USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 898 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 54 ASN : amide:sc= -0.0574 X(o=-0.13,f=-0.018) USER MOD Set 1.2: A 84 SER OG : rot 160:sc= -0.0758 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0328) USER MOD Single : A 6 THR OG1 : rot 150:sc= -0.448 USER MOD Single : A 12 HIS : no HD1:sc= -1.68 K(o=-1.7,f=-3) USER MOD Single : A 16 THR OG1 : rot -96:sc= 0.962 USER MOD Single : A 17 THR OG1 : rot 98:sc= 1.28 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.637) USER MOD Single : A 28 GLN : amide:sc= -0.221 X(o=-0.22,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.0192 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot -58:sc= 0.274 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HE2:sc= -0.127 K(o=-0.13,f=-1.1) USER MOD Single : A 62 TYR OH : rot -151:sc= 0.536 USER MOD Single : A 64 THR OG1 : rot 100:sc= 1.25 USER MOD Single : A 75 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0572) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 27:sc= 0.672 USER MOD Single : A 95 SER OG : rot 180:sc= 0.0765 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0.432 X(o=0.43,f=0) USER MOD Single : A 111 ASN : amide:sc= -0.0362 X(o=-0.036,f=-0.31) USER MOD Single : A 115 TYR OH : rot 180:sc= -1.27 USER MOD Single : A 116 CYS SG : rot 90:sc= -0.538 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 4 -9.568 -19.500 -12.797 1.00 0.00 N ATOM 2 CA TYR A 4 -9.625 -18.042 -12.972 1.00 0.00 C ATOM 3 C TYR A 4 -8.843 -17.393 -11.821 1.00 0.00 C ATOM 4 O TYR A 4 -8.706 -17.969 -10.739 1.00 0.00 O ATOM 5 CB TYR A 4 -11.109 -17.625 -12.980 1.00 0.00 C ATOM 6 CG TYR A 4 -11.423 -16.602 -14.059 1.00 0.00 C ATOM 7 CD1 TYR A 4 -11.564 -17.009 -15.352 1.00 0.00 C ATOM 8 CD2 TYR A 4 -11.580 -15.288 -13.745 1.00 0.00 C ATOM 9 CE1 TYR A 4 -11.851 -16.105 -16.325 1.00 0.00 C ATOM 10 CE2 TYR A 4 -11.871 -14.388 -14.720 1.00 0.00 C ATOM 11 CZ TYR A 4 -12.005 -14.792 -16.008 1.00 0.00 C ATOM 12 OH TYR A 4 -12.278 -13.877 -16.990 1.00 0.00 O ATOM 0 HA TYR A 4 -9.175 -17.717 -13.910 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -11.730 -18.508 -13.130 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -11.372 -17.212 -12.006 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -11.447 -18.053 -15.604 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -11.473 -14.960 -12.721 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -11.957 -16.429 -17.350 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -11.996 -13.345 -14.468 1.00 0.00 H new ATOM 0 HH TYR A 4 -12.359 -12.985 -16.593 1.00 0.00 H new ATOM 22 N LYS A 5 -8.391 -16.159 -12.018 1.00 0.00 N ATOM 23 CA LYS A 5 -7.819 -15.384 -10.920 1.00 0.00 C ATOM 24 C LYS A 5 -8.765 -14.274 -10.453 1.00 0.00 C ATOM 25 O LYS A 5 -9.413 -13.584 -11.242 1.00 0.00 O ATOM 26 CB LYS A 5 -6.518 -14.770 -11.443 1.00 0.00 C ATOM 27 CG LYS A 5 -5.358 -15.773 -11.463 1.00 0.00 C ATOM 28 CD LYS A 5 -4.054 -15.105 -11.909 1.00 0.00 C ATOM 29 CE LYS A 5 -2.866 -16.074 -11.898 1.00 0.00 C ATOM 30 NZ LYS A 5 -3.022 -17.131 -12.910 1.00 0.00 N ATOM 0 H LYS A 5 -8.408 -15.677 -12.917 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.645 -16.032 -10.061 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.680 -14.388 -12.451 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -6.246 -13.918 -10.819 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.228 -16.202 -10.470 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -5.597 -16.596 -12.137 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.181 -14.702 -12.914 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.838 -14.262 -11.252 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -1.944 -15.523 -12.085 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.773 -16.526 -10.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.151 -17.697 -12.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -3.821 -17.745 -12.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.205 -16.699 -13.838 1.00 0.00 H new ATOM 44 N THR A 6 -8.771 -14.078 -9.139 1.00 0.00 N ATOM 45 CA THR A 6 -9.419 -12.908 -8.528 1.00 0.00 C ATOM 46 C THR A 6 -8.313 -11.927 -8.145 1.00 0.00 C ATOM 47 O THR A 6 -7.385 -12.306 -7.432 1.00 0.00 O ATOM 48 CB THR A 6 -10.276 -13.288 -7.308 1.00 0.00 C ATOM 49 OG1 THR A 6 -11.057 -12.167 -6.930 1.00 0.00 O ATOM 50 CG2 THR A 6 -9.496 -13.768 -6.085 1.00 0.00 C ATOM 0 H THR A 6 -8.335 -14.712 -8.470 1.00 0.00 H new ATOM 0 HA THR A 6 -10.108 -12.454 -9.240 1.00 0.00 H new ATOM 0 HB THR A 6 -10.881 -14.136 -7.629 1.00 0.00 H new ATOM 0 HG1 THR A 6 -11.897 -12.474 -6.528 1.00 0.00 H new ATOM 0 HG21 THR A 6 -10.192 -14.010 -5.282 1.00 0.00 H new ATOM 0 HG22 THR A 6 -8.920 -14.656 -6.346 1.00 0.00 H new ATOM 0 HG23 THR A 6 -8.819 -12.981 -5.753 1.00 0.00 H new ATOM 58 N GLY A 7 -8.331 -10.708 -8.674 1.00 0.00 N ATOM 59 CA GLY A 7 -7.332 -9.736 -8.220 1.00 0.00 C ATOM 60 C GLY A 7 -7.937 -8.411 -7.781 1.00 0.00 C ATOM 61 O GLY A 7 -9.093 -8.308 -7.373 1.00 0.00 O ATOM 0 H GLY A 7 -8.987 -10.377 -9.381 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.770 -10.164 -7.390 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.621 -9.553 -9.025 1.00 0.00 H new ATOM 65 N LEU A 8 -7.074 -7.406 -7.780 1.00 0.00 N ATOM 66 CA LEU A 8 -7.410 -6.108 -7.197 1.00 0.00 C ATOM 67 C LEU A 8 -6.954 -5.057 -8.203 1.00 0.00 C ATOM 68 O LEU A 8 -5.927 -5.222 -8.867 1.00 0.00 O ATOM 69 CB LEU A 8 -6.588 -5.949 -5.913 1.00 0.00 C ATOM 70 CG LEU A 8 -7.331 -5.354 -4.723 1.00 0.00 C ATOM 71 CD1 LEU A 8 -6.283 -5.200 -3.618 1.00 0.00 C ATOM 72 CD2 LEU A 8 -7.995 -4.011 -5.037 1.00 0.00 C ATOM 0 H LEU A 8 -6.135 -7.461 -8.175 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.473 -6.013 -6.976 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.204 -6.928 -5.626 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.725 -5.319 -6.131 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.152 -6.008 -4.429 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.751 -4.776 -2.730 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.863 -6.176 -3.376 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.488 -4.538 -3.961 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -8.507 -3.642 -4.148 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -7.235 -3.292 -5.343 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.717 -4.142 -5.843 1.00 0.00 H new ATOM 84 N LEU A 9 -7.697 -3.968 -8.325 1.00 0.00 N ATOM 85 CA LEU A 9 -7.222 -2.868 -9.148 1.00 0.00 C ATOM 86 C LEU A 9 -7.232 -1.644 -8.223 1.00 0.00 C ATOM 87 O LEU A 9 -8.229 -1.331 -7.571 1.00 0.00 O ATOM 88 CB LEU A 9 -8.191 -2.891 -10.335 1.00 0.00 C ATOM 89 CG LEU A 9 -7.907 -1.994 -11.539 1.00 0.00 C ATOM 90 CD1 LEU A 9 -9.175 -1.187 -11.757 1.00 0.00 C ATOM 91 CD2 LEU A 9 -6.727 -1.040 -11.390 1.00 0.00 C ATOM 0 H LEU A 9 -8.603 -3.823 -7.880 1.00 0.00 H new ATOM 0 HA LEU A 9 -6.213 -2.895 -9.560 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -8.246 -3.918 -10.695 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.180 -2.632 -9.958 1.00 0.00 H new ATOM 0 HG LEU A 9 -7.629 -2.636 -12.375 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -9.040 -0.520 -12.609 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -10.007 -1.863 -11.954 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -9.389 -0.598 -10.865 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -6.617 -0.453 -12.302 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -6.903 -0.372 -10.547 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -5.816 -1.612 -11.215 1.00 0.00 H new ATOM 103 N LEU A 10 -6.105 -0.942 -8.195 1.00 0.00 N ATOM 104 CA LEU A 10 -5.990 0.292 -7.403 1.00 0.00 C ATOM 105 C LEU A 10 -5.872 1.457 -8.381 1.00 0.00 C ATOM 106 O LEU A 10 -4.965 1.504 -9.206 1.00 0.00 O ATOM 107 CB LEU A 10 -4.794 0.297 -6.422 1.00 0.00 C ATOM 108 CG LEU A 10 -5.238 0.185 -4.964 1.00 0.00 C ATOM 109 CD1 LEU A 10 -4.145 -0.432 -4.094 1.00 0.00 C ATOM 110 CD2 LEU A 10 -5.592 1.575 -4.425 1.00 0.00 C ATOM 0 H LEU A 10 -5.260 -1.198 -8.705 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.878 0.375 -6.776 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.128 -0.532 -6.661 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.222 1.215 -6.555 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.112 -0.465 -4.927 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.494 -0.497 -3.063 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.909 -1.431 -4.461 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.252 0.191 -4.136 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.908 1.492 -3.385 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.718 2.223 -4.488 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -6.402 2.000 -5.018 1.00 0.00 H new ATOM 122 N ILE A 11 -6.817 2.385 -8.303 1.00 0.00 N ATOM 123 CA ILE A 11 -6.831 3.522 -9.239 1.00 0.00 C ATOM 124 C ILE A 11 -6.831 4.822 -8.428 1.00 0.00 C ATOM 125 O ILE A 11 -7.554 4.964 -7.442 1.00 0.00 O ATOM 126 CB ILE A 11 -8.066 3.449 -10.175 1.00 0.00 C ATOM 127 CG1 ILE A 11 -9.323 2.880 -9.490 1.00 0.00 C ATOM 128 CG2 ILE A 11 -7.743 2.623 -11.423 1.00 0.00 C ATOM 129 CD1 ILE A 11 -10.574 2.937 -10.368 1.00 0.00 C ATOM 0 H ILE A 11 -7.573 2.383 -7.619 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.944 3.489 -9.872 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.294 4.478 -10.453 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -9.135 1.845 -9.206 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -9.509 3.435 -8.570 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.620 2.582 -12.069 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -6.917 3.086 -11.962 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.462 1.612 -11.128 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -11.421 2.520 -9.823 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.787 3.973 -10.631 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -10.407 2.358 -11.277 1.00 0.00 H new ATOM 141 N HIS A 12 -6.067 5.808 -8.894 1.00 0.00 N ATOM 142 CA HIS A 12 -6.141 7.155 -8.324 1.00 0.00 C ATOM 143 C HIS A 12 -7.079 7.961 -9.247 1.00 0.00 C ATOM 144 O HIS A 12 -6.889 7.945 -10.464 1.00 0.00 O ATOM 145 CB HIS A 12 -4.714 7.723 -8.305 1.00 0.00 C ATOM 146 CG HIS A 12 -4.626 9.246 -8.320 1.00 0.00 C ATOM 147 ND1 HIS A 12 -5.150 10.099 -7.357 1.00 0.00 N ATOM 148 CD2 HIS A 12 -4.066 9.968 -9.379 1.00 0.00 C ATOM 149 CE1 HIS A 12 -4.829 11.296 -7.948 1.00 0.00 C ATOM 150 NE2 HIS A 12 -4.170 11.323 -9.144 1.00 0.00 N ATOM 0 H HIS A 12 -5.397 5.704 -9.656 1.00 0.00 H new ATOM 0 HA HIS A 12 -6.529 7.184 -7.306 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -4.204 7.353 -7.416 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -4.173 7.334 -9.168 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -3.616 9.527 -10.256 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -5.099 12.223 -7.464 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -3.848 12.115 -9.701 1.00 0.00 H new ATOM 158 N PRO A 13 -8.087 8.671 -8.726 1.00 0.00 N ATOM 159 CA PRO A 13 -9.133 9.280 -9.559 1.00 0.00 C ATOM 160 C PRO A 13 -8.772 10.220 -10.715 1.00 0.00 C ATOM 161 O PRO A 13 -9.649 10.471 -11.545 1.00 0.00 O ATOM 162 CB PRO A 13 -9.884 10.096 -8.512 1.00 0.00 C ATOM 163 CG PRO A 13 -9.849 9.228 -7.261 1.00 0.00 C ATOM 164 CD PRO A 13 -8.452 8.609 -7.302 1.00 0.00 C ATOM 0 HA PRO A 13 -9.630 8.478 -10.105 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -9.405 11.060 -8.341 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -10.908 10.300 -8.826 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.001 9.818 -6.357 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.628 8.465 -7.278 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -7.748 9.166 -6.683 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -8.457 7.583 -6.934 1.00 0.00 H new ATOM 172 N ALA A 14 -7.589 10.833 -10.757 1.00 0.00 N ATOM 173 CA ALA A 14 -7.418 11.983 -11.674 1.00 0.00 C ATOM 174 C ALA A 14 -7.661 11.611 -13.138 1.00 0.00 C ATOM 175 O ALA A 14 -8.409 12.297 -13.835 1.00 0.00 O ATOM 176 CB ALA A 14 -6.053 12.642 -11.474 1.00 0.00 C ATOM 0 H ALA A 14 -6.770 10.579 -10.204 1.00 0.00 H new ATOM 0 HA ALA A 14 -8.185 12.713 -11.417 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.952 13.484 -12.159 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -5.967 12.997 -10.447 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.265 11.915 -11.673 1.00 0.00 H new ATOM 182 N VAL A 15 -7.021 10.554 -13.621 1.00 0.00 N ATOM 183 CA VAL A 15 -7.064 10.253 -15.063 1.00 0.00 C ATOM 184 C VAL A 15 -8.202 9.209 -15.230 1.00 0.00 C ATOM 185 O VAL A 15 -8.845 9.133 -16.277 