3 GLU A 67 1.581 0.627 13.391 1.00 10.00 H new ATOM 806 N GLY A 68 -4.006 1.541 12.776 1.00 10.00 N ATOM 807 CA GLY A 68 -5.134 2.349 13.191 1.00 10.00 C ATOM 808 C GLY A 68 -5.096 3.736 12.590 1.00 10.00 C ATOM 809 O GLY A 68 -6.101 4.449 12.585 1.00 10.00 O ATOM 0 H GLY A 68 -4.050 1.205 11.814 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -6.060 1.854 12.899 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -5.143 2.426 14.278 1.00 10.00 H new ATOM 813 N GLN A 69 -3.936 4.121 12.083 1.00 10.00 N ATOM 814 CA GLN A 69 -3.767 5.429 11.469 1.00 10.00 C ATOM 815 C GLN A 69 -3.900 5.304 9.961 1.00 10.00 C ATOM 816 O GLN A 69 -3.743 4.211 9.414 1.00 10.00 O ATOM 817 CB GLN A 69 -2.399 6.021 11.816 1.00 10.00 C ATOM 818 CG GLN A 69 -2.136 6.133 13.308 1.00 10.00 C ATOM 819 CD GLN A 69 -0.797 6.775 13.618 1.00 10.00 C ATOM 820 OE1 GLN A 69 0.160 6.657 12.851 1.00 10.00 O ATOM 821 NE2 GLN A 69 -0.718 7.460 14.744 1.00 10.00 N ATOM 0 H GLN A 69 -3.095 3.544 12.084 1.00 10.00 H new ATOM 0 HA GLN A 69 -4.540 6.095 11.854 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -1.622 5.403 11.366 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -2.319 7.011 11.368 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -2.931 6.718 13.770 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -2.170 5.139 13.755 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -1.532 7.535 15.353 1.00 10.00 H new ATOM 0 HE22 GLN A 69 0.157 7.914 15.004 1.00 10.00 H new ATOM 830 N ARG A 70 -4.194 6.404 9.289 1.00 10.00 N ATOM 831 CA ARG A 70 -4.322 6.381 7.842 1.00 10.00 C ATOM 832 C ARG A 70 -3.030 6.867 7.197 1.00 10.00 C ATOM 833 O ARG A 70 -2.457 7.874 7.611 1.00 10.00 O ATOM 834 CB ARG A 70 -5.522 7.216 7.367 1.00 10.00 C ATOM 835 CG ARG A 70 -5.607 8.602 7.985 1.00 10.00 C ATOM 836 CD ARG A 70 -6.755 9.405 7.386 1.00 10.00 C ATOM 837 NE ARG A 70 -6.561 9.647 5.958 1.00 10.00 N ATOM 838 CZ ARG A 70 -7.443 9.324 5.006 1.00 10.00 C ATOM 839 NH1 ARG A 70 -8.627 8.797 5.317 1.00 10.00 N ATOM 840 NH2 ARG A 70 -7.146 9.548 3.736 1.00 10.00 N ATOM 0 H ARG A 70 -4.347 7.317 9.718 1.00 10.00 H new ATOM 0 HA ARG A 70 -4.504 5.352 7.533 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -5.472 7.317 6.283 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -6.439 6.673 7.594 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -5.745 8.514 9.063 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -4.668 9.132 7.826 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -7.692 8.870 7.540 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -6.843 10.358 7.908 1.00 10.00 H new ATOM 0 HE ARG A 70 -5.692 10.094 5.667 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -8.872 8.634 6.294 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -9.288 8.556 4.578 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -6.249 9.965 3.488 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -7.814 9.304 3.005 1.00 10.00 H new ATOM 854 N ILE A 71 -2.571 6.132 6.199 1.00 10.00 N ATOM 855 CA ILE A 71 -1.339 6.466 5.498 1.00 10.00 C ATOM 856 C ILE A 71 -1.500 7.735 4.661 1.00 10.00 C ATOM 857 O ILE A 71 -2.319 7.787 3.739 1.00 10.00 O ATOM 858 CB ILE A 71 -0.881 5.299 4.594 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.581 4.058 5.445 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.341 5.690 3.772 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.475 4.282 6.509 1.00 10.00 C ATOM 0 H ILE A 71 -3.036 5.293 5.852 1.00 10.00 H new ATOM 0 HA ILE A 71 -0.577 6.646 6.256 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.690 5.065 3.902 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.502 3.728 5.925 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.256 3.250 4.789 1.00 10.00 H new ATOM 0 HG21 ILE A 71 0.642 4.850 3.145 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.097 6.545 3.141 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.160 5.955 4.441 1.00 10.00 H new ATOM 0 HD11 ILE A 71 0.630 3.359 7.068 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.410 4.582 6.036 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.145 5.067 7.190 1.00 10.00 H new ATOM 873 N ALA A 72 -0.710 8.752 4.991 1.00 10.00 N ATOM 874 CA ALA A 72 -0.749 10.024 4.278 1.00 10.00 C ATOM 875 C ALA A 72 -0.182 9.866 2.870 1.00 10.00 C ATOM 876 O ALA A 72 0.316 8.800 2.508 1.00 10.00 O ATOM 877 CB ALA A 72 0.030 11.081 5.051 1.00 10.00 C ATOM 0 H ALA A 72 -0.032 8.719 5.752 1.00 10.00 H new ATOM 0 HA ALA A 72 -1.787 10.346 4.194 1.00 10.00 H new ATOM 0 HB1 ALA A 72 -0.005 12.027 4.510 1.00 10.00 H new ATOM 0 HB2 ALA A 72 -0.414 11.211 6.038 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.067 10.763 5.158 1.00 10.00 