1.00 0.00 O ATOM 186 CB VAL A 15 -5.690 9.819 -15.606 1.00 0.00 C ATOM 187 CG1 VAL A 15 -5.779 9.411 -17.079 1.00 0.00 C ATOM 188 CG2 VAL A 15 -4.694 10.980 -15.497 1.00 0.00 C ATOM 0 H VAL A 15 -6.476 9.900 -13.059 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.285 11.131 -15.670 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.358 8.967 -15.012 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.793 9.110 -17.433 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.473 8.577 -17.184 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.134 10.255 -17.670 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -3.725 10.665 -15.883 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.058 11.827 -16.078 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.591 11.274 -14.452 1.00 0.00 H new ATOM 198 N THR A 16 -8.436 8.394 -14.192 1.00 0.00 N ATOM 199 CA THR A 16 -9.332 7.238 -14.276 1.00 0.00 C ATOM 200 C THR A 16 -10.816 7.582 -14.013 1.00 0.00 C ATOM 201 O THR A 16 -11.659 6.693 -14.132 1.00 0.00 O ATOM 202 CB THR A 16 -8.853 6.211 -13.237 1.00 0.00 C ATOM 203 OG1 THR A 16 -8.890 6.777 -11.934 1.00 0.00 O ATOM 204 CG2 THR A 16 -7.434 5.709 -13.522 1.00 0.00 C ATOM 0 H THR A 16 -8.010 8.519 -13.274 1.00 0.00 H new ATOM 0 HA THR A 16 -9.291 6.851 -15.294 1.00 0.00 H new ATOM 0 HB THR A 16 -9.531 5.360 -13.300 1.00 0.00 H new ATOM 0 HG1 THR A 16 -8.003 7.125 -11.703 1.00 0.00 H new ATOM 0 HG21 THR A 16 -7.144 4.986 -12.759 1.00 0.00 H new ATOM 0 HG22 THR A 16 -7.406 5.233 -14.502 1.00 0.00 H new ATOM 0 HG23 THR A 16 -6.741 6.550 -13.507 1.00 0.00 H new ATOM 212 N THR A 17 -11.183 8.843 -13.739 1.00 0.00 N ATOM 213 CA THR A 17 -12.615 9.199 -13.706 1.00 0.00 C ATOM 214 C THR A 17 -13.232 9.335 -15.118 1.00 0.00 C ATOM 215 O THR A 17 -14.453 9.447 -15.247 1.00 0.00 O ATOM 216 CB THR A 17 -12.741 10.503 -12.894 1.00 0.00 C ATOM 217 OG1 THR A 17 -12.329 10.256 -11.556 1.00 0.00 O ATOM 218 CG2 THR A 17 -14.168 11.049 -12.846 1.00 0.00 C ATOM 0 H THR A 17 -10.539 9.609 -13.544 1.00 0.00 H new ATOM 0 HA THR A 17 -13.182 8.397 -13.233 1.00 0.00 H new ATOM 0 HB THR A 17 -12.114 11.243 -13.392 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.396 10.535 -11.444 1.00 0.00 H new ATOM 0 HG21 THR A 17 -14.187 11.967 -12.259 1.00 0.00 H new ATOM 0 HG22 THR A 17 -14.512 11.259 -13.859 1.00 0.00 H new ATOM 0 HG23 THR A 17 -14.825 10.311 -12.386 1.00 0.00 H new ATOM 226 N THR A 18 -12.434 9.230 -16.178 1.00 0.00 N ATOM 227 CA THR A 18 -13.001 9.083 -17.527 1.00 0.00 C ATOM 228 C THR A 18 -12.950 7.563 -17.863 1.00 0.00 C ATOM 229 O THR A 18 -12.285 6.801 -17.153 1.00 0.00 O ATOM 230 CB THR A 18 -12.021 9.954 -18.362 1.00 0.00 C ATOM 231 OG1 THR A 18 -12.005 11.273 -17.827 1.00 0.00 O ATOM 232 CG2 THR A 18 -12.279 10.109 -19.863 1.00 0.00 C ATOM 0 H THR A 18 -11.415 9.243 -16.138 1.00 0.00 H new ATOM 0 HA THR A 18 -14.033 9.394 -17.689 1.00 0.00 H new ATOM 0 HB THR A 18 -11.086 9.399 -18.282 1.00 0.00 H new ATOM 0 HG1 THR A 18 -11.388 11.829 -18.347 1.00 0.00 H new ATOM 0 HG21 THR A 18 -11.509 10.744 -20.301 1.00 0.00 H new ATOM 0 HG22 THR A 18 -12.255 9.129 -20.339 1.00 0.00 H new ATOM 0 HG23 THR A 18 -13.257 10.564 -20.019 1.00 0.00 H new ATOM 240 N PRO A 19 -13.602 7.055 -18.919 1.00 0.00 N ATOM 241 CA PRO A 19 -13.709 5.587 -19.097 1.00 0.00 C ATOM 242 C PRO A 19 -12.476 4.843 -19.637 1.00 0.00 C ATOM 243 O PRO A 19 -12.489 3.614 -19.698 1.00 0.00 O ATOM 244 CB PRO A 19 -14.940 5.393 -19.993 1.00 0.00 C ATOM 245 CG PRO A 19 -15.268 6.774 -20.545 1.00 0.00 C ATOM 246 CD PRO A 19 -14.796 7.722 -19.447 1.00 0.00 C ATOM 0 HA PRO A 19 -13.796 5.128 -18.112 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -14.731 4.689 -20.798 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -15.778 4.989 -19.425 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -14.752 6.962 -21.486 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -16.335 6.885 -20.739 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -14.563 8.711 -19.842 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -15.556 7.857 -18.677 1.00 0.00 H new ATOM 254 N GLU A 20 -11.445 5.542 -20.098 1.00 0.00 N ATOM 255 CA GLU A 20 -10.431 4.886 -20.945 1.00 0.00 C ATOM 256 C GLU A 20 -9.476 3.950 -20.191 1.00 0.00 C ATOM 257 O GLU A 20 -9.295 2.803 -20.604 1.00 0.00 O ATOM 258 CB GLU A 20 -9.612 5.944 -21.694 1.00 0.00 C ATOM 259 CG GLU A 20 -10.433 6.710 -22.740 1.00 0.00 C ATOM 260 CD GLU A 20 -9.588 7.775 -23.425 1.00 0.00 C ATOM 261 OE1 GLU A 20 -8.956 7.469 -24.460 1.00 0.00 O ATOM 262 OE2 GLU A 20 -9.552 8.925 -22.935 1.00 0.00 O ATOM 0 H GLU A 20 -11.283 6.532 -19.913 1.00 0.00 H new ATOM 0 HA GLU A 20 -10.993 4.257 -21.636 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -9.199 6.652 -20.975 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -8.768 5.461 -22.186 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -10.820 6.014 -23.484 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -11.294 7.176 -22.261 1.00 0.00 H new ATOM 269 N LEU A 21 -8.867 4.402 -19.093 1.00 0.00 N ATOM 270 CA LEU A 21 -7.937 3.528 -18.352 1.00 0.00 C ATOM 271 C LEU A 21 -8.666 2.369 -17.655 1.00 0.00 C ATOM 272 O LEU A 21 -8.115 1.273 -17.520 1.00 0.00 O ATOM 273 CB LEU A 21 -7.147 4.349 -17.320 1.00 0.00 C ATOM 274 CG LEU A 21 -5.956 5.130 -17.904 1.00 0.00 C ATOM 275 CD1 LEU A 21 -6.382 6.216 -18.897 1.00 0.00 C ATOM 276 CD2 LEU A 21 -5.167 5.769 -16.760 1.00 0.00 C ATOM 0 H LEU A 21 -8.990 5.336 -18.702 1.00 0.00 H new ATOM 0 HA LEU A 21 -7.249 3.095 -19.078 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -7.825 5.053 -16.838 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.780 3.677 -16.544 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.340 4.419 -18.454 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.498 6.731 -19.274 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -6.918 5.759 -19.729 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -7.033 6.932 -18.396 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.322 6.324 -17.167 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.815 6.449 -16.206 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.802 4.990 -16.091 1.00 0.00 H new ATOM 288 N VAL A 22 -9.908 2.599 -17.229 1.00 0.00 N ATOM 289 CA VAL A 22 -10.696 1.524 -16.602 1.00 0.00 C ATOM 290 C VAL A 22 -11.058 0.443 -17.636 1.00 0.00 C ATOM 291 O VAL A 22 -10.853 -0.743 -17.382 1.00 0.00 O ATOM 292 CB VAL A 22 -11.943 2.100 -15.901 1.00 0.00 C ATOM 293 CG1 VAL A 22 -12.741 1.000 -15.190 1.00 0.00 C ATOM 294 CG2 VAL A 22 -11.569 3.167 -14.862 1.00 0.00 C ATOM 0 H VAL A 22 -10.387 3.497 -17.301 1.00 0.00 H new ATOM 0 HA VAL A 22 -10.088 1.045 -15.834 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.551 2.552 -16.685 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.614 1.439 -14.706 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.065 0.257 -15.919 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.112 0.521 -14.439 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.474 3.548 -14.390 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.923 2.725 -14.103 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -11.044 3.986 -15.354 1.00 0.00 H new ATOM 304 N GLU A 23 -11.558 0.827 -18.811 1.00 0.00 N ATOM 305 CA GLU A 23 -11.839 -0.165 -19.866 1.00 0.00 C ATOM 306 C GLU A 23 -10.595 -0.935 -20.340 1.00 0.00 C ATOM 307 O GLU A 23 -10.698 -2.107 -20.693 1.00 0.00 O ATOM 308 CB GLU A 23 -12.472 0.531 -21.076 1.00 0.00 C ATOM 309 CG GLU A 23 -13.909 0.992 -20.809 1.00 0.00 C ATOM 310 CD GLU A 23 -14.496 1.693 -22.027 1.00 0.00 C ATOM 311 OE1 GLU A 23 -14.016 2.792 -22.380 1.00 0.00 O ATOM 312 OE2 GLU A 23 -15.442 1.149 -22.636 1.00 0.00 O ATOM 0 H GLU A 23 -11.775 1.792 -19.059 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.520 -0.891 -19.422 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -11.864 1.392 -21.353 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -12.466 -0.151 -21.926 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -14.527 0.133 -20.547 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -13.924 1.668 -19.954 1.00 0.00 H new ATOM 319 N ASN A 24 -9.430 -0.294 -20.362 1.00 0.00 N ATOM 320 CA ASN A 24 -8.194 -0.971 -20.792 1.00 0.00 C ATOM 321 C ASN A 24 -7.711 -2.025 -19.799 1.00 0.00 C ATOM 322 O ASN A 24 -7.380 -3.143 -20.194 1.00 0.00 O ATOM 323 CB ASN A 24 -7.103 0.087 -20.937 1.00 0.00 C ATOM 324 CG ASN A 24 -6.235 -0.115 -22.177 1.00 0.00 C ATOM 325 OD1 ASN A 24 -5.411 -1.025 -22.244 1.00 0.00 O ATOM 326 ND2 ASN A 24 -6.408 0.732 -23.177 1.00 0.00 N ATOM 0 H ASN A 24 -9.308 0.682 -20.092 1.00 0.00 H new ATOM 0 HA ASN A 24 -8.407 -1.483 -21.731 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.565 1.073 -20.981 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.469 0.071 -20.050 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.852 0.638 -24.027 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -7.098 1.479 -23.099 1.00 0.00 H new ATOM 333 N THR A 25 -7.656 -1.675 -18.513 1.00 0.00 N ATOM 334 CA THR A 25 -7.260 -2.684 -17.507 1.00 0.00 C ATOM 335 C THR A 25 -8.262 -3.857 -17.456 1.00 0.00 C ATOM 336 O THR A 25 -7.866 -5.024 -17.394 1.00 0.00 O ATOM 337 CB THR A 25 -6.971 -2.039 -16.141 1.00 0.00 C ATOM 338 OG1 THR A 25 -6.306 -2.987 -15.316 1.00 0.00 O ATOM 339 CG2 THR A 25 -8.205 -1.533 -15.390 1.00 0.00 C ATOM 0 H THR A 25 -7.868 -0.747 -18.146 1.00 0.00 H new ATOM 0 HA THR A 25 -6.314 -3.127 -17.819 1.00 0.00 H new ATOM 0 HB THR A 25 -6.360 -1.162 -16.353 1.00 0.00 H new ATOM 0 HG1 THR A 25 -6.116 -2.585 -14.443 1.00 0.00 H new ATOM 0 HG21 THR A 25 -7.899 -1.096 -14.440 1.00 0.00 H new ATOM 0 HG22 THR A 25 -8.712 -0.778 -15.990 1.00 0.00 H new ATOM 0 HG23 THR A 25 -8.884 -2.365 -15.204 1.00 0.00 H new ATOM 347 N LYS A 26 -9.557 -3.553 -17.565 1.00 0.00 N ATOM 348 CA LYS A 26 -10.568 -4.599 -17.757 1.00 0.00 C ATOM 349 C LYS A 26 -10.407 -5.356 -19.088 1.00 0.00 C ATOM 350 O LYS A 26 -10.716 -6.544 -19.135 1.00 0.00 O ATOM 351 CB LYS A 26 -11.971 -3.973 -17.685 1.00 0.00 C ATOM 352 CG LYS A 26 -12.285 -3.297 -16.341 1.00 0.00 C ATOM 353 CD LYS A 26 -12.300 -4.282 -15.173 1.00 0.00 C ATOM 354 CE LYS A 26 -12.741 -3.586 -13.885 1.00 0.00 C ATOM 355 NZ LYS A 26 -12.773 -4.544 -12.772 1.00 0.00 N ATOM 0 H LYS A 26 -9.929 -2.604 -17.525 1.00 0.00 H new ATOM 0 HA LYS A 26 -10.430 -5.329 -16.959 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -12.071 -3.237 -18.483 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.714 -4.748 -17.872 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.544 -2.522 -16.147 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.254 -2.802 -16.406 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -12.976 -5.108 -15.396 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -11.307 -4.710 -15.039 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -12.057 -2.770 -13.652 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -13.728 -3.144 -14.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -13.633 -4.392 -12.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -12.773 -5.514 -13.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.936 -4.406 -12.171 1.00 0.00 H new ATOM 369 N ALA A 27 -9.923 -4.724 -20.167 1.00 0.00 N ATOM 370 CA ALA A 27 -9.709 -5.472 -21.422 1.00 0.00 C ATOM 371 C ALA A 27 -8.559 -6.482 -21.310 1.00 0.00 C ATOM 372 O ALA A 27 -8.701 -7.642 -21.704 1.00 0.00 O ATOM 373 CB ALA A 27 -9.462 -4.490 -22.569 1.00 0.00 C ATOM 0 H ALA A 27 -9.679 -3.734 -20.203 1.00 0.00 H new ATOM 0 HA ALA A 27 -10.611 -6.049 -21.626 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -9.304 -5.044 -23.494 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.327 -3.836 -22.680 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.579 -3.890 -22.350 1.00 0.00 H new ATOM 379 N GLN A 28 -7.430 -6.057 -20.746 1.00 0.00 N ATOM 380 CA GLN A 28 -6.301 -6.947 -20.472 1.00 0.00 C ATOM 381 C GLN A 28 -6.671 -8.170 -19.624 1.00 0.00 C ATOM 382 O GLN A 28 -6.371 -9.305 -19.996 1.00 0.00 O ATOM 383 CB GLN A 28 -5.322 -6.033 -19.728 1.00 0.00 C ATOM 384 CG GLN A 28 -3.871 -6.481 -19.831 1.00 0.00 C ATOM 385 CD GLN A 28 -3.354 -7.183 -18.577 1.00 0.00 C ATOM 386 OE1 GLN A 28 -2.638 -6.598 -17.765 1.00 0.00 O ATOM 387 NE2 GLN A 28 -3.704 -8.442 -18.393 1.00 0.00 N ATOM 0 H GLN A 28 -7.271 -5.089 -20.466 1.00 0.00 H new ATOM 0 HA GLN A 28 -5.900 -7.384 -21.386 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -5.410 -5.021 -20.124 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -5.606 -5.989 -18.677 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -3.768 -7.154 -20.682 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.245 -5.612 -20.034 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -4.298 -8.911 -19.076 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -3.380 -8.946 -17.567 1.00 0.00 H new ATOM 396 N ALA A 29 -7.333 -7.941 -18.490 1.00 0.00 N ATOM 397 CA ALA A 29 -7.799 -9.061 -17.656 1.00 0.00 C ATOM 398 C ALA A 29 -8.846 -9.937 -18.364 1.00 0.00 C ATOM 399 O ALA A 29 -8.883 -11.153 -18.165 1.00 0.00 O ATOM 400 CB ALA A 29 -8.369 -8.472 -16.365 1.00 0.00 C ATOM 0 H ALA A 29 -7.558 -7.014 -18.129 1.00 0.00 H new ATOM 0 HA ALA A 29 -6.956 -9.720 -17.447 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.724 -9.278 -15.723 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.591 -7.911 -15.847 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -9.198 -7.806 -16.604 1.00 0.00 H new ATOM 406 N ALA A 30 -9.717 -9.327 -19.167 1.00 0.00 N ATOM 407 CA ALA A 30 -10.878 -10.058 -19.706 1.00 0.00 C ATOM 408 C ALA A 30 -10.541 -11.003 -20.876 1.00 0.00 C ATOM 409 O ALA A 30 -10.895 -12.180 -20.829 1.00 0.00 O ATOM 410 CB ALA A 30 -11.958 -9.062 -20.137 1.00 0.00 C ATOM 0 H ALA A 30 -9.650 -8.351 -19.457 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.238 -10.696 -18.899 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -12.815 -9.605 -20.535 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -12.271 -8.470 -19.277 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.558 -8.401 -20.906 1.00 0.00 H new ATOM 416 N SER A 31 -9.829 -10.525 -21.897 1.00 0.00 N ATOM 417 CA SER A 31 -9.295 -11.422 -22.938 1.00 0.00 C ATOM 418 C SER A 31 -8.366 -12.540 -22.433 1.00 0.00 C ATOM 419 O SER A 31 -8.327 -13.622 -23.022 1.00 0.00 O ATOM 420 CB SER A 31 -8.562 -10.558 -23.971 1.00 0.00 C ATOM 421 OG SER A 31 -8.148 -11.350 -25.074 1.00 0.00 O ATOM 0 H SER A 31 -9.608 -9.538 -22.030 1.00 0.00 H new ATOM 0 HA SER A 31 -10.148 -11.950 -23.365 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.217 -9.758 -24.315 1.00 0.00 H new ATOM 0 HB3 SER A 31 -7.695 -10.085 -23.509 1.00 0.00 H new ATOM 0 HG SER A 31 -7.683 -10.785 -25.726 1.00 0.00 H new ATOM 427 N LYS A 32 -7.665 -12.325 -21.319 1.00 0.00 N ATOM 428 CA LYS A 32 -6.929 -13.413 -20.670 1.00 0.00 C ATOM 429 C LYS A 32 -7.870 -14.174 -19.719 1.00 0.00 C ATOM 430 O LYS A 32 -8.928 -14.653 -20.128 1.00 0.00 O ATOM 431 CB LYS A 32 -5.698 -12.787 -19.989 1.00 0.00 C ATOM 432 CG LYS A 32 -4.707 -12.175 -20.988 1.00 0.00 C ATOM 433 CD LYS A 32 -3.465 -11.634 -20.277 1.00 0.00 C ATOM 434 CE LYS A 32 -2.511 -10.958 -21.263 1.00 0.00 C ATOM 435 NZ LYS A 32 -1.326 -10.444 -20.558 1.00 0.00 N ATOM 0 H LYS A 32 -7.591 -11.421 -20.852 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.570 -14.162 -21.376 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.028 -12.015 -19.293 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.188 -13.550 -19.401 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.412 -12.928 -21.718 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.193 -11.370 -21.539 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -3.765 -10.920 -19.510 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -2.949 -12.449 -19.770 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.206 -11.670 -22.030 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -3.022 -10.141 -21.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.687 -9.988 -21.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -1.622 -9.750 -19.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -0.830 -11.231 -20.093 1.00 0.00 H new ATOM 449 N LYS A 33 -7.452 -14.337 -18.474 1.00 0.00 N ATOM 450 CA LYS A 33 -8.162 -15.230 -17.534 1.00 0.00 C ATOM 451 C LYS A 33 -8.481 -14.586 -16.177 1.00 0.00 C ATOM 452 O LYS A 33 -8.925 -15.255 -15.244 1.00 0.00 O ATOM 453 CB LYS A 33 -7.300 -16.478 -17.311 1.00 0.00 C ATOM 454 CG LYS A 33 -8.113 -17.730 -16.969 1.00 0.00 C ATOM 455 CD LYS A 33 -9.014 -18.129 -18.138 1.00 0.00 C ATOM 456 CE LYS A 33 -9.598 -19.529 -17.938 1.00 0.00 C ATOM 457 NZ LYS A 33 -10.424 -19.908 -19.093 1.00 0.00 N ATOM 0 H LYS A 33 -6.633 -13.873 -18.081 1.00 0.00 H new ATOM 0 HA LYS A 33 -9.124 -15.471 -17.987 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.713 -16.670 -18.209 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.593 -16.282 -16.505 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.439 -18.552 -16.727 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -8.720 -17.544 -16.083 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -9.824 -17.406 -18.239 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -8.443 -18.100 -19.066 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -8.792 -20.251 -17.806 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.199 -19.553 -17.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -10.814 -20.860 -18.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -11.203 -19.228 -19.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -9.840 -19.904 -19.954 1.00 0.00 H new ATOM 471 N VAL A 34 -8.218 -13.296 -16.057 1.00 0.00 N ATOM 472 CA VAL A 34 -8.281 -12.632 -14.746 1.00 0.00 C ATOM 473 C VAL A 34 -9.563 -11.786 -14.646 1.00 0.00 C ATOM 474 O VAL A 34 -10.034 -11.202 -15.622 1.00 0.00 O ATOM 475 CB VAL A 34 -7.032 -11.748 -14.539 1.00 0.00 C ATOM 476 CG1 VAL A 34 -6.993 -11.199 -13.110 1.00 0.00 C ATOM 477 CG2 VAL A 34 -5.716 -12.500 -14.772 1.00 0.00 C ATOM 0 H VAL A 34 -7.961 -12.686 -16.833 1.00 0.00 H new ATOM 0 HA VAL A 34 -8.302 -13.390 -13.963 1.00 0.00 H new ATOM 0 HB VAL A 34 -7.117 -10.948 -15.274 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -6.106 -10.578 -12.983 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.885 -10.600 -12.926 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.961 -12.028 -12.403 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -4.877 -11.823 -14.611 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -5.647 -13.336 -14.076 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.688 -12.876 -15.795 1.00 0.00 H new ATOM 487 N LYS A 35 -10.058 -11.637 -13.421 1.00 0.00 N ATOM 488 CA LYS A 35 -11.054 -10.593 -13.130 1.00 0.00 C ATOM 489 C LYS A 35 -10.531 -9.804 -11.928 1.00 0.00 C ATOM 490 O LYS A 35 -9.967 -10.349 -10.979 1.00 0.00 O ATOM 491 CB LYS A 35 -12.453 -11.171 -12.858 1.00 0.00 C ATOM 492 CG LYS A 35 -13.526 -10.124 -12.523 1.00 0.00 C ATOM 493 CD LYS A 35 -13.796 -9.157 -13.680 1.00 0.00 C ATOM 494 CE LYS A 35 -14.879 -8.142 -13.308 1.00 0.00 C ATOM 495 NZ LYS A 35 -15.124 -7.223 -14.431 1.00 0.00 N ATOM 0 H LYS A 35 -9.796 -12.212 -12.621 1.00 0.00 H new ATOM 0 HA LYS A 35 -11.178 -9.946 -13.999 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -12.775 -11.734 -13.734 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.385 -11.879 -12.032 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -14.453 -10.633 -12.257 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -13.212 -9.556 -11.647 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -12.877 -8.633 -13.942 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -14.106 -9.718 -14.562 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -15.801 -8.662 -13.047 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -14.571 -7.578 -12.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -15.861 -6.539 -14.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -14.247 -6.714 -14.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -15.438 -7.765 -15.261 1.00 0.00 H new ATOM 509 N PHE A 36 -10.744 -8.501 -11.995 1.00 0.00 N ATOM 510 CA PHE A 36 -10.367 -7.607 -10.885 1.00 0.00 C ATOM 511 C PHE A 36 -11.629 -7.297 -10.078 1.00 0.00 C ATOM 512 O PHE A 36 -12.518 -6.563 -10.510 1.00 0.00 O ATOM 513 CB PHE A 36 -9.602 -6.357 -11.330 1.00 0.00 C ATOM 514 CG PHE A 36 -8.307 -6.601 -12.107 1.00 0.00 C ATOM 515 CD1 PHE A 36 -7.348 -7.480 -11.685 1.00 0.00 C ATOM 516 CD2 PHE A 36 -8.087 -5.877 -13.240 1.00 0.00 C ATOM 517 CE1 PHE A 36 -6.221 -7.664 -12.424 1.00 0.00 C ATOM 518 CE2 PHE A 36 -6.958 -6.057 -13.968 1.00 0.00 C ATOM 519 CZ PHE A 36 -6.032 -6.964 -13.568 1.00 0.00 C ATOM 0 H PHE A 36 -11.171 -8.031 -12.793 1.00 0.00 H new ATOM 0 HA PHE A 36 -9.647 -8.118 -10.246 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.264 -5.752 -11.949 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -9.365 -5.767 -10.445 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -7.486 -8.028 -10.765 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -8.820 -5.152 -13.561 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.473 -8.372 -12.097 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.796 -5.479 -14.866 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.145 -7.128 -14.161 1.00 0.00 H new ATOM 529 N VAL A 37 -11.755 -8.003 -8.963 1.00 0.00 N ATOM 530 CA VAL A 37 -13.046 -8.098 -8.257 1.00 0.00 C ATOM 531 C VAL A 37 -13.340 -6.909 -7.330 1.00 0.00 C ATOM 532 O VAL A 37 -14.500 -6.577 -7.090 1.00 0.00 O ATOM 533 CB VAL A 37 -13.091 -9.441 -7.496 1.00 0.00 C ATOM 534 CG1 VAL A 37 -12.172 -9.488 -6.268 1.00 0.00 C ATOM 535 CG2 VAL A 37 -14.513 -9.795 -7.073 1.00 0.00 C ATOM 0 H VAL A 37 -10.992 -8.518 -8.523 1.00 0.00 H new ATOM 0 HA VAL A 37 -13.839 -8.060 -9.004 1.00 0.00 H new ATOM 0 HB VAL A 37 -12.721 -10.179 -8.207 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -12.258 -10.462 -5.786 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -11.140 -9.327 -6.580 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -12.464 -8.708 -5.565 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -14.508 -10.746 -6.540 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -14.903 -9.015 -6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -15.146 -9.878 -7.957 1.00 0.00 H new ATOM 545 N ASP A 38 -12.293 -6.287 -6.800 1.00 0.00 N ATOM 546 CA ASP A 38 -12.482 -5.164 -5.867 1.00 0.00 C ATOM 547 C ASP A 38 -11.788 -3.908 -6.397 1.00 0.00 C ATOM 548 O ASP A 38 -11.076 -3.923 -7.404 1.00 0.00 O ATOM 549 CB ASP A 38 -12.005 -5.521 -4.450 1.00 0.00 C ATOM 550 CG ASP A 38 -12.933 -6.508 -3.746 1.00 0.00 C ATOM 551 OD1 ASP A 38 -14.126 -6.183 -3.560 1.00 0.00 O ATOM 552 OD2 ASP A 38 -12.474 -7.606 -3.372 1.00 0.00 O ATOM 0 H ASP A 38 -11.320 -6.529 -6.990 1.00 0.00 H new ATOM 0 HA ASP A 38 -13.550 -4.956 -5.797 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -11.003 -5.947 -4.505 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.932 -4.610 -3.856 1.00 0.00 H new ATOM 557 N GLN A 39 -12.077 -2.784 -5.741 1.00 0.00 N ATOM 558 CA GLN A 39 -11.830 -1.481 -6.374 1.00 0.00 C ATOM 559 C GLN A 39 -11.464 -0.495 -5.285 1.00 0.00 C ATOM 560 O GLN A 39 -12.294 -0.139 -4.450 1.00 0.00 O ATOM 561 CB GLN A 39 -13.078 -0.916 -7.073 1.00 0.00 C ATOM 562 CG GLN A 39 -13.955 -2.003 -7.682 1.00 0.00 C ATOM 563 CD GLN A 39 -15.079 -1.437 -8.545 1.00 0.00 C ATOM 564 OE1 GLN A 39 -16.126 -1.025 -8.052 1.00 0.00 O ATOM 565 NE2 GLN A 39 -14.875 -1.409 -9.850 1.00 0.00 N ATOM 0 H GLN A 39 -12.470 -2.743 -4.801 1.00 0.00 H new ATOM 0 HA GLN A 39 -11.044 -1.622 -7.115 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -13.664 -0.343 -6.354 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -12.769 -0.224 -7.856 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -13.337 -2.667 -8.287 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -14.385 -2.608 -6.883 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -13.997 -1.757 -10.237 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -15.595 -1.040 -10.471 1.00 0.00 H new ATOM 574 N PHE A 40 -10.218 -0.064 -5.289 1.00 0.00 N ATOM 575 CA PHE A 40 -9.748 0.808 -4.202 1.00 0.00 C ATOM 576 C PHE A 40 -9.314 2.139 -4.815 1.00 0.00 C ATOM 577 O PHE A 40 -8.445 2.198 -5.684 1.00 0.00 O ATOM 578 CB PHE A 40 -8.611 0.181 -3.390 1.00 0.00 C ATOM 579 CG PHE A 40 -8.872 -1.124 -2.646 1.00 0.00 C ATOM 580 CD1 PHE A 40 -10.109 -1.678 -2.515 1.00 0.00 C ATOM 581 CD2 PHE A 40 -7.797 -1.764 -2.109 1.00 0.00 C ATOM 582 CE1 PHE A 40 -10.265 -2.878 -1.905 1.00 0.00 C ATOM 583 CE2 PHE A 40 -7.956 -2.952 -1.471 1.00 0.00 C ATOM 584 CZ PHE A 40 -9.186 -3.522 -1.395 1.00 0.00 C ATOM 0 H PHE A 40 -9.524 -0.287 -6.002 1.00 0.00 H new ATOM 0 HA PHE A 40 -10.565 0.960 -3.497 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -7.775 0.012 -4.069 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -8.283 0.919 -2.657 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -10.973 -1.157 -2.900 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -6.814 -1.325 -2.191 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -11.247 -3.321 -1.825 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -7.104 -3.443 -1.024 1.00 0.00 H new ATOM 0 HZ PHE A 40 -9.305 -4.489 -0.928 1.00 0.00 H new ATOM 594 N LEU A 41 -9.957 3.211 -4.377 1.00 0.00 N ATOM 595 CA LEU A 41 -9.495 4.554 -4.736 1.00 0.00 C ATOM 596 C LEU A 41 -8.428 4.976 -3.719 1.00 0.00 C ATOM 597 O LEU A 41 -8.484 4.592 -2.550 1.00 0.00 O ATOM 598 CB LEU A 41 -10.694 5.510 -4.660 1.00 0.00 C ATOM 599 CG LEU A 41 -11.806 5.251 -5.692 1.00 0.00 C ATOM 600 CD1 LEU A 41 -12.930 6.271 -5.507 1.00 0.00 C ATOM 601 CD2 LEU A 41 -11.289 5.343 -7.128 1.00 0.00 C ATOM 0 H LEU A 41 -10.786 3.186 -3.783 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.075 4.574 -5.742 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.126 5.447 -3.661 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.333 6.531 -4.787 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.174 4.239 -5.525 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.715 6.084 -6.240 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -13.342 6.180 -4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -12.535 7.277 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -12.108 5.153 -7.822 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -10.886 6.340 -7.306 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.505 4.602 -7.281 1.00 0.00 H new ATOM 613 N ILE A 42 -7.470 5.797 -4.138 1.00 0.00 N ATOM 614 CA ILE A 42 -6.422 6.251 -3.208 1.00 0.00 C ATOM 615 C ILE A 42 -6.964 7.091 -2.034 1.00 0.00 C ATOM 616 O ILE A 42 -6.519 6.919 -0.897 1.00 0.00 O ATOM 617 CB ILE A 42 -5.301 6.917 -4.039 1.00 0.00 C ATOM 618 CG1 ILE A 42 -4.057 7.255 -3.220 1.00 0.00 C ATOM 619 CG2 ILE A 42 -5.726 8.207 -4.743 1.00 0.00 C ATOM 620 CD1 ILE A 42 -3.543 6.055 -2.433 1.00 0.00 C ATOM 0 H ILE A 42 -7.390 6.158 -5.089 1.00 0.00 H new ATOM 0 HA ILE A 42 -5.989 5.397 -2.687 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.073 6.151 -4.780 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.272 7.614 -3.886 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.287 8.068 -2.531 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -4.883 8.610 -5.304 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.548 7.995 -5.427 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.051 8.936 -4.001 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.658 6.344 -1.866 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -4.317 5.711 -1.747 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.286 5.251 -3.122 1.00 0.00 H new ATOM 632 N ASN A 43 -7.935 7.972 -2.275 1.00 0.00 N ATOM 633 CA ASN A 43 -8.483 8.787 -1.177 1.00 0.00 C ATOM 634 C ASN A 43 -9.475 8.022 -0.280 1.00 0.00 C ATOM 635 O ASN A 43 -9.537 8.294 0.918 1.00 0.00 O ATOM 636 CB ASN A 43 -9.145 10.027 -1.799 1.00 0.00 C ATOM 637 CG ASN A 43 -9.583 11.056 -0.755 1.00 0.00 C ATOM 638 OD1 ASN A 43 -8.782 11.556 0.035 1.00 0.00 O ATOM 639 ND2 ASN A 43 -10.860 11.390 -0.744 1.00 0.00 N ATOM 0 H ASN A 43 -8.352 8.141 -3.190 1.00 0.00 H new ATOM 0 HA ASN A 43 -7.664 9.070 -0.515 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.447 10.496 -2.493 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.012 9.716 -2.381 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -11.202 12.076 -0.071 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.505 10.962 -1.408 1.00 0.00 H new ATOM 646 N LYS A 44 -10.216 7.044 -0.805 1.00 0.00 N ATOM 647 CA LYS A 44 -11.153 6.286 0.039 1.00 0.00 C ATOM 648 C LYS A 44 -10.487 5.123 0.790 1.00 0.00 C ATOM 649 O LYS A 44 -10.984 4.731 1.845 1.00 0.00 O ATOM 650 CB LYS A 44 -12.299 5.745 -0.820 1.00 0.00 C ATOM 651 CG LYS A 44 -13.221 6.848 -1.349 1.00 0.00 C ATOM 652 CD LYS A 44 -14.509 6.257 -1.927 1.00 0.00 C ATOM 653 CE LYS A 44 -15.403 7.351 -2.512 1.00 0.00 C ATOM 654 NZ LYS A 44 -16.636 6.762 -3.059 1.00 0.00 N ATOM 0 H LYS A 44 -10.191 6.760 -1.784 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.528 6.980 0.792 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.885 5.190 -1.662 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.886 5.040 -0.231 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.464 7.541 -0.543 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.703 7.422 -2.118 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.264 5.531 -2.702 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.049 5.721 -1.147 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -15.651 8.080 -1.740 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.868 7.887 -3.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.235 7.515 -3.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.394 6.084 -3.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.152 6.271 -2.301 1.00 0.00 H new ATOM 668 N LEU A 45 -9.381 4.564 0.300 1.00 0.00 N ATOM 669 CA LEU A 45 -8.657 3.554 1.093 1.00 0.00 C ATOM 670 C LEU A 45 -7.962 4.174 2.314 1.00 0.00 C ATOM 671 O LEU A 45 -7.995 3.617 3.413 1.00 0.00 O ATOM 672 CB LEU A 45 -7.639 2.830 0.194 1.00 0.00 C ATOM 673 CG LEU A 45 -7.646 1.297 0.321 1.00 0.00 C ATOM 674 CD1 LEU A 45 -7.136 0.838 1.688 1.00 0.00 C ATOM 675 CD2 LEU A 45 -9.033 0.700 0.060 1.00 0.00 C ATOM 0 H LEU A 45 -8.972 4.779 -0.610 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.382 2.834 1.473 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -7.838 3.096 -0.844 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.640 3.196 0.431 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.966 0.929 -0.447 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.157 -0.251 1.737 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -6.114 1.188 1.831 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -7.773 1.249 2.471 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.987 -0.384 0.161 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -9.744 1.102 0.782 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -9.356 0.957 -0.949 1.00 0.00 H new ATOM 687 N ASN A 46 -7.379 5.353 2.129 1.00 0.00 N ATOM 688 CA ASN A 46 -6.802 6.095 3.262 1.00 0.00 C ATOM 689 C ASN A 46 -7.862 6.745 4.185 1.00 0.00 C ATOM 690 O ASN A 46 -7.567 7.026 5.348 1.00 0.00 O ATOM 691 CB ASN A 46 -5.818 7.110 2.658 1.00 0.00 C ATOM 692 CG ASN A 46 -5.013 7.871 3.708 1.00 0.00 C ATOM 693 OD1 ASN A 46 -4.151 7.314 4.388 1.00 0.00 O ATOM 694 ND2 ASN A 46 -5.277 9.156 3.853 1.00 0.00 N ATOM 0 H ASN A 46 -7.290 5.816 1.224 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.284 5.411 3.934 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.131 6.587 1.992 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.372 7.823 2.048 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -4.763 9.708 4.539 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.995 9.597 3.279 1.00 0.00 H new ATOM 701 N ASP A 47 -9.089 6.966 3.705 1.00 0.00 N ATOM 702 CA ASP A 47 -10.169 7.478 4.576 1.00 0.00 C ATOM 703 C ASP A 47 -10.934 6.338 5.278 1.00 0.00 C ATOM 704 O ASP A 47 -11.155 6.435 6.485 1.00 0.00 O ATOM 705 CB ASP A 47 -11.132 8.450 3.855 1.00 0.00 C ATOM 706 CG ASP A 47 -10.464 9.746 3.399 1.00 0.00 C ATOM 707 OD1 ASP A 47 -9.497 10.201 4.052 1.00 0.00 O ATOM 708 OD2 ASP A 47 -10.912 10.323 2.385 1.00 0.00 O ATOM 0 H ASP A 47 -9.364 6.804 2.736 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.670 8.065 5.347 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -11.561 7.947 2.988 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -11.958 8.692 4.523 1.00 0.00 H new ATOM 713 N GLY A 48 -11.327 5.264 4.583 1.00 0.00 N ATOM 714 CA GLY A 48 -11.881 4.094 5.289 1.00 0.00 C ATOM 715 C GLY A 48 -13.229 3.541 4.795 1.00 0.00 C ATOM 716 O GLY A 48 -13.862 2.776 5.524 1.00 0.00 O ATOM 0 H GLY A 48 -11.277 5.176 3.568 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -11.147 3.290 5.235 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.990 4.356 6.341 1.00 0.00 H new ATOM 720 N SER A 49 -13.707 3.903 3.603 1.00 0.00 N ATOM 721 CA SER A 49 -15.031 3.425 3.145 1.00 0.00 C ATOM 722 C SER A 49 -15.077 1.963 2.644 1.00 0.00 C ATOM 723 O SER A 49 -16.156 1.397 2.470 1.00 0.00 O ATOM 724 CB SER A 49 -15.513 4.352 2.024 1.00 0.00 C ATOM 725 OG SER A 49 -15.617 5.689 2.494 1.00 0.00 O ATOM 0 H SER A 49 -13.218 4.510 2.945 1.00 0.00 H new ATOM 0 HA SER A 49 -15.678 3.446 4.022 1.00 0.00 H new ATOM 0 HB2 SER A 49 -14.819 4.308 1.184 1.00 0.00 H new ATOM 0 HB3 SER A 49 -16.481 4.014 1.655 1.00 0.00 H new ATOM 0 HG SER A 49 -15.924 6.269 1.766 1.00 0.00 H new ATOM 731 N ILE A 50 -13.916 1.359 2.404 1.00 0.00 N ATOM 732 CA ILE A 50 -13.829 0.072 1.692 1.00 0.00 C ATOM 733 C ILE A 50 -13.301 -0.992 2.631 1.00 0.00 C ATOM 734 O ILE A 50 -12.208 -0.850 3.185 1.00 0.00 O ATOM 735 CB ILE A 50 -12.897 0.111 0.474 1.00 0.00 C ATOM 736 CG1 ILE A 50 -13.269 1.331 -0.379 1.00 0.00 C ATOM 737 CG2 ILE A 50 -12.925 -1.245 -0.262 1.00 0.00 C ATOM 738 CD1 ILE A 50 -12.583 1.343 -1.733 1.00 0.00 C ATOM 0 H ILE A 50 -13.013 1.737 2.691 1.00 0.00 H new ATOM 0 HA ILE A 50 -14.838 -0.149 1.344 1.00 0.00 H new ATOM 0 HB ILE A 50 -11.854 0.242 0.761 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.349 1.349 -0.525 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -13.006 2.239 0.163 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -12.260 -1.205 -1.124 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.595 -2.033 0.415 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -13.941 -1.456 -0.597 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.888 2.231 -2.287 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -11.502 1.356 -1.593 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -12.866 0.451 -2.292 1.00 0.00 H new ATOM 750 N THR A 51 -14.075 -2.051 2.826 1.00 0.00 N ATOM 751 CA THR A 51 -13.593 -3.096 3.726 1.00 0.00 C ATOM 752 C THR A 51 -12.983 -4.241 2.905 1.00 0.00 C ATOM 753 O THR A 51 -13.160 -4.398 1.695 1.00 0.00 O ATOM 754 CB THR A 51 -14.742 -3.585 4.631 1.00 0.00 C ATOM 755 OG1 THR A 51 -14.208 -4.385 5.677 1.00 0.00 O ATOM 756 CG2 THR A 51 -15.790 -4.412 3.877 1.00 0.00 C ATOM 0 H THR A 51 -14.989 -2.209 2.402 1.00 0.00 H new ATOM 0 HA THR A 51 -12.814 -2.696 4.375 1.00 0.00 H new ATOM 0 HB THR A 51 -15.238 -2.695 5.019 1.00 0.00 H new ATOM 0 HG1 THR A 51 -14.936 -4.696 6.255 1.00 0.00 H new ATOM 0 HG21 THR A 51 -16.572 -4.726 4.569 1.00 0.00 H new ATOM 0 HG22 THR A 51 -16.229 -3.807 3.084 1.00 0.00 H new ATOM 0 HG23 THR A 51 -15.315 -5.291 3.442 1.00 0.00 H new ATOM 764 N LEU A 52 -12.166 -4.971 3.638 1.00 0.00 N ATOM 765 CA LEU A 52 -11.036 -5.681 3.031 1.00 0.00 C ATOM 766 C LEU A 52 -10.999 -7.140 3.469 1.00 0.00 C ATOM 767 O LEU A 52 -10.863 -7.471 4.648 1.00 0.00 O ATOM 768 CB LEU A 52 -9.760 -4.949 3.464 1.00 0.00 C ATOM 769 CG LEU A 52 -8.457 -5.495 2.863 1.00 0.00 C ATOM 770 CD1 LEU A 52 -8.429 -5.237 1.359 1.00 0.00 C ATOM 771 CD2 LEU A 52 -7.263 -4.804 3.527 1.00 0.00 C ATOM 0 H LEU A 52 -12.254 -5.093 4.647 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.131 -5.686 1.945 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -9.854 -3.897 3.193 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -9.686 -4.993 4.551 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.401 -6.569 3.039 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.501 -5.627 0.940 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.277 -5.734 0.889 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.488 -4.165 1.173 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.337 -5.190 3.102 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -7.322 -3.730 3.353 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.279 -5.000 4.599 1.00 0.00 H new ATOM 783 N GLU A 53 -11.082 -8.004 2.472 1.00 0.00 N ATOM 784 CA GLU A 53 -10.890 -9.443 2.708 1.00 0.00 C ATOM 785 C GLU A 53 -9.447 -9.786 2.324 1.00 0.00 C ATOM 786 O GLU A 53 -9.017 -9.625 1.181 1.00 0.00 O ATOM 787 CB GLU A 53 -11.882 -10.275 1.882 1.00 0.00 C ATOM 788 CG GLU A 53 -13.336 -10.051 2.311 1.00 0.00 C ATOM 789 CD GLU A 53 -14.291 -10.899 1.479 1.00 0.00 C ATOM 790 OE1 GLU A 53 -14.712 -10.443 0.395 1.00 0.00 O ATOM 791 OE2 GLU A 53 -14.623 -12.026 1.907 1.00 0.00 O ATOM 0 H GLU A 53 -11.277 -7.750 1.504 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.073 -9.678 3.757 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.775 -10.021 0.828 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.636 -11.332 1.982 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.449 -10.300 3.366 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.592 -8.997 2.203 1.00 0.00 H new ATOM 798 N ASN A 54 -8.683 -10.209 3.326 1.00 0.00 N ATOM 799 CA ASN A 54 -7.219 -10.307 3.188 1.00 0.00 C ATOM 800 C ASN A 54 -6.802 -11.705 2.703 1.00 0.00 C ATOM 801 O ASN A 54 -6.347 -12.527 3.501 1.00 0.00 O ATOM 802 CB ASN A 54 -6.635 -10.018 4.583 1.00 0.00 C ATOM 803 CG ASN A 54 -6.684 -8.538 4.960 1.00 0.00 C ATOM 804 OD1 ASN A 54 -7.720 -8.008 5.359 1.00 0.00 O ATOM 805 ND2 ASN A 54 -5.563 -7.849 4.840 1.00 0.00 N ATOM 0 H ASN A 54 -9.042 -10.489 4.239 1.00 0.00 H new ATOM 0 HA ASN A 54 -6.848 -9.598 