H new ATOM 883 N ASP A 73 -0.281 10.908 2.058 1.00 10.00 N ATOM 884 CA ASP A 73 0.241 10.850 0.695 1.00 10.00 C ATOM 885 C ASP A 73 1.738 11.108 0.691 1.00 10.00 C ATOM 886 O ASP A 73 2.464 10.628 -0.175 1.00 10.00 O ATOM 887 CB ASP A 73 -0.480 11.848 -0.208 1.00 10.00 C ATOM 888 CG ASP A 73 -1.272 11.144 -1.288 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.756 10.021 -1.025 1.00 10.00 O ATOM 890 OD2 ASP A 73 -1.407 11.704 -2.397 1.00 10.00 O ATOM 0 H ASP A 73 -0.713 11.796 2.313 1.00 10.00 H new ATOM 0 HA ASP A 73 0.060 9.850 0.302 1.00 10.00 H new ATOM 0 HB2 ASP A 73 -1.149 12.466 0.391 1.00 10.00 H new ATOM 0 HB3 ASP A 73 0.248 12.518 -0.666 1.00 10.00 H new ATOM 895 N ASN A 74 2.191 11.856 1.683 1.00 10.00 N ATOM 896 CA ASN A 74 3.606 12.173 1.833 1.00 10.00 C ATOM 897 C ASN A 74 4.233 11.244 2.867 1.00 10.00 C ATOM 898 O ASN A 74 5.270 11.549 3.459 1.00 10.00 O ATOM 899 CB ASN A 74 3.783 13.635 2.259 1.00 10.00 C ATOM 900 CG ASN A 74 2.997 13.968 3.513 1.00 10.00 C ATOM 901 OD1 ASN A 74 1.800 14.253 3.451 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.654 13.934 4.658 1.00 10.00 N ATOM 0 H ASN A 74 1.594 12.260 2.405 1.00 10.00 H new ATOM 0 HA ASN A 74 4.105 12.030 0.874 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.840 13.835 2.432 1.00 10.00 H new ATOM 0 HB3 ASN A 74 3.463 14.289 1.448 1.00 10.00 H new ATOM 0 HD21 ASN A 74 3.170 14.148 5.530 1.00 10.00 H new ATOM 0 HD22 ASN A 74 4.645 13.694 4.670 1.00 10.00 H new ATOM 909 N HIS A 75 3.595 10.102 3.069 1.00 10.00 N ATOM 910 CA HIS A 75 4.055 9.118 4.036 1.00 10.00 C ATOM 911 C HIS A 75 5.257 8.348 3.500 1.00 10.00 C ATOM 912 O HIS A 75 5.318 8.019 2.312 1.00 10.00 O ATOM 913 CB HIS A 75 2.916 8.153 4.361 1.00 10.00 C ATOM 914 CG HIS A 75 2.844 7.753 5.803 1.00 10.00 C ATOM 915 ND1 HIS A 75 1.916 8.305 6.655 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.583 6.844 6.482 1.00 10.00 C ATOM 917 CE1 HIS A 75 2.109 7.719 7.825 1.00 10.00 C ATOM 918 NE2 HIS A 75 3.110 6.828 7.769 1.00 10.00 N ATOM 0 H HIS A 75 2.748 9.832 2.570 1.00 10.00 H new ATOM 0 HA HIS A 75 4.364 9.637 4.943 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.971 8.615 4.076 1.00 10.00 H new ATOM 0 HB3 HIS A 75 3.029 7.256 3.752 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.390 6.246 6.086 1.00 10.00 H new ATOM 0 HE1 HIS A 75 1.533 7.931 8.714 1.00 10.00 H new ATOM 0 HE2 HIS A 75 3.453 6.250 8.536 1.00 10.00 H new ATOM 926 N THR A 76 6.210 8.078 4.373 1.00 10.00 N ATOM 927 CA THR A 76 7.406 7.348 4.004 1.00 10.00 C ATOM 928 C THR A 76 7.463 6.016 4.751 1.00 10.00 C ATOM 929 O THR A 76 7.104 5.952 5.925 1.00 10.00 O ATOM 930 CB THR A 76 8.666 8.174 4.327 1.00 10.00 C ATOM 931 OG1 THR A 76 8.288 9.509 4.708 1.00 10.00 O ATOM 932 CG2 THR A 76 9.598 8.228 3.125 1.00 10.00 C ATOM 0 H THR A 76 6.176 8.358 5.353 1.00 10.00 H new ATOM 0 HA THR A 76 7.373 7.159 2.931 1.00 10.00 H new ATOM 0 HB THR A 76 9.192 7.694 5.152 1.00 10.00 H new ATOM 0 HG1 THR A 76 7.761 9.477 5.533 1.00 10.00 H new ATOM 0 HG21 THR A 76 10.481 8.816 3.375 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.901 7.217 2.854 1.00 10.00 H new ATOM 0 HG23 THR A 76 9.081 8.690 2.284 1.00 10.00 H new ATOM 940 N PRO A 77 7.911 4.927 4.095 1.00 10.00 N ATOM 941 CA PRO A 77 7.994 3.602 4.729 1.00 10.00 C ATOM 942 C PRO A 77 9.061 3.534 5.821 1.00 10.00 C ATOM 943 O PRO A 77 9.189 2.526 6.514 1.00 10.00 O ATOM 944 CB PRO A 77 8.365 2.658 3.576 1.00 10.00 C ATOM 945 CG PRO A 77 8.154 3.440 2.325 1.00 10.00 C ATOM 946 CD PRO A 77 8.356 4.882 2.692 1.00 10.00 C ATOM 0 HA PRO A 77 7.057 3.346 5.224 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.400 2.327 3.660 1.00 10.00 H new ATOM 0 HB3 PRO A 77 7.742 1.764 3.587 1.00 10.00 H new ATOM 0 HG2 PRO A 77 8.858 3.133 1.551 1.00 10.00 H new ATOM 0 HG3 PRO A 77 7.152 3.276 1.928 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.398 5.184 2.588 1.00 10.00 H new ATOM 0 HD3 PRO A 77 7.768 5.547 2.059 1.00 10.00 H new ATOM 954 N LYS A 78 9.832 4.603 5.970 1.00 10.00 N ATOM 955 CA LYS A 78 10.882 4.649 6.976 1.00 10.00 C ATOM 956 C LYS A 78 10.341 5.199 8.296 1.00 10.00 C ATOM 957 O LYS A 78 10.967 5.054 9.346 1.00 10.00 O ATOM 958 CB LYS A 78 12.054 5.500 6.475 1.00 10.00 C ATOM 959 CG LYS A 78 13.300 5.416 7.345 1.00 10.00 C ATOM 960 CD LYS A 78 14.127 4.173 7.043 1.00 10.00 C ATOM 961 CE LYS A 78 14.802 4.262 5.682 1.00 10.00 C ATOM 962 NZ LYS A 78 16.002 3.386 5.601 1.00 10.00 N ATOM 0 H LYS A 78 9.749 5.449 5.407 1.00 10.00 H new ATOM 0 HA LYS A 78 11.239 3.635 7.154 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.309 5.187 5.462 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.734 6.540 6.416 1.00 10.00 H new ATOM 0 HG2 LYS A 78 13.912 6.305 7.188 1.00 10.00 H new ATOM 0 HG3 LYS A 78 13.009 5.411 8.395 1.00 10.00 H new ATOM 0 HD2 LYS A 78 14.884 4.043 7.817 1.00 10.00 H new ATOM 0 HD3 LYS A 78 13.485 3.293 7.074 1.00 10.00 H new ATOM 0 HE2 LYS A 78 14.092 3.978 4.905 1.00 10.00 H new ATOM 0 HE3 LYS A 78 15.092 5.294 5.487 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 16.434 3.475 4.659 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 16.691 3.673 6.326 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 15.722 2.397 5.762 1.00 10.00 H new ATOM 976 N GLU A 79 9.167 5.819 8.242 1.00 10.00 N ATOM 977 CA GLU A 79 8.554 6.386 9.436 1.00 10.00 C ATOM 978 C GLU A 79 7.490 5.440 9.985 1.00 10.00 C ATOM 979 O GLU A 79 7.069 4.508 9.293 1.00 10.00 O ATOM 980 CB GLU A 79 7.942 7.758 9.135 1.00 10.00 C ATOM 981 CG GLU A 79 6.619 7.692 8.392 1.00 10.00 C ATOM 982 CD GLU A 79 6.174 9.039 7.878 1.00 10.00 C ATOM 983 OE1 GLU A 79 5.512 9.780 8.634 1.00 10.00 O ATOM 984 OE2 GLU A 79 6.486 9.369 6.718 1.00 10.00 O ATOM 0 H GLU A 79 8.623 5.941 7.388 1.00 10.00 H new ATOM 0 HA GLU A 79 9.331 6.517 10.190 1.00 10.00 H new ATOM 0 HB2 GLU A 79 7.794 8.293 10.073 1.00 10.00 H new ATOM 0 HB3 GLU A 79 8.650 8.339 8.545 1.00 10.00 H new ATOM 0 HG2 GLU A 79 6.711 7.000 7.555 1.00 10.00 H new ATOM 0 HG3 GLU A 79 5.854 7.290 9.056 1.00 10.00 H new ATOM 991 N LEU A 80 7.071 5.686 11.231 1.00 10.00 N ATOM 992 CA LEU A 80 6.055 4.880 11.915 1.00 10.00 C ATOM 993 C LEU A 80 6.611 3.504 12.273 1.00 10.00 C ATOM 994 O LEU A 80 6.782 3.184 13.448 1.00 10.00 O ATOM 995 CB LEU A 80 4.782 4.745 11.065 1.00 10.00 C ATOM 996 CG LEU A 80 3.458 4.816 11.836 1.00 10.00 C ATOM 997 CD1 LEU A 80 2.293 4.987 10.871 1.00 10.00 C ATOM 998 CD2 LEU A 80 3.267 3.570 12.690 1.00 10.00 C ATOM 0 H LEU A 80 7.430 6.455 11.797 1.00 10.00 H new ATOM 0 HA LEU A 80 5.786 5.396 12.837 1.00 10.00 H new ATOM 0 HB2 LEU A 80 4.785 5.532 10.311 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.821 3.794 10.533 1.00 10.00 H new ATOM 0 HG LEU A 80 3.490 5.681 12.498 1.00 10.00 H new ATOM 0 HD11 LEU A 80 1.360 5.036 11.432 1.00 10.00 H new ATOM 0 HD12 LEU A 80 2.423 5.908 10.303 1.00 10.00 H new ATOM 0 HD13 LEU A 80 2.261 4.140 10.186 1.00 10.00 H new ATOM 0 HD21 LEU A 80 2.322 3.640 13.229 1.00 10.00 H new ATOM 0 HD22 LEU A 80 3.255 2.688 12.049 1.00 10.00 H new ATOM 0 HD23 LEU A 80 4.087 3.489 13.404 1.00 10.00 H new ATOM 1010 N GLY A 81 6.898 2.699 11.261 1.00 10.00 N ATOM 1011 CA GLY A 81 7.431 1.376 11.496 1.00 10.00 C ATOM 1012 C GLY A 81 6.947 0.368 10.476 1.00 10.00 C ATOM 1013 O GLY A 81 6.059 -0.433 10.764 1.00 10.00 O ATOM 0 H GLY A 81 6.770 2.941 10.278 1.00 10.00 H new ATOM 0 HA2 GLY A 81 8.520 1.417 11.473 1.00 10.00 H new ATOM 0 HA3 GLY A 81 7.145 1.044 12.494 1.00 10.00 H new ATOM 1017 N MET A 82 7.518 0.411 9.281 1.00 10.00 N ATOM 1018 CA MET A 82 7.143 -0.515 8.220 1.00 10.00 C ATOM 1019 C MET A 82 8.289 -1.474 7.943 1.00 10.00 C ATOM 1020 O MET A 82 9.401 -1.049 7.619 1.00 10.00 O ATOM 1021 CB MET A 82 6.771 0.246 6.947 1.00 10.00 C ATOM 1022 CG MET A 82 5.373 0.837 6.979 1.00 10.00 C ATOM 1023 SD MET A 82 4.956 1.715 5.462 1.00 10.00 S ATOM 1024 CE MET A 82 3.199 1.956 5.697 1.00 10.00 C ATOM 0 H MET A 82 8.244 1.078 9.021 1.00 10.00 H new ATOM 0 HA MET A 82 6.272 -1.084 8.545 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.492 1.048 6.789 1.00 10.00 H new ATOM 0 HB3 MET A 82 6.852 -0.428 6.094 1.00 10.00 H new ATOM 0 HG2 MET A 82 4.649 0.039 7.143 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.291 1.520 7.824 1.00 10.00 H new ATOM 0 HE1 MET A 82 2.787 2.489 4.840 1.00 10.00 H new ATOM 0 HE2 MET A 82 2.708 0.987 5.792 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.030 2.539 6.602 1.00 10.00 H new ATOM 1034 N GLU A 83 8.026 -2.759 8.084 1.00 10.00 N ATOM 1035 CA GLU A 83 9.041 -3.770 7.863 1.00 10.00 C ATOM 1036 C GLU A 83 8.549 -4.839 6.901 1.00 10.00 C ATOM 1037 O GLU A 83 7.466 -4.728 6.326 1.00 10.00 O ATOM 1038 CB GLU A 83 9.416 -4.412 9.193 1.00 10.00 C ATOM 1039 CG GLU A 83 10.905 -4.488 9.438 1.00 10.00 C ATOM 1040 CD GLU A 83 11.210 -4.972 10.832 1.00 10.00 C ATOM 1041 OE1 GLU A 83 11.311 -4.125 11.746 1.00 10.00 O ATOM 1042 OE2 GLU A 83 11.320 -6.199 11.027 1.00 10.00 O ATOM 0 H GLU A 83 7.114 -3.128 8.352 1.00 10.00 H new ATOM 0 HA GLU A 83 9.915 -3.290 7.422 1.00 10.00 H new ATOM 0 HB2 GLU A 83 8.953 -3.846 10.002 1.00 10.00 H new ATOM 0 HB3 GLU A 83 9.000 -5.419 9.229 1.00 10.00 H new ATOM 0 HG2 GLU A 83 11.361 -5.159 8.710 1.00 10.00 H new ATOM 0 HG3 GLU A 83 11.351 -3.505 9.287 1.00 10.00 H new ATOM 1049 N GLU A 84 9.358 -5.878 6.742 1.00 10.00 N ATOM 1050 CA GLU A 84 9.029 -6.987 5.867 