2.448 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -7.185 -10.594 5.327 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -5.601 -10.361 4.615 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -5.545 -6.858 5.080 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -4.715 -8.308 4.507 1.00 0.00 H new ATOM 812 N ALA A 55 -6.900 -11.984 1.398 1.00 0.00 N ATOM 813 CA ALA A 55 -6.305 -13.235 0.887 1.00 0.00 C ATOM 814 C ALA A 55 -6.008 -13.319 -0.625 1.00 0.00 C ATOM 815 O ALA A 55 -4.839 -13.424 -0.998 1.00 0.00 O ATOM 816 CB ALA A 55 -7.171 -14.428 1.307 1.00 0.00 C ATOM 0 H ALA A 55 -7.360 -11.397 0.702 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.316 -13.254 1.346 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.729 -15.350 0.928 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.226 -14.472 2.395 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.174 -14.312 0.897 1.00 0.00 H new ATOM 822 N LYS A 56 -7.021 -13.554 -1.465 1.00 0.00 N ATOM 823 CA LYS A 56 -6.763 -14.170 -2.791 1.00 0.00 C ATOM 824 C LYS A 56 -6.574 -13.228 -3.983 1.00 0.00 C ATOM 825 O LYS A 56 -6.619 -13.656 -5.136 1.00 0.00 O ATOM 826 CB LYS A 56 -7.891 -15.165 -3.076 1.00 0.00 C ATOM 827 CG LYS A 56 -7.694 -16.418 -2.224 1.00 0.00 C ATOM 828 CD LYS A 56 -8.904 -17.352 -2.295 1.00 0.00 C ATOM 829 CE LYS A 56 -8.695 -18.591 -1.423 1.00 0.00 C ATOM 830 NZ LYS A 56 -9.864 -19.479 -1.507 1.00 0.00 N ATOM 0 H LYS A 56 -7.999 -13.339 -1.270 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.785 -14.643 -2.702 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -8.856 -14.710 -2.854 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -7.899 -15.429 -4.134 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -6.804 -16.950 -2.561 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -7.519 -16.129 -1.188 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -9.798 -16.820 -1.968 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -9.073 -17.655 -3.328 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -7.801 -19.124 -1.746 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -8.531 -18.292 -0.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -9.708 -20.316 -0.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -10.710 -18.972 -1.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -10.002 -19.778 -2.493 1.00 0.00 H new ATOM 844 N TYR A 57 -6.366 -11.952 -3.717 1.00 0.00 N ATOM 845 CA TYR A 57 -6.374 -10.933 -4.780 1.00 0.00 C ATOM 846 C TYR A 57 -5.001 -10.857 -5.483 1.00 0.00 C ATOM 847 O TYR A 57 -4.630 -9.759 -5.899 1.00 0.00 O ATOM 848 CB TYR A 57 -6.712 -9.501 -4.336 1.00 0.00 C ATOM 849 CG TYR A 57 -7.907 -9.339 -3.410 1.00 0.00 C ATOM 850 CD1 TYR A 57 -9.108 -9.911 -3.705 1.00 0.00 C ATOM 851 CD2 TYR A 57 -7.790 -8.544 -2.315 1.00 0.00 C ATOM 852 CE1 TYR A 57 -10.183 -9.687 -2.904 1.00 0.00 C ATOM 853 CE2 TYR A 57 -8.868 -8.308 -1.524 1.00 0.00 C ATOM 854 CZ TYR A 57 -10.065 -8.878 -1.817 1.00 0.00 C ATOM 855 OH TYR A 57 -11.155 -8.626 -1.028 1.00 0.00 O ATOM 0 H TYR A 57 -6.189 -11.586 -2.782 1.00 0.00 H new ATOM 0 HA TYR A 57 -7.173 -11.275 -5.438 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.837 -9.083 -3.839 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.889 -8.901 -5.228 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -9.206 -10.543 -4.576 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.837 -8.098 -2.073 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -11.131 -10.152 -3.131 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -8.773 -7.666 -0.661 1.00 0.00 H new ATOM 0 HH TYR A 57 -11.868 -8.231 -1.572 1.00 0.00 H new ATOM 865 N GLU A 58 -4.164 -11.906 -5.415 1.00 0.00 N ATOM 866 CA GLU A 58 -2.695 -11.791 -5.635 1.00 0.00 C ATOM 867 C GLU A 58 -2.233 -11.298 -7.030 1.00 0.00 C ATOM 868 O GLU A 58 -1.080 -11.488 -7.422 1.00 0.00 O ATOM 869 CB GLU A 58 -2.016 -13.142 -5.341 1.00 0.00 C ATOM 870 CG GLU A 58 -2.617 -14.326 -6.115 1.00 0.00 C ATOM 871 CD GLU A 58 -1.832 -15.608 -5.881 1.00 0.00 C ATOM 872 OE1 GLU A 58 -0.784 -15.797 -6.535 1.00 0.00 O ATOM 873 OE2 GLU A 58 -2.261 -16.436 -5.050 1.00 0.00 O ATOM 0 H GLU A 58 -4.474 -12.855 -5.208 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.390 -11.006 -4.943 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.956 -13.064 -5.582 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.085 -13.347 -4.273 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.653 -14.473 -5.809 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.629 -14.096 -7.180 1.00 0.00 H new ATOM 880 N THR A 59 -3.075 -10.512 -7.685 1.00 0.00 N ATOM 881 CA THR A 59 -2.624 -9.651 -8.785 1.00 0.00 C ATOM 882 C THR A 59 -3.065 -8.213 -8.503 1.00 0.00 C ATOM 883 O THR A 59 -4.252 -7.891 -8.437 1.00 0.00 O ATOM 884 CB THR A 59 -3.107 -10.110 -10.168 1.00 0.00 C ATOM 885 OG1 THR A 59 -2.598 -9.234 -11.164 1.00 0.00 O ATOM 886 CG2 THR A 59 -4.615 -10.238 -10.347 1.00 0.00 C ATOM 0 H THR A 59 -4.072 -10.448 -7.480 1.00 0.00 H new ATOM 0 HA THR A 59 -1.537 -9.716 -8.824 1.00 0.00 H new ATOM 0 HB THR A 59 -2.721 -11.124 -10.268 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.905 -9.529 -12.047 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.834 -10.569 -11.362 1.00 0.00 H new ATOM 0 HG22 THR A 59 -5.005 -10.966 -9.636 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.086 -9.271 -10.171 1.00 0.00 H new ATOM 894 N VAL A 60 -2.075 -7.367 -8.269 1.00 0.00 N ATOM 895 CA VAL A 60 -2.325 -6.004 -7.787 1.00 0.00 C ATOM 896 C VAL A 60 -1.998 -5.188 -9.059 1.00 0.00 C ATOM 897 O VAL A 60 -0.838 -5.135 -9.470 1.00 0.00 O ATOM 898 CB VAL A 60 -1.392 -5.662 -6.588 1.00 0.00 C ATOM 899 CG1 VAL A 60 -0.624 -4.354 -6.741 1.00 0.00 C ATOM 900 CG2 VAL A 60 -2.143 -5.476 -5.265 1.00 0.00 C ATOM 0 H VAL A 60 -1.089 -7.593 -8.403 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.326 -5.819 -7.398 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.727 -6.525 -6.580 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.000 -4.194 -5.862 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.006 -4.404 -7.629 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.328 -3.528 -6.841 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.432 -5.240 -4.473 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.859 -4.660 -5.365 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.673 -6.395 -5.015 1.00 0.00 H new ATOM 910 N HIS A 61 -2.968 -4.575 -9.728 1.00 0.00 N ATOM 911 CA HIS A 61 -2.607 -3.587 -10.759 1.00 0.00 C ATOM 912 C HIS A 61 -2.723 -2.224 -10.083 1.00 0.00 C ATOM 913 O HIS A 61 -3.739 -1.952 -9.443 1.00 0.00 O ATOM 914 CB HIS A 61 -3.527 -3.751 -11.997 1.00 0.00 C ATOM 915 CG HIS A 61 -2.779 -4.519 -13.066 1.00 0.00 C ATOM 916 ND1 HIS A 61 -2.895 -5.886 -13.281 1.00 0.00 N ATOM 917 CD2 HIS A 61 -1.691 -3.991 -13.760 1.00 0.00 C ATOM 918 CE1 HIS A 61 -1.832 -6.045 -14.136 1.00 0.00 C ATOM 919 NE2 HIS A 61 -1.075 -4.968 -14.509 1.00 0.00 N ATOM 0 H HIS A 61 -3.967 -4.728 -9.592 1.00 0.00 H new ATOM 0 HA HIS A 61 -1.594 -3.716 -11.141 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.439 -4.280 -11.721 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -3.827 -2.774 -12.375 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -3.564 -6.564 -12.916 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -1.375 -2.959 -13.716 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -1.592 -7.027 -14.517 1.00 0.00 H new ATOM 927 N TYR A 62 -1.739 -1.327 -10.258 1.00 0.00 N ATOM 928 CA TYR A 62 -1.983 0.052 -9.816 1.00 0.00 C ATOM 929 C TYR A 62 -2.030 0.892 -11.091 1.00 0.00 C ATOM 930 O TYR A 62 -1.214 0.756 -12.003 1.00 0.00 O ATOM 931 CB TYR A 62 -0.868 0.514 -8.849 1.00 0.00 C ATOM 932 CG TYR A 62 -1.323 1.388 -7.699 1.00 0.00 C ATOM 933 CD1 TYR A 62 -1.936 2.583 -7.907 1.00 0.00 C ATOM 934 CD2 TYR A 62 -1.067 0.972 -6.429 1.00 0.00 C ATOM 935 CE1 TYR A 62 -2.380 3.310 -6.850 1.00 0.00 C ATOM 936 CE2 TYR A 62 -1.496 1.708 -5.377 1.00 0.00 C ATOM 937 CZ TYR A 62 -2.163 2.871 -5.586 1.00 0.00 C ATOM 938 OH TYR A 62 -2.612 3.604 -4.521 1.00 0.00 O ATOM 0 H TYR A 62 -0.826 -1.513 -10.674 1.00 0.00 H new ATOM 0 HA TYR A 62 -2.915 0.150 -9.260 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.378 -0.369 -8.439 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -0.117 1.059 -9.422 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.070 2.954 -8.912 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.522 0.055 -6.260 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.906 4.238 -7.016 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -1.307 1.369 -4.369 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.027 3.453 -3.750 1.00 0.00 H new ATOM 948 N LEU A 63 -2.943 1.846 -11.075 1.00 0.00 N ATOM 949 CA LEU A 63 -3.007 2.879 -12.104 1.00 0.00 C ATOM 950 C LEU A 63 -2.931 4.269 -11.463 1.00 0.00 C ATOM 951 O LEU A 63 -3.974 4.843 -11.150 1.00 0.00 O ATOM 952 CB LEU A 63 -4.339 2.606 -12.827 1.00 0.00 C ATOM 953 CG LEU A 63 -4.309 1.423 -13.808 1.00 0.00 C ATOM 954 CD1 LEU A 63 -5.693 1.286 -14.442 1.00 0.00 C ATOM 955 CD2 LEU A 63 -3.266 1.609 -14.913 1.00 0.00 C ATOM 0 H LEU A 63 -3.660 1.930 -10.354 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.176 2.855 -12.809 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.111 2.421 -12.080 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.632 3.504 -13.371 1.00 0.00 H new ATOM 0 HG LEU A 63 -4.037 0.527 -13.251 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -5.691 0.451 -15.142 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.434 1.105 -13.663 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.942 2.204 -14.974 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.284 0.747 -15.580 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.494 2.511 -15.480 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.276 1.702 -14.467 1.00 0.00 H new ATOM 967 N THR A 64 -1.742 4.862 -11.301 1.00 0.00 N ATOM 968 CA THR A 64 -1.697 6.279 -10.889 1.00 0.00 C ATOM 969 C THR A 64 -0.772 7.071 -11.828 1.00 0.00 C ATOM 970 O THR A 64 0.414 7.223 -11.529 1.00 0.00 O ATOM 971 CB THR A 64 -1.240 6.393 -9.431 1.00 0.00 C ATOM 972 OG1 THR A 64 -2.118 5.642 -8.612 1.00 0.00 O ATOM 973 CG2 THR A 64 -1.283 7.843 -8.943 1.00 0.00 C ATOM 0 H THR A 64 -0.836 4.414 -11.440 1.00 0.00 H new ATOM 0 HA THR A 64 -2.698 6.705 -10.960 1.00 0.00 H new ATOM 0 HB THR A 64 -0.217 6.022 -9.372 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.710 4.776 -8.404 1.00 0.00 H new ATOM 0 HG21 THR A 64 -0.953 7.888 -7.905 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.624 8.454 -9.560 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.303 8.221 -9.016 1.00 0.00 H new ATOM 981 N PRO A 65 -1.260 7.619 -12.948 1.00 0.00 N ATOM 982 CA PRO A 65 -0.475 8.559 -13.758 1.00 0.00 C ATOM 983 C PRO A 65 -0.521 9.965 -13.139 1.00 0.00 C ATOM 984 O PRO A 65 -1.206 10.857 -13.645 1.00 0.00 O ATOM 985 CB PRO A 65 -1.234 8.476 -15.086 1.00 0.00 C ATOM 986 CG PRO A 65 -2.692 8.296 -14.664 1.00 0.00 C ATOM 987 CD PRO A 65 -2.637 7.420 -13.416 1.00 0.00 C ATOM 0 HA PRO A 65 0.589 8.338 -13.846 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -1.099 9.379 -15.681 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -0.887 7.640 -15.693 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -3.163 9.256 -14.452 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.276 7.822 -15.453 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -3.368 7.731 -12.670 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -2.840 6.374 -13.645 1.00 0.00 H new ATOM 1104 N PHE A 73 2.849 8.047 -3.289 1.00 0.00 N ATOM 1105 CA PHE A 73 2.024 7.023 -2.629 1.00 0.00 C ATOM 1106 C PHE A 73 2.598 6.871 -1.218 1.00 0.00 C ATOM 1107 O PHE A 73 3.819 6.936 -1.051 1.00 0.00 O ATOM 1108 CB PHE A 73 2.162 5.747 -3.487 1.00 0.00 C ATOM 1109 CG PHE A 73 1.398 4.510 -3.038 1.00 0.00 C ATOM 1110 CD1 PHE A 73 0.127 4.606 -2.560 1.00 0.00 C ATOM 1111 CD2 PHE A 73 1.953 3.277 -3.216 1.00 0.00 C ATOM 1112 CE1 PHE A 73 -0.573 3.491 -2.239 1.00 0.00 C ATOM 1113 CE2 PHE A 73 1.231 2.162 -2.944 1.00 0.00 C ATOM 1114 CZ PHE A 73 -0.014 2.271 -2.424 1.00 0.00 C ATOM 0 HA PHE A 73 0.964 7.261 -2.544 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.844 5.988 -4.501 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.220 5.489 -3.537 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.327 5.578 -2.436 1.00 0.00 H new ATOM 0 HD2 PHE A 73 2.968 3.189 -3.574 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.572 3.575 -1.837 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.649 1.186 -3.142 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.564 1.381 -2.155 1.00 0.00 H new ATOM 1124 N PRO A 74 1.805 6.542 -0.191 1.00 0.00 N ATOM 1125 CA PRO A 74 2.379 6.358 1.142 1.00 0.00 C ATOM 1126 C PRO A 74 2.978 4.958 1.297 1.00 0.00 C ATOM 1127 O PRO A 74 2.495 3.988 0.713 1.00 0.00 O ATOM 1128 CB PRO A 74 1.177 6.593 2.055 1.00 0.00 C ATOM 1129 CG PRO A 74 0.135 7.329 1.221 1.00 0.00 C ATOM 1130 CD PRO A 74 0.360 6.797 -0.182 1.00 0.00 C ATOM 0 HA PRO A 74 3.210 7.027 1.366 1.00 0.00 H new ATOM 0 HB2 PRO A 74 0.780 5.647 2.425 1.00 0.00 H new ATOM 0 HB3 PRO A 74 1.462 7.182 2.927 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -0.877 7.123 1.570 1.00 0.00 H new ATOM 0 HG3 PRO A 74 0.274 8.409 1.267 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -0.214 5.890 -0.370 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.070 7.521 -0.943 1.00 0.00 H new ATOM 1138 N LYS A 75 4.017 4.843 2.118 1.00 0.00 N ATOM 1139 CA LYS A 75 4.538 3.509 2.470 1.00 0.00 C ATOM 1140 C LYS A 75 3.518 2.624 3.224 1.00 0.00 C ATOM 1141 O LYS A 75 3.476 1.402 3.047 1.00 0.00 O ATOM 1142 CB LYS A 75 5.872 3.634 3.225 1.00 0.00 C ATOM 1143 CG LYS A 75 5.773 4.338 4.587 1.00 0.00 C ATOM 1144 CD LYS A 75 7.141 4.507 5.262 1.00 0.00 C ATOM 1145 CE LYS A 75 7.817 3.185 5.648 1.00 0.00 C ATOM 1146 NZ LYS A 75 7.031 2.452 6.655 1.00 0.00 N ATOM 0 H LYS A 75 4.509 5.627 2.546 1.00 0.00 H new ATOM 0 HA LYS A 75 4.722 2.985 1.532 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.284 2.636 3.376 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.579 4.179 2.599 1.00 0.00 H new ATOM 0 HG2 LYS A 75 5.314 5.318 4.454 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.117 3.765 5.242 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.800 5.057 4.590 1.00 0.00 H new ATOM 0 HD3 LYS A 75 7.019 5.116 6.158 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.941 2.565 4.760 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.815 3.385 6.