1.00 10.00 C ATOM 1051 C GLU A 84 7.878 -7.798 6.452 1.00 10.00 C ATOM 1052 O GLU A 84 7.827 -8.031 7.666 1.00 10.00 O ATOM 1053 CB GLU A 84 10.258 -7.881 5.681 1.00 10.00 C ATOM 1054 CG GLU A 84 10.057 -9.009 4.682 1.00 10.00 C ATOM 1055 CD GLU A 84 10.354 -8.599 3.256 1.00 10.00 C ATOM 1056 OE1 GLU A 84 10.538 -7.393 3.001 1.00 10.00 O ATOM 1057 OE2 GLU A 84 10.407 -9.490 2.384 1.00 10.00 O ATOM 0 H GLU A 84 10.257 -5.972 7.215 1.00 10.00 H new ATOM 0 HA GLU A 84 8.722 -6.594 4.898 1.00 10.00 H new ATOM 0 HB2 GLU A 84 11.096 -7.265 5.354 1.00 10.00 H new ATOM 0 HB3 GLU A 84 10.533 -8.308 6.645 1.00 10.00 H new ATOM 0 HG2 GLU A 84 10.700 -9.846 4.954 1.00 10.00 H new ATOM 0 HG3 GLU A 84 9.028 -9.363 4.745 1.00 10.00 H new ATOM 1064 N GLU A 85 6.947 -8.192 5.585 1.00 10.00 N ATOM 1065 CA GLU A 85 5.782 -8.988 5.972 1.00 10.00 C ATOM 1066 C GLU A 85 4.853 -8.219 6.908 1.00 10.00 C ATOM 1067 O GLU A 85 4.079 -8.824 7.655 1.00 10.00 O ATOM 1068 CB GLU A 85 6.205 -10.312 6.625 1.00 10.00 C ATOM 1069 CG GLU A 85 6.881 -11.282 5.669 1.00 10.00 C ATOM 1070 CD GLU A 85 6.059 -11.554 4.426 1.00 10.00 C ATOM 1071 OE1 GLU A 85 5.144 -12.405 4.475 1.00 10.00 O ATOM 1072 OE2 GLU A 85 6.333 -10.926 3.382 1.00 10.00 O ATOM 0 H GLU A 85 6.979 -7.968 4.590 1.00 10.00 H new ATOM 0 HA GLU A 85 5.234 -9.208 5.056 1.00 10.00 H new ATOM 0 HB2 GLU A 85 6.884 -10.098 7.450 1.00 10.00 H new ATOM 0 HB3 GLU A 85 5.325 -10.792 7.053 1.00 10.00 H new ATOM 0 HG2 GLU A 85 7.851 -10.879 5.376 1.00 10.00 H new ATOM 0 HG3 GLU A 85 7.070 -12.222 6.187 1.00 10.00 H new ATOM 1079 N ASP A 86 4.922 -6.892 6.867 1.00 10.00 N ATOM 1080 CA ASP A 86 4.059 -6.069 7.709 1.00 10.00 C ATOM 1081 C ASP A 86 2.641 -6.095 7.160 1.00 10.00 C ATOM 1082 O ASP A 86 2.439 -6.317 5.964 1.00 10.00 O ATOM 1083 CB ASP A 86 4.574 -4.633 7.797 1.00 10.00 C ATOM 1084 CG ASP A 86 4.803 -4.193 9.231 1.00 10.00 C ATOM 1085 OD1 ASP A 86 3.844 -4.223 10.032 1.00 10.00 O ATOM 1086 OD2 ASP A 86 5.947 -3.823 9.567 1.00 10.00 O ATOM 0 H ASP A 86 5.559 -6.368 6.267 1.00 10.00 H new ATOM 0 HA ASP A 86 4.064 -6.481 8.718 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.507 -4.549 7.240 1.00 10.00 H new ATOM 0 HB3 ASP A 86 3.858 -3.962 7.323 1.00 10.00 H new ATOM 1091 N VAL A 87 1.666 -5.864 8.022 1.00 10.00 N ATOM 1092 CA VAL A 87 0.269 -5.910 7.612 1.00 10.00 C ATOM 1093 C VAL A 87 -0.357 -4.522 7.506 1.00 10.00 C ATOM 1094 O VAL A 87 -0.311 -3.727 8.447 1.00 10.00 O ATOM 1095 CB VAL A 87 -0.562 -6.766 8.592 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -2.018 -6.828 8.160 1.00 10.00 C ATOM 1097 CG2 VAL A 87 0.019 -8.167 8.701 1.00 10.00 C ATOM 0 H VAL A 87 1.813 -5.643 9.007 1.00 10.00 H new ATOM 0 HA VAL A 87 0.257 -6.363 6.620 1.00 10.00 H new ATOM 0 HB VAL A 87 -0.518 -6.294 9.573 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -2.582 -7.437 8.867 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.434 -5.821 8.137 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -2.084 -7.271 7.166 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -0.579 -8.756 9.396 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.009 -8.642 7.720 1.00 10.00 H new ATOM 0 HG23 VAL A 87 1.045 -8.108 9.065 1.00 10.00 H new ATOM 1107 N ILE A 88 -0.939 -4.247 6.345 1.00 10.00 N ATOM 1108 CA ILE A 88 -1.613 -2.984 6.095 1.00 10.00 C ATOM 1109 C ILE A 88 -2.990 -3.263 5.491 1.00 10.00 C ATOM 1110 O ILE A 88 -3.155 -4.212 4.721 1.00 10.00 O ATOM 1111 CB ILE A 88 -0.783 -2.063 5.167 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.476 -0.708 4.985 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -0.532 -2.724 3.818 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.599 0.337 4.333 1.00 10.00 C ATOM 0 H ILE A 88 -0.956 -4.892 5.555 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.727 -2.458 7.043 1.00 10.00 H new ATOM 0 HB ILE A 88 0.183 -1.893 5.642 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.373 -0.846 4.381 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.801 -0.342 5.959 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.053 -2.054 3.188 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.016 -3.655 3.965 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.485 -2.937 3.334 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.155 1.270 4.236 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.286 0.504 4.947 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.295 -0.008 3.345 1.00 10.00 H new ATOM 1126 N GLU A 89 -3.979 -2.463 5.859 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.334 -2.658 5.359 1.00 10.00 C ATOM 1128 C GLU A 89 -5.753 -1.519 4.437 1.00 10.00 C ATOM 1129 O GLU A 89 -5.206 -0.418 4.507 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.312 -2.768 6.528 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.062 -3.978 7.411 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.009 -4.040 8.589 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -8.237 -4.009 8.375 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -6.530 -4.140 9.734 1.00 10.00 O ATOM 0 H GLU A 89 -3.871 -1.676 6.499 1.00 10.00 H new ATOM 0 HA GLU A 89 -5.351 -3.584 4.783 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -6.245 -1.865 7.134 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.329 -2.816 6.138 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.167 -4.886 6.817 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -5.035 -3.952 7.775 1.00 10.00 H new ATOM 1141 N VAL A 90 -6.720 -1.793 3.575 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.223 -0.797 2.643 1.00 10.00 C ATOM 1143 C VAL A 90 -8.732 -0.959 2.457 1.00 10.00 C ATOM 1144 O VAL A 90 -9.225 -2.065 2.230 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.502 -0.884 1.273 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -6.652 -2.271 0.659 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -7.014 0.185 0.321 1.00 10.00 C ATOM 0 H VAL A 90 -7.174 -2.703 3.502 1.00 10.00 H new ATOM 0 HA VAL A 90 -7.019 0.187 3.066 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.440 -0.706 1.445 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.136 -2.302 -0.301 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.218 -3.014 1.328 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -7.709 -2.491 0.510 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.493 0.103 -0.633 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.084 0.049 0.163 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.833 1.171 0.750 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.465 0.141 2.592 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.915 0.119 2.441 1.00 10.00 C ATOM 1159 C TYR A 91 -11.383 1.320 1.635 1.00 10.00 C ATOM 1160 O TYR A 91 -10.605 2.231 1.366 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.591 0.106 3.812 1.00 10.00 C ATOM 1162 CG TYR A 91 -11.244 -1.115 4.633 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -11.825 -2.345 4.354 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -10.321 -1.043 5.667 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -11.497 -3.469 5.086 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -9.990 -2.162 6.405 1.00 10.00 C ATOM 1167 CZ TYR A 91 -10.580 -3.373 6.108 1.00 10.00 C ATOM 1168 OH TYR A 91 -10.248 -4.493 6.833 1.00 10.00 O ATOM 0 H TYR A 91 -9.078 1.060 2.806 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.193 -0.789 1.905 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -11.300 1.001 4.362 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.672 0.151 3.678 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -12.544 -2.424 3.552 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -9.854 -0.097 5.898 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -11.958 -4.419 4.858 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -9.274 -2.090 7.210 1.00 10.00 H new ATOM 0 HH TYR A 91 -9.493 -4.289 7.424 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.653 1.325 1.262 1.00 10.00 N ATOM 1179 CA GLN A 92 -13.212 2.418 0.480 1.00 10.00 C ATOM 1180 C GLN A 92 -13.694 3.538 1.394 1.00 10.00 C ATOM 1181 O GLN A 92 -14.264 3.281 2.456 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.374 1.913 -0.381 1.00 10.00 C ATOM 1183 CG GLN A 92 -14.871 2.924 -1.400 1.00 10.00 C ATOM 1184 CD GLN A 92 -16.345 2.754 -1.713 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -16.721 1.981 -2.594 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -17.191 3.480 -0.996 1.00 10.00 N ATOM 0 H GLN A 92 -13.317 0.584 1.488 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.430 2.809 -0.171 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -14.060 1.010 -0.904 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -15.201 1.633 0.271 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -14.697 3.932 -1.023 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -14.293 2.823 -2.319 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -16.839 4.109 -0.275 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -18.194 3.409 -1.166 1.00 10.00 H new ATOM 1195 N GLU A 93 -13.452 4.776 0.986 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.882 5.933 1.760 1.00 10.00 C ATOM 1197 C GLU A 93 -15.391 6.113 1.635 1.00 10.00 C ATOM 1198 O GLU A 93 -16.029 5.486 0.785 1.00 10.00 O ATOM 1199 CB GLU A 93 -13.160 7.198 1.282 1.00 10.00 C ATOM 1200 CG GLU A 93 -11.668 7.208 1.586 1.00 