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.577 1.634 6.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.818 3.082 7.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 6.142 2.122 6.228 1.00 0.00 H new ATOM 1160 N LYS A 76 2.701 3.238 4.078 1.00 0.00 N ATOM 1161 CA LYS A 76 1.718 2.480 4.871 1.00 0.00 C ATOM 1162 C LYS A 76 0.614 1.811 4.029 1.00 0.00 C ATOM 1163 O LYS A 76 0.123 0.749 4.416 1.00 0.00 O ATOM 1164 CB LYS A 76 1.143 3.373 5.983 1.00 0.00 C ATOM 1165 CG LYS A 76 0.467 4.657 5.482 1.00 0.00 C ATOM 1166 CD LYS A 76 -0.105 5.477 6.639 1.00 0.00 C ATOM 1167 CE LYS A 76 -0.790 6.746 6.123 1.00 0.00 C ATOM 1168 NZ LYS A 76 -1.343 7.520 7.245 1.00 0.00 N ATOM 0 H LYS A 76 2.694 4.245 4.242 1.00 0.00 H new ATOM 0 HA LYS A 76 2.251 1.646 5.327 1.00 0.00 H new ATOM 0 HB2 LYS A 76 0.418 2.796 6.557 1.00 0.00 H new ATOM 0 HB3 LYS A 76 1.948 3.644 6.667 1.00 0.00 H new ATOM 0 HG2 LYS A 76 1.190 5.259 4.931 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -0.332 4.401 4.786 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -0.821 4.874 7.198 1.00 0.00 H new ATOM 0 HD3 LYS A 76 0.694 5.746 7.330 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.074 7.355 5.570 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.587 6.480 5.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.805 8.378 6.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.041 6.942 7.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.575 7.789 7.893 1.00 0.00 H new ATOM 1182 N LEU A 77 0.252 2.358 2.864 1.00 0.00 N ATOM 1183 CA LEU A 77 -0.700 1.631 1.995 1.00 0.00 C ATOM 1184 C LEU A 77 0.004 0.473 1.261 1.00 0.00 C ATOM 1185 O LEU A 77 -0.622 -0.563 1.055 1.00 0.00 O ATOM 1186 CB LEU A 77 -1.461 2.485 0.959 1.00 0.00 C ATOM 1187 CG LEU A 77 -2.602 3.342 1.519 1.00 0.00 C ATOM 1188 CD1 LEU A 77 -2.126 4.343 2.564 1.00 0.00 C ATOM 1189 CD2 LEU A 77 -3.322 4.108 0.406 1.00 0.00 C ATOM 0 H LEU A 77 0.580 3.256 2.507 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.455 1.266 2.692 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.748 3.142 0.461 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.869 1.821 0.197 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.289 2.642 1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.975 4.923 2.926 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.669 3.809 3.397 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.393 5.014 2.117 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.125 4.706 0.837 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.614 4.763 -0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.740 3.401 -0.311 1.00 0.00 H new ATOM 1201 N ILE A 78 1.299 0.562 0.943 1.00 0.00 N ATOM 1202 CA ILE A 78 2.036 -0.601 0.440 1.00 0.00 C ATOM 1203 C ILE A 78 2.055 -1.741 1.488 1.00 0.00 C ATOM 1204 O ILE A 78 1.921 -2.908 1.112 1.00 0.00 O ATOM 1205 CB ILE A 78 3.439 -0.081 0.060 1.00 0.00 C ATOM 1206 CG1 ILE A 78 3.454 0.900 -1.116 1.00 0.00 C ATOM 1207 CG2 ILE A 78 4.404 -1.234 -0.189 1.00 0.00 C ATOM 1208 CD1 ILE A 78 4.812 1.572 -1.342 1.00 0.00 C ATOM 0 H ILE A 78 1.853 1.415 1.023 1.00 0.00 H new ATOM 0 HA ILE A 78 1.563 -1.047 -0.435 1.00 0.00 H new ATOM 0 HB ILE A 78 3.775 0.491 0.925 1.00 0.00 H new ATOM 0 HG12 ILE A 78 3.166 0.369 -2.024 1.00 0.00 H new ATOM 0 HG13 ILE A 78 2.702 1.670 -0.945 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.384 -0.837 -0.455 1.00 0.00 H new ATOM 0 HG22 ILE A 78 4.490 -1.838 0.714 1.00 0.00 H new ATOM 0 HG23 ILE A 78 4.029 -1.852 -1.005 1.00 0.00 H new ATOM 0 HD11 ILE A 78 4.745 2.252 -2.191 1.00 0.00 H new ATOM 0 HD12 ILE A 78 5.094 2.132 -0.450 1.00 0.00 H new ATOM 0 HD13 ILE A 78 5.565 0.811 -1.546 1.00 0.00 H new ATOM 1220 N SER A 79 2.183 -1.441 2.786 1.00 0.00 N ATOM 1221 CA SER A 79 2.091 -2.502 3.804 1.00 0.00 C ATOM 1222 C SER A 79 0.681 -3.118 3.896 1.00 0.00 C ATOM 1223 O SER A 79 0.543 -4.339 3.978 1.00 0.00 O ATOM 1224 CB SER A 79 2.527 -1.927 5.156 1.00 0.00 C ATOM 1225 OG SER A 79 2.554 -2.951 6.140 1.00 0.00 O ATOM 0 H SER A 79 2.346 -0.503 3.152 1.00 0.00 H new ATOM 0 HA SER A 79 2.755 -3.315 3.511 1.00 0.00 H new ATOM 0 HB2 SER A 79 3.514 -1.474 5.065 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.841 -1.137 5.462 1.00 0.00 H new ATOM 0 HG SER A 79 2.835 -2.572 6.999 1.00 0.00 H new ATOM 1231 N VAL A 80 -0.363 -2.289 3.867 1.00 0.00 N ATOM 1232 CA VAL A 80 -1.747 -2.808 3.901 1.00 0.00 C ATOM 1233 C VAL A 80 -2.081 -3.673 2.670 1.00 0.00 C ATOM 1234 O VAL A 80 -2.742 -4.702 2.815 1.00 0.00 O ATOM 1235 CB VAL A 80 -2.745 -1.644 4.078 1.00 0.00 C ATOM 1236 CG1 VAL A 80 -4.207 -2.109 4.015 1.00 0.00 C ATOM 1237 CG2 VAL A 80 -2.540 -0.942 5.425 1.00 0.00 C ATOM 0 H VAL A 80 -0.289 -1.273 3.821 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.836 -3.470 4.762 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.549 -0.960 3.252 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -4.867 -1.252 4.145 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -4.400 -2.572 3.047 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.393 -2.834 4.808 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -3.256 -0.126 5.523 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.691 -1.656 6.234 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.527 -0.543 5.477 1.00 0.00 H new ATOM 1247 N LEU A 81 -1.634 -3.298 1.468 1.00 0.00 N ATOM 1248 CA LEU A 81 -1.836 -4.168 0.303 1.00 0.00 C ATOM 1249 C LEU A 81 -1.027 -5.467 0.396 1.00 0.00 C ATOM 1250 O LEU A 81 -1.534 -6.514 0.003 1.00 0.00 O ATOM 1251 CB LEU A 81 -1.480 -3.450 -1.008 1.00 0.00 C ATOM 1252 CG LEU A 81 -2.549 -2.520 -1.608 1.00 0.00 C ATOM 1253 CD1 LEU A 81 -3.954 -3.134 -1.591 1.00 0.00 C ATOM 1254 CD2 LEU A 81 -2.543 -1.154 -0.924 1.00 0.00 C ATOM 0 H LEU A 81 -1.144 -2.424 1.277 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.897 -4.419 0.302 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.577 -2.863 -0.838 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.233 -4.207 -1.752 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.280 -2.383 -2.656 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.664 -2.431 -2.027 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.955 -4.057 -2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.244 -3.351 -0.563 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.309 -0.520 -1.370 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.749 -1.278 0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.566 -0.687 -1.052 1.00 0.00 H new ATOM 1266 N ALA A 82 0.202 -5.435 0.916 1.00 0.00 N ATOM 1267 CA ALA A 82 0.946 -6.683 1.149 1.00 0.00 C ATOM 1268 C ALA A 82 0.231 -7.653 2.108 1.00 0.00 C ATOM 1269 O ALA A 82 0.402 -8.868 2.007 1.00 0.00 O ATOM 1270 CB ALA A 82 2.327 -6.327 1.705 1.00 0.00 C ATOM 0 H ALA A 82 0.697 -4.583 1.180 1.00 0.00 H new ATOM 0 HA ALA A 82 1.024 -7.203 0.194 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.894 -7.241 1.884 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.860 -5.705 0.986 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.213 -5.781 2.642 1.00 0.00 H new ATOM 1276 N ASP A 83 -0.553 -7.125 3.050 1.00 0.00 N ATOM 1277 CA ASP A 83 -1.274 -7.992 4.009 1.00 0.00 C ATOM 1278 C ASP A 83 -2.471 -8.771 3.428 1.00 0.00 C ATOM 1279 O ASP A 83 -3.031 -9.649 4.084 1.00 0.00 O ATOM 1280 CB ASP A 83 -1.743 -7.163 5.216 1.00 0.00 C ATOM 1281 CG ASP A 83 -0.600 -6.558 6.028 1.00 0.00 C ATOM 1282 OD1 ASP A 83 0.368 -7.283 6.345 1.00 0.00 O ATOM 1283 OD2 ASP A 83 -0.670 -5.357 6.360 1.00 0.00 O ATOM 0 H ASP A 83 -0.709 -6.125 3.176 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.547 -8.750 4.302 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -2.391 -6.360 4.864 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.345 -7.796 5.868 1.00 0.00 H new ATOM 1288 N SER A 84 -2.865 -8.444 2.208 1.00 0.00 N ATOM 1289 CA SER A 84 -4.049 -9.042 1.576 1.00 0.00 C ATOM 1290 C SER A 84 -3.739 -10.183 0.587 1.00 0.00 C ATOM 1291 O SER A 84 -4.592 -10.541 -0.227 1.00 0.00 O ATOM 1292 CB SER A 84 -4.724 -7.896 0.821 1.00 0.00 C ATOM 1293 OG SER A 84 -5.184 -6.901 1.725 1.00 0.00 O ATOM 0 H SER A 84 -2.382 -7.761 1.624 1.00 0.00 H new ATOM 0 HA SER A 84 -4.669 -9.498 2.348 1.00 0.00 H new ATOM 0 HB2 SER A 84 -4.021 -7.455 0.115 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.561 -8.281 0.239 1.00 0.00 H new ATOM 0 HG SER A 84 -5.314 -6.057 1.244 1.00 0.00 H new ATOM 1299 N LEU A 85 -2.525 -10.730 0.607 1.00 0.00 N ATOM 1300 CA LEU A 85 -2.028 -11.478 -0.552 1.00 0.00 C ATOM 1301 C LEU A 85 -1.378 -12.805 -0.131 1.00 0.00 C ATOM 1302 O LEU A 85 -1.409 -13.211 1.033 1.00 0.00 O ATOM 1303 CB LEU A 85 -0.956 -10.580 -1.198 1.00 0.00 C ATOM 1304 CG LEU A 85 -1.385 -9.155 -1.583 1.00 0.00 C ATOM 1305 CD1 LEU A 85 -0.187 -8.404 -2.169 1.00 0.00 C ATOM 1306 CD2 LEU A 85 -2.526 -9.132 -2.606 1.00 0.00 C ATOM 0 H LEU A 85 -1.878 -10.673 1.393 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.847 -11.719 -1.230 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.114 -10.507 -0.509 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.591 -11.079 -2.096 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.746 -8.676 -0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.490 -7.393 -2.443 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.610 -8.356 -1.427 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.173 -8.927 -3.055 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.785 -8.099 -2.839 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.209 -9.640 -3.516 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.397 -9.640 -2.191 1.00 0.00 H new ATOM 1318 N LYS A 86 -0.827 -13.502 -1.121 1.00 0.00 N ATOM 1319 CA LYS A 86 -0.349 -14.878 -0.928 1.00 0.00 C ATOM 1320 C LYS A 86 1.173 -14.883 -1.190 1.00 0.00 C ATOM 1321 O LYS A 86 1.725 -13.905 -1.700 1.00 0.00 O ATOM 1322 CB LYS A 86 -1.079 -15.803 -1.919 1.00 0.00 C ATOM 1323 CG LYS A 86 -2.602 -15.898 -1.724 1.00 0.00 C ATOM 1324 CD LYS A 86 -3.070 -16.944 -0.704 1.00 0.00 C ATOM 1325 CE LYS A 86 -2.745 -16.590 0.750 1.00 0.00 C ATOM 1326 NZ LYS A 86 -3.421 -17.527 1.662 1.00 0.00 N ATOM 0 H LYS A 86 -0.698 -13.141 -2.066 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.548 -15.234 0.083 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.879 -15.454 -2.932 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.655 -16.804 -1.837 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.973 -14.921 -1.414 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.061 -16.123 -2.687 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -4.148 -17.075 -0.802 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.609 -17.902 -0.945 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.667 -16.629 0.910 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -3.063 -15.569 0.