10.00 C ATOM 1201 CD GLU A 93 -11.344 7.701 2.986 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -12.242 7.689 3.853 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -10.185 8.098 3.225 1.00 10.00 O ATOM 0 H GLU A 93 -12.960 5.005 0.123 1.00 10.00 H new ATOM 0 HA GLU A 93 -13.629 5.764 2.807 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -13.303 7.302 0.206 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -13.622 8.067 1.750 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -11.272 6.200 1.462 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -11.160 7.841 0.859 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.956 6.977 2.469 1.00 10.00 N ATOM 1211 CA GLN A 94 -17.392 7.237 2.465 1.00 10.00 C ATOM 1212 C GLN A 94 -17.843 7.870 1.148 1.00 10.00 C ATOM 1213 O GLN A 94 -18.931 7.582 0.646 1.00 10.00 O ATOM 1214 CB GLN A 94 -17.756 8.153 3.635 1.00 10.00 C ATOM 1215 CG GLN A 94 -19.251 8.312 3.850 1.00 10.00 C ATOM 1216 CD GLN A 94 -19.584 9.545 4.664 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -19.803 10.624 4.114 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -19.619 9.396 5.977 1.00 10.00 N ATOM 0 H GLN A 94 -15.437 7.515 3.163 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.908 6.283 2.572 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -17.308 7.757 4.546 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -17.317 9.136 3.464 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -19.751 8.371 2.883 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -19.639 7.428 4.357 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -19.431 8.483 6.392 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -19.834 10.194 6.575 1.00 10.00 H new ATOM 1227 N THR A 95 -17.000 8.722 0.588 1.00 10.00 N ATOM 1228 CA THR A 95 -17.318 9.396 -0.660 1.00 10.00 C ATOM 1229 C THR A 95 -17.175 8.450 -1.850 1.00 10.00 C ATOM 1230 O THR A 95 -17.841 8.613 -2.875 1.00 10.00 O ATOM 1231 CB THR A 95 -16.403 10.612 -0.865 1.00 10.00 C ATOM 1232 OG1 THR A 95 -15.046 10.238 -0.596 1.00 10.00 O ATOM 1233 CG2 THR A 95 -16.813 11.750 0.053 1.00 10.00 C ATOM 0 H THR A 95 -16.089 8.963 0.978 1.00 10.00 H new ATOM 0 HA THR A 95 -18.354 9.728 -0.598 1.00 10.00 H new ATOM 0 HB THR A 95 -16.493 10.950 -1.897 1.00 10.00 H new ATOM 0 HG1 THR A 95 -14.461 11.013 -0.728 1.00 10.00 H new ATOM 0 HG21 THR A 95 -16.153 12.602 -0.107 1.00 10.00 H new ATOM 0 HG22 THR A 95 -17.841 12.041 -0.165 1.00 10.00 H new ATOM 0 HG23 THR A 95 -16.740 11.425 1.091 1.00 10.00 H new ATOM 1241 N GLY A 96 -16.301 7.457 -1.704 1.00 10.00 N ATOM 1242 CA GLY A 96 -16.069 6.504 -2.774 1.00 10.00 C ATOM 1243 C GLY A 96 -15.114 7.054 -3.812 1.00 10.00 C ATOM 1244 O GLY A 96 -14.896 6.445 -4.858 1.00 10.00 O ATOM 0 H GLY A 96 -15.749 7.296 -0.862 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -15.664 5.581 -2.359 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -17.017 6.251 -3.249 1.00 10.00 H new ATOM 1248 N GLY A 97 -14.544 8.211 -3.508 1.00 10.00 N ATOM 1249 CA GLY A 97 -13.619 8.857 -4.409 1.00 10.00 C ATOM 1250 C GLY A 97 -13.454 10.316 -4.053 1.00 10.00 C ATOM 1251 O GLY A 97 -13.179 11.131 -4.953 1.00 10.00 O ATOM 0 H GLY A 97 -14.711 8.718 -2.639 1.00 10.00 H new ATOM 0 HA2 GLY A 97 -12.652 8.356 -4.366 1.00 10.00 H new ATOM 0 HA3 GLY A 97 -13.979 8.767 -5.434 1.00 10.00 H new TER 1255 GLY A 97 ATOM 1256 N ASN B 357 -4.695 -19.757 -1.925 1.00 10.00 N ATOM 1257 CA ASN B 357 -3.540 -18.846 -2.075 1.00 10.00 C ATOM 1258 C ASN B 357 -3.954 -17.599 -2.840 1.00 10.00 C ATOM 1259 O ASN B 357 -4.672 -17.678 -3.837 1.00 10.00 O ATOM 1260 CB ASN B 357 -2.383 -19.539 -2.803 1.00 10.00 C ATOM 1261 CG ASN B 357 -2.761 -20.034 -4.189 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -3.844 -20.588 -4.392 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -1.880 -19.831 -5.154 1.00 10.00 N ATOM 0 HA ASN B 357 -3.201 -18.564 -1.078 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -1.547 -18.845 -2.887 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -2.038 -20.382 -2.204 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -2.086 -20.136 -6.105 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -0.994 -19.369 -4.947 1.00 10.00 H new ATOM 1272 N ASN B 358 -3.508 -16.451 -2.364 1.00 10.00 N ATOM 1273 CA ASN B 358 -3.834 -15.176 -2.989 1.00 10.00 C ATOM 1274 C ASN B 358 -2.687 -14.190 -2.833 1.00 10.00 C ATOM 1275 O ASN B 358 -2.892 -13.026 -2.486 1.00 10.00 O ATOM 1276 CB ASN B 358 -5.129 -14.600 -2.397 1.00 10.00 C ATOM 1277 CG ASN B 358 -5.212 -14.722 -0.881 1.00 10.00 C ATOM 1278 OD1 ASN B 358 -4.202 -14.689 -0.177 1.00 10.00 O ATOM 1279 ND2 ASN B 358 -6.424 -14.866 -0.370 1.00 10.00 N ATOM 