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.194 -17.278 2.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.449 -17.470 1.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.098 -18.496 1.466 1.00 0.00 H new ATOM 1340 N PRO A 87 1.867 -16.007 -0.977 1.00 0.00 N ATOM 1341 CA PRO A 87 3.274 -16.147 -1.396 1.00 0.00 C ATOM 1342 C PRO A 87 3.673 -15.815 -2.858 1.00 0.00 C ATOM 1343 O PRO A 87 4.812 -15.409 -3.087 1.00 0.00 O ATOM 1344 CB PRO A 87 3.531 -17.613 -1.033 1.00 0.00 C ATOM 1345 CG PRO A 87 2.679 -17.861 0.211 1.00 0.00 C ATOM 1346 CD PRO A 87 1.428 -17.005 0.013 1.00 0.00 C ATOM 0 HA PRO A 87 3.890 -15.393 -0.906 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.245 -18.278 -1.848 1.00 0.00 H new ATOM 0 HB3 PRO A 87 4.587 -17.792 -0.831 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.423 -18.916 0.310 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.213 -17.576 1.118 1.00 0.00 H new ATOM 0 HD2 PRO A 87 0.588 -17.595 -0.353 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.107 -16.537 0.944 1.00 0.00 H new ATOM 1354 N ASN A 88 2.786 -15.963 -3.847 1.00 0.00 N ATOM 1355 CA ASN A 88 3.063 -15.452 -5.210 1.00 0.00 C ATOM 1356 C ASN A 88 2.280 -14.145 -5.405 1.00 0.00 C ATOM 1357 O ASN A 88 1.527 -13.982 -6.366 1.00 0.00 O ATOM 1358 CB ASN A 88 2.678 -16.535 -6.251 1.00 0.00 C ATOM 1359 CG ASN A 88 3.408 -17.859 -6.026 1.00 0.00 C ATOM 1360 OD1 ASN A 88 2.821 -18.855 -5.608 1.00 0.00 O ATOM 1361 ND2 ASN A 88 4.701 -17.886 -6.297 1.00 0.00 N ATOM 0 H ASN A 88 1.882 -16.423 -3.742 1.00 0.00 H new ATOM 0 HA ASN A 88 4.123 -15.236 -5.346 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.602 -16.707 -6.209 1.00 0.00 H new ATOM 0 HB3 ASN A 88 2.903 -16.167 -7.252 1.00 0.00 H new ATOM 0 HD21 ASN A 88 5.233 -18.746 -6.160 1.00 0.00 H new ATOM 0 HD22 ASN A 88 5.167 -17.047 -6.643 1.00 0.00 H new ATOM 1368 N GLY A 89 2.481 -13.193 -4.493 1.00 0.00 N ATOM 1369 CA GLY A 89 1.889 -11.863 -4.650 1.00 0.00 C ATOM 1370 C GLY A 89 2.724 -11.092 -5.656 1.00 0.00 C ATOM 1371 O GLY A 89 3.948 -11.201 -5.663 1.00 0.00 O ATOM 0 H GLY A 89 3.041 -13.314 -3.649 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.858 -11.943 -4.993 1.00 0.00 H new ATOM 0 HA3 GLY A 89 1.867 -11.341 -3.694 1.00 0.00 H new ATOM 1375 N SER A 90 2.070 -10.357 -6.541 1.00 0.00 N ATOM 1376 CA SER A 90 2.804 -9.738 -7.642 1.00 0.00 C ATOM 1377 C SER A 90 2.132 -8.387 -7.831 1.00 0.00 C ATOM 1378 O SER A 90 1.017 -8.283 -8.343 1.00 0.00 O ATOM 1379 CB SER A 90 2.716 -10.602 -8.909 1.00 0.00 C ATOM 1380 OG SER A 90 1.362 -10.842 -9.276 1.00 0.00 O ATOM 0 H SER A 90 1.066 -10.176 -6.526 1.00 0.00 H new ATOM 0 HA SER A 90 3.869 -9.634 -7.434 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.235 -10.104 -9.728 1.00 0.00 H new ATOM 0 HB3 SER A 90 3.224 -11.552 -8.741 1.00 0.00 H new ATOM 0 HG SER A 90 0.799 -10.112 -8.944 1.00 0.00 H new ATOM 1386 N LEU A 91 2.805 -7.350 -7.366 1.00 0.00 N ATOM 1387 CA LEU A 91 2.301 -5.995 -7.502 1.00 0.00 C ATOM 1388 C LEU A 91 2.834 -5.458 -8.826 1.00 0.00 C ATOM 1389 O LEU A 91 4.027 -5.553 -9.073 1.00 0.00 O ATOM 1390 CB LEU A 91 2.932 -5.297 -6.294 1.00 0.00 C ATOM 1391 CG LEU A 91 2.685 -3.796 -6.238 1.00 0.00 C ATOM 1392 CD1 LEU A 91 2.326 -3.381 -4.813 1.00 0.00 C ATOM 1393 CD2 LEU A 91 3.895 -2.985 -6.707 1.00 0.00 C ATOM 0 H LEU A 91 3.704 -7.420 -6.890 1.00 0.00 H new ATOM 0 HA LEU A 91 1.218 -5.873 -7.516 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.543 -5.752 -5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.007 -5.476 -6.306 1.00 0.00 H new ATOM 0 HG LEU A 91 1.859 -3.584 -6.917 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.151 -2.306 -4.780 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.424 -3.905 -4.498 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.147 -3.635 -4.142 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.665 -1.921 -6.647 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.751 -3.208 -6.070 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.131 -3.248 -7.738 1.00 0.00 H new ATOM 1405 N ILE A 92 2.009 -4.899 -9.701 1.00 0.00 N ATOM 1406 CA ILE A 92 2.507 -4.586 -11.050 1.00 0.00 C ATOM 1407 C ILE A 92 2.471 -3.086 -11.126 1.00 0.00 C ATOM 1408 O ILE A 92 1.456 -2.476 -11.475 1.00 0.00 O ATOM 1409 CB ILE A 92 1.679 -5.220 -12.186 1.00 0.00 C ATOM 1410 CG1 ILE A 92 1.654 -6.756 -12.172 1.00 0.00 C ATOM 1411 CG2 ILE A 92 2.163 -4.780 -13.572 1.00 0.00 C ATOM 1412 CD1 ILE A 92 0.621 -7.309 -11.200 1.00 0.00 C ATOM 0 H ILE A 92 1.034 -4.659 -9.523 1.00 0.00 H new ATOM 0 HA ILE A 92 3.504 -5.001 -11.194 1.00 0.00 H new ATOM 0 HB ILE A 92 0.670 -4.856 -11.995 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.438 -7.123 -13.175 1.00 0.00 H new ATOM 0 HG13 ILE A 92 2.641 -7.131 -11.901 1.00 0.00 H new ATOM 0 HG21 ILE A 92 1.549 -5.253 -14.339 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.082 -3.697 -13.659 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.203 -5.078 -13.706 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.642 -8.398 -11.227 1.00 0.00 H new ATOM 0 HD12 ILE A 92 0.851 -6.967 -10.191 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.371 -6.958 -11.485 1.00 0.00 H new ATOM 1424 N GLY A 93 3.560 -2.515 -10.630 1.00 0.00 N ATOM 1425 CA GLY A 93 3.380 -1.140 -10.162 1.00 0.00 C ATOM 1426 C GLY A 93 4.462 -0.089 -10.334 1.00 0.00 C ATOM 1427 O GLY A 93 4.356 0.790 -11.189 1.00 0.00 O ATOM 0 H GLY A 93 4.490 -2.926 -10.543 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.485 -0.755 -10.651 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.161 -1.196 -9.096 1.00 0.00 H new ATOM 1431 N LEU A 94 5.446 -0.089 -9.455 1.00 0.00 N ATOM 1432 CA LEU A 94 5.959 1.195 -8.962 1.00 0.00 C ATOM 1433 C LEU A 94 7.418 1.381 -9.398 1.00 0.00 C ATOM 1434 O LEU A 94 8.041 0.516 -10.015 1.00 0.00 O ATOM 1435 CB LEU A 94 5.952 1.043 -7.428 1.00 0.00 C ATOM 1436 CG LEU A 94 4.676 1.252 -6.599 1.00 0.00 C ATOM 1437 CD1 LEU A 94 3.372 0.891 -7.253 1.00 0.00 C ATOM 1438 CD2 LEU A 94 4.776 0.456 -5.300 1.00 0.00 C ATOM 0 H LEU A 94 5.897 -0.921 -9.074 1.00 0.00 H new ATOM 0 HA LEU A 94 5.371 2.035 -9.332 1.00 0.00 H new ATOM 0 HB2 LEU A 94 6.308 0.036 -7.209 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.698 1.737 -7.039 1.00 0.00 H new ATOM 0 HG LEU A 94 4.642 2.331 -6.450 1.00 0.00 H new ATOM 0 HD11 LEU A 94 2.552 1.086 -6.562 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.238 1.491 -8.153 1.00 0.00 H new ATOM 0 HD13 LEU A 94 3.379 -0.166 -7.519 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.870 0.604 -4.712 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.890 -0.603 -5.530 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.639 0.798 -4.729 1.00 0.00 H new ATOM 1450 N SER A 95 7.909 2.599 -9.183 1.00 0.00 N ATOM 1451 CA SER A 95 9.076 3.081 -9.955 1.00 0.00 C ATOM 1452 C SER A 95 10.380 3.019 -9.135 1.00 0.00 C ATOM 1453 O SER A 95 10.578 2.107 -8.332 1.00 0.00 O ATOM 1454 CB SER A 95 8.769 4.461 -10.572 1.00 0.00 C ATOM 1455 OG SER A 95 9.712 4.759 -11.591 1.00 0.00 O ATOM 0 H SER A 95 7.537 3.262 -8.503 1.00 0.00 H new ATOM 0 HA SER A 95 9.257 2.405 -10.791 1.00 0.00 H new ATOM 0 HB2 SER A 95 7.761 4.467 -10.986 1.00 0.00 H new ATOM 0 HB3 SER A 95 8.801 5.229 -9.799 1.00 0.00 H new ATOM 0 HG SER A 95 9.509 5.636 -11.978 1.00 0.00 H new ATOM 1461 N ASP A 96 11.312 3.937 -9.396 1.00 0.00 N ATOM 1462 CA ASP A 96 12.702 3.750 -8.945 1.00 0.00 C ATOM 1463 C ASP A 96 12.961 4.083 -7.476 1.00 0.00 C ATOM 1464 O ASP A 96 13.666 3.337 -6.796 1.00 0.00 O ATOM 1465 CB ASP A 96 13.642 4.592 -9.815 1.00 0.00 C ATOM 1466 CG ASP A 96 13.671 4.140 -11.272 1.00 0.00 C ATOM 1467 OD1 ASP A 96 14.384 3.161 -11.585 1.00 0.00 O ATOM 1468 OD2 ASP A 96 12.984 4.762 -12.111 1.00 0.00 O ATOM 0 H ASP A 96 11.140 4.803 -9.907 1.00 0.00 H new ATOM 0 HA ASP A 96 12.894 2.682 -9.049 1.00 0.00 H new ATOM 0 HB2 ASP A 96 13.332 5.636 -9.770 1.00 0.00 H new ATOM 0 HB3 ASP A 96 14.651 4.541 -9.405 1.00 0.00 H new ATOM 1473 N ILE A 97 12.407 5.176 -6.963 1.00 0.00 N ATOM 1474 CA ILE A 97 12.424 5.397 -5.504 1.00 0.00 C ATOM 1475 C ILE A 97 11.743 4.254 -4.712 1.00 0.00 C ATOM 1476 O ILE A 97 12.125 3.820 -3.611 1.00 0.00 O ATOM 1477 CB ILE A 97 11.752 6.761 -5.249 1.00 0.00 C ATOM 1478 CG1 ILE A 97 11.872 7.121 -3.774 1.00 0.00 C ATOM 1479 CG2 ILE A 97 10.267 6.855 -5.637 1.00 0.00 C ATOM 1480 CD1 ILE A 97 13.328 7.349 -3.376 1.00 0.00 C ATOM 0 H ILE A 97 11.951 5.908 -7.508 1.00 0.00 H new ATOM 0 HA ILE A 97 13.452 5.401 -5.143 1.00 0.00 H new ATOM 0 HB ILE A 97 12.285 7.455 -5.900 1.00 0.00 H new ATOM 0 HG12 ILE A 97 11.291 8.020 -3.568 1.00 0.00 H new ATOM 0 HG13 ILE A 97 11.447 6.322 -3.167 1.00 0.00 H new ATOM 0 HG21 ILE A 97 9.896 7.856 -5.416 1.00 0.00 H new ATOM 0 HG22 ILE A 97 10.156 6.654 -6.703 1.00 0.00 H new ATOM 0 HG23 ILE A 97 9.695 6.122 -5.068 1.00 0.00 H new ATOM 0 HD11 ILE A 97 13.380 7.604 -2.318 1.00 0.00 H new ATOM 0 HD12 ILE A 97 13.902 6.440 -3.559 1.00 0.00 H new ATOM 0 HD13 ILE A 97 13.743 8.165 -3.967 1.00 0.00 H new ATOM 1492 N TYR A 98 10.738 3.704 -5.365 1.00 0.00 N ATOM 1493 CA TYR A 98 9.973 2.643 -4.753 1.00 0.00 C ATOM 1494 C TYR A 98 10.773 1.314 -4.799 1.00 0.00 C ATOM 1495 O TYR A 98 10.406 0.361 -4.126 1.00 0.00 O ATOM 1496 CB TYR A 98 8.625 2.515 -5.439 1.00 0.00 C ATOM 1497 CG TYR A 98 7.778 3.774 -5.464 1.00 0.00 C ATOM 1498 CD1 TYR A 98 6.934 4.031 -4.428 1.00 0.00 C ATOM 1499 CD2 TYR A 98 7.781 4.593 -6.550 1.00 0.00 C ATOM 1500 CE1 TYR A 98 6.058 5.062 -4.505 1.00 0.00 C ATOM 1501 CE2 TYR A 98 6.900 5.621 -6.630 1.00 0.00 C ATOM 1502 CZ TYR A 98 6.031 5.853 -5.611 1.00 0.00 C ATOM 1503 OH TYR A 98 5.126 6.878 -5.700 1.00 0.00 O ATOM 0 H TYR A 98 10.438 3.970 -6.303 1.00 0.00 H new ATOM 0 HA TYR A 98 9.791 2.881 -3.705 1.00 0.00 H new ATOM 0 HB2 TYR A 98 8.790 2.190 -6.466 1.00 0.00 H new ATOM 0 HB3 TYR A 98 8.058 1.728 -4.942 1.00 0.00 H new ATOM 0 HD1 TYR A 98 6.962 3.412 -3.543 1.00 0.00 H new ATOM 0 HD2 TYR A 98 8.486 4.424 -7.350 1.00 0.00 H new ATOM 0 HE1 TYR A 98 5.380 5.256 -3.687 1.00 0.00 H new ATOM 0 HE2 TYR A 98 6.889 6.256 -7.504 1.00 0.00 H new ATOM 0 HH TYR A 98 5.243 7.344 -6.554 1.00 0.00 H new ATOM 1513 N LYS A 99 11.893 1.242 -5.534 1.00 0.00 N ATOM 1514 CA LYS A 99 12.825 0.100 -5.433 1.00 0.00 C ATOM 1515 C LYS A 99 13.383 -0.077 -4.010 1.00 0.00 C ATOM 1516 O LYS A 99 13.337 -1.178 -3.463 1.00 0.00 O ATOM 1517 CB LYS A 99 13.967 0.307 -6.440 1.00 0.00 C ATOM 1518 CG LYS A 99 14.961 -0.858 -6.440 1.00 0.00 C ATOM 1519 CD LYS A 99 16.097 -0.629 -7.442 1.00 0.00 C ATOM 1520 CE LYS A 99 17.083 -1.797 -7.432 1.00 0.00 C ATOM 1521 NZ LYS A 99 18.167 -1.557 -8.398 1.00 0.00 N ATOM 0 H LYS A 99 12.178 1.957 -6.204 1.00 0.00 H new ATOM 0 HA LYS A 99 12.277 -0.814 -5.665 1.00 0.00 H new ATOM 0 HB2 LYS A 99 13.550 0.425 -7.440 1.00 0.00 H new ATOM 0 HB3 LYS A 99 14.494 1.231 -6.203 1.00 0.00 H new ATOM 0 HG2 LYS A 99 15.377 -0.983 -5.440 1.00 0.00 H new ATOM 0 HG3 LYS A 99 14.439 -1.783 -6.686 1.00 0.00 H new ATOM 0 HD2 LYS A 99 15.684 -0.506 -8.443 1.00 0.00 H new ATOM 0 HD3 LYS A 99 16.621 0.295 -7.198 1.00 0.00 H new ATOM 0 HE2 LYS A 99 17.499 -1.923 -6.432 1.00 0.00 H new ATOM 0 HE3 LYS A 99 16.564 -2.723 -7.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 18.830 -2.358 -8.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 17.766 -1.459 -9.