0 H ASN B 358 -2.913 -16.373 -1.539 1.00 10.00 H new ATOM 0 HA ASN B 358 -3.991 -15.348 -4.054 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -5.209 -13.549 -2.674 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -5.982 -15.113 -2.842 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -6.545 -14.954 0.639 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -7.237 -14.889 -0.985 1.00 10.00 H new ATOM 1286 N ARG B 359 -1.477 -14.666 -3.100 1.00 10.00 N ATOM 1287 CA ARG B 359 -0.287 -13.834 -3.000 1.00 10.00 C ATOM 1288 C ARG B 359 0.109 -13.305 -4.372 1.00 10.00 C ATOM 1289 O ARG B 359 0.399 -14.081 -5.284 1.00 10.00 O ATOM 1290 CB ARG B 359 0.876 -14.627 -2.403 1.00 10.00 C ATOM 1291 CG ARG B 359 0.659 -15.041 -0.961 1.00 10.00 C ATOM 1292 CD ARG B 359 1.810 -15.885 -0.445 1.00 10.00 C ATOM 1293 NE ARG B 359 1.540 -16.417 0.887 1.00 10.00 N ATOM 1294 CZ ARG B 359 2.188 -17.455 1.413 1.00 10.00 C ATOM 1295 NH1 ARG B 359 3.127 -18.080 0.712 1.00 10.00 N ATOM 1296 NH2 ARG B 359 1.893 -17.871 2.639 1.00 10.00 N ATOM 0 H ARG B 359 -1.295 -15.627 -3.388 1.00 10.00 H new ATOM 0 HA ARG B 359 -0.517 -12.994 -2.345 1.00 10.00 H new ATOM 0 HB2 ARG B 359 1.042 -15.520 -3.006 1.00 10.00 H new ATOM 0 HB3 ARG B 359 1.783 -14.026 -2.466 1.00 10.00 H new ATOM 0 HG2 ARG B 359 0.550 -14.153 -0.339 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -0.271 -15.603 -0.879 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.994 -16.709 -1.135 1.00 10.00 H new ATOM 0 HD3 ARG B 359 2.718 -15.283 -0.418 1.00 10.00 H new ATOM 0 HE ARG B 359 0.814 -15.969 1.446 1.00 10.00 H new ATOM 0 HH11 ARG B 359 3.353 -17.765 -0.231 1.00 10.00 H new ATOM 0 HH12 ARG B 359 3.622 -18.875 1.117 1.00 10.00 H new ATOM 0 HH21 ARG B 359 1.170 -17.396 3.179 1.00 10.00 H new ATOM 0 HH22 ARG B 359 2.390 -18.666 3.041 1.00 10.00 H new ATOM 1310 N ASP B 360 0.117 -11.992 -4.522 1.00 10.00 N ATOM 1311 CA ASP B 360 0.471 -11.387 -5.797 1.00 10.00 C ATOM 1312 C ASP B 360 1.520 -10.299 -5.621 1.00 10.00 C ATOM 1313 O ASP B 360 1.219 -9.213 -5.128 1.00 10.00 O ATOM 1314 CB ASP B 360 -0.775 -10.821 -6.475 1.00 10.00 C ATOM 1315 CG ASP B 360 -0.660 -10.816 -7.986 1.00 10.00 C ATOM 1316 OD1 ASP B 360 -0.849 -9.746 -8.595 1.00 10.00 O ATOM 1317 OD2 ASP B 360 -0.391 -11.891 -8.570 1.00 10.00 O ATOM 0 H ASP B 360 -0.115 -11.327 -3.784 1.00 10.00 H new ATOM 0 HA ASP B 360 0.899 -12.163 -6.432 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -1.644 -11.410 -6.182 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -0.946 -9.804 -6.123 1.00 10.00 H new ATOM 1322 N PRO B 361 2.778 -10.597 -5.985 1.00 10.00 N ATOM 1323 CA PRO B 361 3.884 -9.640 -5.880 1.00 10.00 C ATOM 1324 C PRO B 361 3.774 -8.511 -6.905 1.00 10.00 C ATOM 1325 O PRO B 361 3.963 -8.723 -8.106 1.00 10.00 O ATOM 1326 CB PRO B 361 5.135 -10.486 -6.162 1.00 10.00 C ATOM 1327 CG PRO B 361 4.684 -11.907 -6.112 1.00 10.00 C ATOM 1328 CD PRO B 361 3.234 -11.897 -6.494 1.00 10.00 C ATOM 0 HA PRO B 361 3.897 -9.151 -4.906 1.00 10.00 H new ATOM 0 HB2 PRO B 361 5.559 -10.244 -7.137 1.00 10.00 H new ATOM 0 HB3 PRO B 361 5.911 -10.296 -5.421 1.00 10.00 H new ATOM 0 HG2 PRO B 361 5.264 -12.524 -6.799 1.00 10.00 H new ATOM 0 HG3 PRO B 361 4.821 -12.325 -5.115 1.00 10.00 H new ATOM 0 HD2 PRO B 361 3.098 -11.980 -7.572 1.00 10.00 H new ATOM 0 HD3 PRO B 361 2.689 -12.724 -6.039 1.00 10.00 H new ATOM 1336 N ILE B 362 3.480 -7.312 -6.423 1.00 10.00 N ATOM 1337 CA ILE B 362 3.347 -6.152 -7.293 1.00 10.00 C ATOM 1338 C ILE B 362 4.650 -5.371 -7.369 1.00 10.00 C ATOM 1339 O ILE B 362 5.215 -4.993 -6.344 1.00 10.00 O ATOM 1340 CB ILE B 362 2.233 -5.204 -6.812 1.00 10.00 C ATOM 1341 CG1 ILE B 362 0.956 -5.987 -6.506 1.00 10.00 C ATOM 1342 CG2 ILE B 362 1.962 -4.128 -7.858 1.00 10.00 C ATOM 1343 CD1 ILE B 362 -0.148 -5.134 -5.924 1.00 10.00 C ATOM 0 H ILE B 362 3.329 -7.117 -5.433 1.00 10.00 H new ATOM 0 HA ILE B 362 3.089 -6.534 -8.281 1.00 10.00 H new ATOM 0 HB ILE B 362 2.566 -4.719 -5.894 1.00 10.00 H new ATOM 0 HG12 ILE B 362 0.598 -6.455 -7.423 1.00 10.00 H new ATOM 0 HG13 ILE B 362 1.190 -6.791 -5.808 1.00 10.00 H new ATOM 0 HG21 ILE B 362 1.172 -3.466 -7.503 1.00 10.00 H new ATOM 0 HG22 ILE B 362 2.870 -3.550 -8.029 1.00 10.00 H new ATOM 0 HG23 ILE B 362 1.650 -4.598 -8.791 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -1.024 -5.754 -5.731 1.00 10.00 H new ATOM 0 HD12 ILE B 362 0.192 -4.686 -4.990 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -0.410 -4.346 -6.630 1.00 10.00 H new ATOM 1355 N VAL B 363 5.123 -5.141 -8.588 1.00 10.00 N ATOM 1356 CA VAL B 363 6.356 -4.398 -8.810 1.00 10.00 C ATOM 1357 C VAL B 363 6.104 -3.225 -9.755 1.00 10.00 C ATOM 1358 O VAL B 363 5.532 -3.399 -10.833 1.00 10.00 O ATOM 1359 CB VAL B 363 7.466 -5.290 -9.411 1.00 10.00 C ATOM 1360 CG1 VAL B 363 8.812 -4.581 -9.352 1.00 10.00 C ATOM 1361 CG2 VAL B 363 7.537 -6.633 -8.698 1.00 10.00 C ATOM 0 H VAL B 363 4.667 -5.461 -9.443 1.00 10.00 H new ATOM 0 HA VAL B 363 6.689 -4.035 -7.838 1.00 10.00 H new ATOM 0 HB VAL B 363 7.218 -5.477 -10.456 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.581 -5.224 -9.779 1.00 10.00 H new ATOM 0 HG12 VAL B 363 8.759 -3.652 -9.920 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.061 -4.358 -8.314 1.00 10.00 H new ATOM 0 HG21 VAL B 363 8.327 -7.239 -9.142 1.00 10.00 H new ATOM 0 HG22 VAL B 363 7.753 -6.473 -7.642 1.00 10.00 H new ATOM 0 HG23 VAL B 363 6.583 -7.150 -8.799 1.00 10.00 H new ATOM 1371 N ILE B 364 6.515 -2.034 -9.341 1.00 10.00 N ATOM 1372 CA ILE B 364 6.340 -0.833 -10.149 1.00 10.00 C ATOM 1373 C ILE B 364 7.677 -0.121 -10.328 1.00 10.00 C ATOM 1374 O ILE B 364 8.676 -0.508 -9.720 1.00 10.00 O ATOM 1375 CB ILE B 364 5.322 0.143 -9.513 1.00 10.00 C ATOM 1376 CG1 ILE B 364 5.832 0.651 -8.159 1.00 10.00 C ATOM 1377 CG2 ILE B 364 3.965 -0.529 -9.351 1.00 10.00 C ATOM 1378 CD1 ILE B 364 5.924 2.160 -8.077 1.00 10.00 C ATOM 0 H ILE B 364 6.975 -1.873 -8.445 1.00 10.00 H new ATOM 0 HA ILE B 364 5.953 -1.146 -11.119 1.00 10.00 H new ATOM 0 HB ILE B 364 5.207 0.997 -10.180 1.00 10.00 H new ATOM 0 HG12 ILE B 364 5.169 0.292 -7.372 1.00 10.00 H new ATOM 0 HG13 ILE B 364 6.816 0.224 -7.967 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.263 0.173 -8.902 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.594 -0.839 -10.328 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.066 -1.403 -8.707 1.00 10.00 H new ATOM 0 HD11 ILE B 364 6.292 2.449 -7.092 1.00 10.00 H new ATOM 0 HD12 ILE B 364 6.610 2.525 -8.842 1.00 10.00 H new ATOM 0 HD13 ILE B 364 4.937 2.594 -8.238 1.00 10.00 H new ATOM 1390 N SER B 365 7.697 0.909 -11.161 1.00 10.00 N ATOM 1391 CA SER B 365 8.914 1.666 -11.408 1.00 10.00 C ATOM 1392 C SER B 365 8.596 3.127 -11.723 1.00 10.00 C ATOM 1393 O SER B 365 7.953 3.432 -12.730 1.00 10.00 O ATOM 1394 CB SER B 365 9.701 1.030 -12.558 1.00 10.00 C ATOM 1395 OG SER B 365 8.828 0.506 -13.546 1.00 10.00 O ATOM 0 H SER B 365 6.882 1.240 -11.678 1.00 10.00 H new ATOM 0 HA SER B 365 9.524 1.643 -10.505 1.00 10.00 H new ATOM 0 HB2 SER B 365 10.359 1.774 -13.007 1.00 10.00 H new ATOM 0 HB3 SER B 365 10.337 0.234 -12.171 1.00 10.00 H new ATOM 0 HG SER B 365 9.355 0.107 -14.270 1.00 10.00 H new ATOM 1401 N ASP B 366 9.052 4.024 -10.861 1.00 10.00 N ATOM 1402 CA ASP B 366 8.818 5.451 -11.050 1.00 10.00 C ATOM 1403 C ASP B 366 9.821 6.020 -12.052 1.00 10.00 C ATOM 1404 O ASP B 366 10.801 5.363 -12.403 1.00 10.00 O ATOM 1405 CB ASP B 366 8.928 6.195 -9.713 1.00 10.00 C ATOM 1406 CG ASP B 366 8.313 7.584 -9.761 1.00 10.00 C ATOM 1407 OD1 ASP B 366 8.490 8.350 -8.795 1.00 10.00 O ATOM 1408 OD2 ASP B 366 7.651 7.918 -10.768 1.00 10.00 O ATOM 0 H ASP B 366 9.586 3.791 -10.024 1.00 10.00 H new ATOM 0 HA ASP B 366 7.810 5.588 -11.442 1.00 10.00 H new ATOM 0 HB2 ASP B 366 8.435 5.611 -8.936 1.00 10.00 H new ATOM 0 HB3 ASP B 366 9.978 6.277 -9.433 1.00 10.00 H new ATOM 1413 N SER B 367 9.565 7.231 -12.519 1.00 10.00 N ATOM 1414 CA SER B 367 10.440 7.884 -13.479 1.00 10.00 C ATOM 1415 C SER B 367 10.584 9.367 -13.140 1.00 10.00 C ATOM 1416 O SER B 367 9.684 10.166 -13.413 1.00 10.00 O ATOM 1417 CB SER B 367 9.892 7.702 -14.898 1.00 10.00 C ATOM 1418 OG SER B 367 9.535 6.349 -15.129 1.00 10.00 O ATOM 0 H SER B 367 8.753 7.785 -12.247 1.00 10.00 H new ATOM 0 HA SER B 367 11.427 7.425 -13.429 1.00 10.00 H new ATOM 0 HB2 SER B 367 9.022 8.342 -15.042 1.00 10.00 H new ATOM 0 HB3 SER B 367 10.641 8.015 -15.625 1.00 10.00 H new ATOM 0 HG SER B 367 9.186 6.254 -16.040 1.00 10.00 H new ATOM 1424 N PRO B 368 11.703 9.746 -12.501 1.00 10.00 N ATOM 1425 CA PRO B 368 11.969 11.136 -12.120 1.00 10.00 C ATOM 1426 C PRO B 368 12.261 12.017 -13.328 1.00 10.00 C ATOM 1427 O PRO B 368 12.696 11.479 -14.367 1.00 10.00 O ATOM 1428 CB PRO B 368 13.208 11.046 -11.215 1.00 10.00 C ATOM 1429 CG PRO B 368 13.397 9.595 -10.927 1.00 10.00 C ATOM 1430 CD PRO B 368 12.798 8.856 -12.088 1.00 10.00 C ATOM 1431 OXT PRO B 368 12.057 13.245 -13.229 1.00 10.00 O ATOM 0 HA PRO B 368 11.107 11.589 -11.630 1.00 10.00 H new ATOM 0 HB2 PRO B 368 14.085 11.464 -11.710 1.00 10.00 H new ATOM 0 HB3 PRO B 368 13.062 11.611 -10.295 1.00 10.00 H new ATOM 0 HG2 PRO B 368 14.454 9.355 -10.816 1.00 10.00 H new ATOM 0 HG3 PRO B 368 12.907 9.316 -9.994 1.00 10.00 H new ATOM 0 HD2 PRO B 368 13.521 8.704 -12.889 1.00 10.00 H new ATOM 0 HD3 PRO B 368 12.433 7.871 -11.797 1.00 10.00 H new TER 1439 PRO B 368