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 18.672 -0.684 -8.143 1.00 0.00 H new ATOM 1535 N VAL A 100 13.900 0.990 -3.404 1.00 0.00 N ATOM 1536 CA VAL A 100 14.308 0.922 -1.986 1.00 0.00 C ATOM 1537 C VAL A 100 13.096 0.641 -1.073 1.00 0.00 C ATOM 1538 O VAL A 100 13.207 -0.092 -0.085 1.00 0.00 O ATOM 1539 CB VAL A 100 15.035 2.224 -1.582 1.00 0.00 C ATOM 1540 CG1 VAL A 100 15.504 2.178 -0.123 1.00 0.00 C ATOM 1541 CG2 VAL A 100 16.260 2.485 -2.465 1.00 0.00 C ATOM 0 H VAL A 100 14.047 1.895 -3.851 1.00 0.00 H new ATOM 0 HA VAL A 100 15.003 0.091 -1.860 1.00 0.00 H new ATOM 0 HB VAL A 100 14.309 3.027 -1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 100 16.011 3.110 0.126 1.00 0.00 H new ATOM 0 HG12 VAL A 100 14.643 2.047 0.532 1.00 0.00 H new ATOM 0 HG13 VAL A 100 16.192 1.344 0.012 1.00 0.00 H new ATOM 0 HG21 VAL A 100 16.745 3.409 -2.151 1.00 0.00 H new ATOM 0 HG22 VAL A 100 16.961 1.656 -2.369 1.00 0.00 H new ATOM 0 HG23 VAL A 100 15.946 2.576 -3.505 1.00 0.00 H new ATOM 1551 N ASP A 101 11.928 1.187 -1.419 1.00 0.00 N ATOM 1552 CA ASP A 101 10.691 0.824 -0.703 1.00 0.00 C ATOM 1553 C ASP A 101 10.354 -0.676 -0.794 1.00 0.00 C ATOM 1554 O ASP A 101 10.063 -1.309 0.217 1.00 0.00 O ATOM 1555 CB ASP A 101 9.560 1.654 -1.314 1.00 0.00 C ATOM 1556 CG ASP A 101 8.972 2.688 -0.362 1.00 0.00 C ATOM 1557 OD1 ASP A 101 8.042 2.345 0.400 1.00 0.00 O ATOM 1558 OD2 ASP A 101 9.435 3.849 -0.372 1.00 0.00 O ATOM 0 H ASP A 101 11.807 1.866 -2.171 1.00 0.00 H new ATOM 0 HA ASP A 101 10.825 1.032 0.358 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.935 2.163 -2.202 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.766 0.983 -1.642 1.00 0.00 H new ATOM 1563 N ALA A 102 10.406 -1.242 -2.001 1.00 0.00 N ATOM 1564 CA ALA A 102 10.209 -2.685 -2.200 1.00 0.00 C ATOM 1565 C ALA A 102 11.203 -3.518 -1.380 1.00 0.00 C ATOM 1566 O ALA A 102 10.840 -4.518 -0.765 1.00 0.00 O ATOM 1567 CB ALA A 102 10.457 -2.939 -3.684 1.00 0.00 C ATOM 0 H ALA A 102 10.584 -0.723 -2.861 1.00 0.00 H new ATOM 0 HA ALA A 102 9.208 -2.974 -1.879 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.326 -4.000 -3.899 1.00 0.00 H new ATOM 0 HB2 ALA A 102 9.749 -2.359 -4.276 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.474 -2.641 -3.939 1.00 0.00 H new ATOM 1573 N LEU A 103 12.464 -3.086 -1.370 1.00 0.00 N ATOM 1574 CA LEU A 103 13.512 -3.802 -0.626 1.00 0.00 C ATOM 1575 C LEU A 103 13.236 -3.881 0.886 1.00 0.00 C ATOM 1576 O LEU A 103 13.414 -4.935 1.495 1.00 0.00 O ATOM 1577 CB LEU A 103 14.847 -3.084 -0.898 1.00 0.00 C ATOM 1578 CG LEU A 103 16.084 -3.815 -0.351 1.00 0.00 C ATOM 1579 CD1 LEU A 103 16.308 -5.157 -1.055 1.00 0.00 C ATOM 1580 CD2 LEU A 103 17.321 -2.931 -0.535 1.00 0.00 C ATOM 0 H LEU A 103 12.787 -2.253 -1.862 1.00 0.00 H new ATOM 0 HA LEU A 103 13.540 -4.836 -0.970 1.00 0.00 H new ATOM 0 HB2 LEU A 103 14.963 -2.954 -1.974 1.00 0.00 H new ATOM 0 HB3 LEU A 103 14.805 -2.087 -0.459 1.00 0.00 H new ATOM 0 HG LEU A 103 15.915 -4.015 0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 103 17.191 -5.642 -0.640 1.00 0.00 H new ATOM 0 HD12 LEU A 103 15.438 -5.796 -0.905 1.00 0.00 H new ATOM 0 HD13 LEU A 103 16.454 -4.988 -2.122 1.00 0.00 H new ATOM 0 HD21 LEU A 103 18.199 -3.448 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 103 17.463 -2.720 -1.595 1.00 0.00 H new ATOM 0 HD23 LEU A 103 17.183 -1.995 0.006 1.00 0.00 H new ATOM 1592 N ILE A 104 12.821 -2.772 1.499 1.00 0.00 N ATOM 1593 CA ILE A 104 12.622 -2.756 2.961 1.00 0.00 C ATOM 1594 C ILE A 104 11.277 -3.398 3.367 1.00 0.00 C ATOM 1595 O ILE A 104 11.203 -4.081 4.390 1.00 0.00 O ATOM 1596 CB ILE A 104 12.807 -1.316 3.480 1.00 0.00 C ATOM 1597 CG1 ILE A 104 14.249 -0.840 3.226 1.00 0.00 C ATOM 1598 CG2 ILE A 104 12.481 -1.206 4.979 1.00 0.00 C ATOM 1599 CD1 ILE A 104 14.456 0.649 3.517 1.00 0.00 C ATOM 0 H ILE A 104 12.619 -1.891 1.027 1.00 0.00 H new ATOM 0 HA ILE A 104 13.377 -3.378 3.441 1.00 0.00 H new ATOM 0 HB ILE A 104 12.111 -0.679 2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 104 14.931 -1.422 3.846 1.00 0.00 H new ATOM 0 HG13 ILE A 104 14.513 -1.040 2.187 1.00 0.00 H new ATOM 0 HG21 ILE A 104 12.623 -0.177 5.308 1.00 0.00 H new ATOM 0 HG22 ILE A 104 11.446 -1.501 5.149 1.00 0.00 H new ATOM 0 HG23 ILE A 104 13.143 -1.862 5.544 1.00 0.00 H new ATOM 0 HD11 ILE A 104 15.493 0.918 3.317 1.00 0.00 H new ATOM 0 HD12 ILE A 104 13.799 1.239 2.879 1.00 0.00 H new ATOM 0 HD13 ILE A 104 14.224 0.851 4.563 1.00 0.00 H new ATOM 1611 N ASN A 105 10.229 -3.228 2.566 1.00 0.00 N ATOM 1612 CA ASN A 105 8.931 -3.837 2.842 1.00 0.00 C ATOM 1613 C ASN A 105 8.874 -5.358 2.636 1.00 0.00 C ATOM 1614 O ASN A 105 7.954 -5.996 3.148 1.00 0.00 O ATOM 1615 CB ASN A 105 7.984 -3.117 1.868 1.00 0.00 C ATOM 1616 CG ASN A 105 7.334 -1.872 2.473 1.00 0.00 C ATOM 1617 OD1 ASN A 105 6.341 -1.956 3.193 1.00 0.00 O ATOM 1618 ND2 ASN A 105 7.878 -0.703 2.184 1.00 0.00 N ATOM 0 H ASN A 105 10.254 -2.669 1.713 1.00 0.00 H new ATOM 0 HA ASN A 105 8.671 -3.722 3.894 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.540 -2.832 0.975 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.204 -3.809 1.551 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.474 0.155 2.561 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.702 -0.658 1.584 1.00 0.00 H new ATOM 1625 N GLY A 106 9.811 -5.955 1.900 1.00 0.00 N ATOM 1626 CA GLY A 106 9.763 -7.413 1.701 1.00 0.00 C ATOM 1627 C GLY A 106 9.255 -7.802 0.309 1.00 0.00 C ATOM 1628 O GLY A 106 8.670 -8.869 0.133 1.00 0.00 O ATOM 0 H GLY A 106 10.588 -5.477 1.444 1.00 0.00 H new ATOM 0 HA2 GLY A 106 10.760 -7.829 1.849 1.00 0.00 H new ATOM 0 HA3 GLY A 106 9.116 -7.858 2.457 1.00 0.00 H new ATOM 1632 N PHE A 107 9.508 -6.951 -0.678 1.00 0.00 N ATOM 1633 CA PHE A 107 9.140 -7.268 -2.066 1.00 0.00 C ATOM 1634 C PHE A 107 10.418 -7.603 -2.849 1.00 0.00 C ATOM 1635 O PHE A 107 11.532 -7.228 -2.477 1.00 0.00 O ATOM 1636 CB PHE A 107 8.375 -6.127 -2.759 1.00 0.00 C ATOM 1637 CG PHE A 107 6.973 -5.851 -2.239 1.00 0.00 C ATOM 1638 CD1 PHE A 107 6.783 -5.003 -1.194 1.00 0.00 C ATOM 1639 CD2 PHE A 107 5.894 -6.382 -2.882 1.00 0.00 C ATOM 1640 CE1 PHE A 107 5.525 -4.706 -0.774 1.00 0.00 C ATOM 1641 CE2 PHE A 107 4.638 -6.081 -2.465 1.00 0.00 C ATOM 1642 CZ PHE A 107 4.453 -5.246 -1.410 1.00 0.00 C ATOM 0 H PHE A 107 9.960 -6.045 -0.553 1.00 0.00 H new ATOM 0 HA PHE A 107 8.463 -8.122 -2.047 1.00 0.00 H new ATOM 0 HB2 PHE A 107 8.962 -5.213 -2.665 1.00 0.00 H new ATOM 0 HB3 PHE A 107 8.308 -6.355 -3.823 1.00 0.00 H new ATOM 0 HD1 PHE A 107 7.635 -4.564 -0.696 1.00 0.00 H new ATOM 0 HD2 PHE A 107 6.039 -7.043 -3.724 1.00 0.00 H new ATOM 0 HE1 PHE A 107 5.378 -4.041 0.064 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.785 -6.506 -2.973 1.00 0.00 H new ATOM 0 HZ PHE A 107 3.453 -5.011 -1.076 1.00 0.00 H new ATOM 1652 N GLU A 108 10.233 -8.300 -3.964 1.00 0.00 N ATOM 1653 CA GLU A 108 11.363 -8.690 -4.816 1.00 0.00 C ATOM 1654 C GLU A 108 11.083 -8.162 -6.224 1.00 0.00 C ATOM 1655 O GLU A 108 10.233 -8.677 -6.954 1.00 0.00 O ATOM 1656 CB GLU A 108 11.524 -10.219 -4.793 1.00 0.00 C ATOM 1657 CG GLU A 108 12.787 -10.682 -5.530 1.00 0.00 C ATOM 1658 CD GLU A 108 12.919 -12.199 -5.482 1.00 0.00 C ATOM 1659 OE1 GLU A 108 13.506 -12.723 -4.511 1.00 0.00 O ATOM 1660 OE2 GLU A 108 12.437 -12.874 -6.417 1.00 0.00 O ATOM 0 H GLU A 108 9.321 -8.607 -4.302 1.00 0.00 H new ATOM 0 HA GLU A 108 12.301 -8.266 -4.457 1.00 0.00 H new ATOM 0 HB2 GLU A 108 11.563 -10.563 -3.759 1.00 0.00 H new ATOM 0 HB3 GLU A 108 10.649 -10.681 -5.250 1.00 0.00 H new ATOM 0 HG2 GLU A 108 12.750 -10.349 -6.567 1.00 0.00 H new ATOM 0 HG3 GLU A 108 13.666 -10.222 -5.078 1.00 0.00 H new ATOM 1667 N ILE A 109 11.788 -7.100 -6.591 1.00 0.00 N ATOM 1668 CA ILE A 109 11.450 -6.337 -7.793 1.00 0.00 C ATOM 1669 C ILE A 109 11.872 -7.063 -9.072 1.00 0.00 C ATOM 1670 O ILE A 109 12.887 -7.761 -9.121 1.00 0.00 O ATOM 1671 CB ILE A 109 12.152 -4.983 -7.586 1.00 0.00 C ATOM 1672 CG1 ILE A 109 11.741 -3.848 -8.520 1.00 0.00 C ATOM 1673 CG2 ILE A 109 13.652 -5.125 -7.729 1.00 0.00 C ATOM 1674 CD1 ILE A 109 12.381 -2.530 -8.092 1.00 0.00 C ATOM 0 H ILE A 109 12.595 -6.745 -6.078 1.00 0.00 H new ATOM 0 HA ILE A 109 10.376 -6.207 -7.927 1.00 0.00 H new ATOM 0 HB ILE A 109 11.834 -4.708 -6.580 1.00 0.00 H new ATOM 0 HG12 ILE A 109 12.039 -4.086 -9.541 1.00 0.00 H new ATOM 0 HG13 ILE A 109 10.656 -3.747 -8.520 1.00 0.00 H new ATOM 0 HG21 ILE A 109 14.125 -4.155 -7.578 1.00 0.00 H new ATOM 0 HG22 ILE A 109 14.023 -5.829 -6.985 1.00 0.00 H new ATOM 0 HG23 ILE A 109 13.889 -5.493 -8.727 1.00 0.00 H new ATOM 0 HD11 ILE A 109 12.072 -1.737 -8.774 1.00 0.00 H new ATOM 0 HD12 ILE A 109 12.062 -2.283 -7.080 1.00 0.00 H new ATOM 0 HD13 ILE A 109 13.466 -2.628 -8.117 1.00 0.00 H new ATOM 1686 N ILE A 110 11.073 -6.875 -10.113 1.00 0.00 N ATOM 1687 CA ILE A 110 11.408 -7.448 -11.422 1.00 0.00 C ATOM 1688 C ILE A 110 10.988 -6.456 -12.511 1.00 0.00 C ATOM 1689 O ILE A 110 9.898 -5.880 -12.481 1.00 0.00 O ATOM 1690 CB ILE A 110 10.797 -8.846 -11.646 1.00 0.00 C ATOM 1691 CG1 ILE A 110 9.278 -8.934 -11.402 1.00 0.00 C ATOM 1692 CG2 ILE A 110 11.548 -9.896 -10.814 1.00 0.00 C ATOM 1693 CD1 ILE A 110 8.700 -10.284 -11.838 1.00 0.00 C ATOM 0 H ILE A 110 10.204 -6.342 -10.086 1.00 0.00 H new ATOM 0 HA ILE A 110 12.486 -7.606 -11.465 1.00 0.00 H new ATOM 0 HB ILE A 110 10.923 -9.054 -12.708 1.00 0.00 H new ATOM 0 HG12 ILE A 110 9.072 -8.777 -10.343 1.00 0.00 H new ATOM 0 HG13 ILE A 110 8.777 -8.133 -11.946 1.00 0.00 H new ATOM 0 HG21 ILE A 110 11.106 -10.878 -10.982 1.00 0.00 H new ATOM 0 HG22 ILE A 110 12.596 -9.914 -11.112 1.00 0.00 H new ATOM 0 HG23 ILE A 110 11.476 -9.642 -9.756 1.00 0.00 H new ATOM 0 HD11 ILE A 110 7.627 -10.299 -11.647 1.00 0.00 H new ATOM 0 HD12 ILE A 110 8.881 -10.430 -12.903 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.180 -11.084 -11.275 1.00 0.00 H new ATOM 1705 N ASN A 111 11.888 -6.251 -13.471 1.00 0.00 N ATOM 1706 CA ASN A 111 11.665 -5.247 -14.517 1.00 0.00 C ATOM 1707 C ASN A 111 11.467 -5.928 -15.871 1.00 0.00 C ATOM 1708 O ASN A 111 12.403 -6.330 -16.564 1.00 0.00 O ATOM 1709 CB ASN A 111 12.792 -4.208 -14.547 1.00 0.00 C ATOM 1710 CG ASN A 111 14.212 -4.761 -14.694 1.00 0.00 C ATOM 1711 OD1 ASN A 111 14.709 -4.979 -15.798 1.00 0.00 O ATOM 1712 ND2 ASN A 111 14.892 -4.976 -13.582 1.00 0.00 N ATOM 0 H ASN A 111 12.769 -6.759 -13.549 1.00 0.00 H new ATOM 0 HA ASN A 111 10.751 -4.701 -14.285 1.00 0.00 H new ATOM 0 HB2 ASN A 111 12.604 -3.521 -15.372 1.00 0.00 H new ATOM 0 HB3 ASN A 111 12.745 -3.623 -13.628 1.00 0.00 H new ATOM 0 HD21 ASN A 111 15.848 -5.329 -13.629 1.00 0.00 H new ATOM 0 HD22 ASN A 111 14.461 -4.789 -12.677 1.00 0.00 H new ATOM 1719 N GLU A 112 10.200 -6.025 -16.229 1.00 0.00 N ATOM 1720 CA GLU A 112 9.811 -6.452 -17.583 1.00 0.00 C ATOM 1721 C GLU A 112 8.856 -5.389 -18.165 1.00 0.00 C ATOM 1722 O GLU A 112 8.431 -4.491 -17.436 1.00 0.00 O ATOM 1723 CB GLU A 112 9.116 -7.820 -17.486 1.00 0.00 C ATOM 1724 CG GLU A 112 10.068 -8.939 -17.052 1.00 0.00 C ATOM 1725 CD GLU A 112 9.344 -10.276 -16.970 1.00 0.00 C ATOM 1726 OE1 GLU A 112 9.293 -10.997 -17.991 1.00 0.00 O ATOM 1727 OE2 GLU A 112 8.824 -10.616 -15.887 1.00 0.00 O ATOM 0 H GLU A 112 9.416 -5.817 -15.611 1.00 0.00 H new ATOM 0 HA GLU A 112 10.679 -6.548 -18.235 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.292 -7.754 -16.776 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.683 -8.072 -18.454 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.894 -9.012 -17.760 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.500 -8.696 -16.081 1.00 0.00 H new ATOM 1734 N PRO A 113 8.458 -5.457 -19.446 1.00 0.00 N ATOM 1735 CA PRO A 113 7.547 -4.447 -20.024 1.00 0.00 C ATOM 1736 C PRO A 113 6.189 -4.185 -19.341 1.00 0.00 C ATOM 1737 O PRO A 113 5.506 -3.207 -19.648 1.00 0.00 O ATOM 1738 CB PRO A 113 7.400 -4.939 -21.461 1.00 0.00 C ATOM 1739 CG PRO A 113 8.749 -5.585 -21.770 1.00 0.00 C ATOM 1740 CD PRO A 113 9.177 -6.248 -20.459 1.00 0.00 C ATOM 0 HA PRO A 113 7.975 -3.453 -19.896 1.00 0.00 H new ATOM 0 HB2 PRO A 113 6.583 -5.655 -21.556 1.00 0.00 H new ATOM 0 HB3 PRO A 113 7.185 -4.117 -22.144 1.00 0.00 H new ATOM 0 HG2 PRO A 113 8.662 -6.317 -22.573 1.00 0.00 H new ATOM 0 HG3 PRO A 113 9.478 -4.842 -22.094 1.00 0.00 H new ATOM 0 HD2 PRO A 113 8.895 -7.300 -20.426 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.257 -6.203 -20.316 1.00 0.00 H new ATOM 1748 N ASP A 114 5.844 -5.017 -18.372 1.00 0.00 N ATOM 1749 CA ASP A 114 4.847 -4.646 -17.357 1.00 0.00 C ATOM 1750 C ASP A 114 5.593 -4.789 -16.028 1.00 0.00 C ATOM 1751 O ASP A 114 6.070 -5.870 -15.676 1.00 0.00 O ATOM 1752 CB ASP A 114 3.613 -5.552 -17.352 1.00 0.00 C ATOM 1753 CG ASP A 114 2.974 -5.741 -18.724 1.00 0.00 C ATOM 1754 OD1 ASP A 114 2.254 -4.831 -19.183 1.00 0.00 O ATOM 1755 OD2 ASP A 114 3.192 -6.802 -19.348 1.00 0.00 O ATOM 0 H ASP A 114 6.233 -5.953 -18.259 1.00 0.00 H new ATOM 0 HA ASP A 114 4.463 -3.644 -17.551 1.00 0.00 H new ATOM 0 HB2 ASP A 114 3.894 -6.528 -16.956 1.00 0.00 H new ATOM 0 HB3 ASP A 114 2.871 -5.134 -16.672 1.00 0.00 H new ATOM 1760 N TYR A 115 5.777 -3.680 -15.330 1.00 0.00 N ATOM 1761 CA TYR A 115 6.721 -3.653 -14.210 1.00 0.00 C ATOM 1762 C TYR A 115 6.074 -4.270 -12.973 1.00 0.00 C ATOM 1763 O TYR A 115 4.884 -4.095 -12.736 1.00 0.00 O ATOM 1764 CB TYR A 115 7.110 -2.199 -13.929 1.00 0.00 C ATOM 1765 CG TYR A 115 8.372 -2.109 -13.091 1.00 0.00 C ATOM 1766 CD1 TYR A 115 8.334 -2.187 -11.731 1.00 0.00 C ATOM 1767 CD2 TYR A 115 9.565 -1.974 -13.727 1.00 0.00 C ATOM 1768 CE1 TYR A 115 9.487 -2.105 -11.016 1.00 0.00 C ATOM 1769 CE2 TYR A 115 10.710 -1.868 -13.011 1.00 0.00 C ATOM 1770 CZ TYR A 115 10.674 -1.930 -11.656 1.00 0.00 C ATOM 1771 OH TYR A 115 11.839 -1.829 -10.946 1.00 0.00 O ATOM 0 H TYR A 115 5.297 -2.798 -15.510 1.00 0.00 H new ATOM 0 HA TYR A 115 7.611 -4.229 -14.461 1.00 0.00 H new ATOM 0 HB2 TYR A 115 7.261 -1.674 -14.872 1.00 0.00 H new ATOM 0 HB3 TYR A 115 6.293 -1.697 -13.412 1.00 0.00 H new ATOM 0 HD1 TYR A 115 7.390 -2.314 -11.222 1.00 0.00 H new ATOM 0 HD2 TYR A 115 9.601 -1.951 -14.806 1.00 0.00 H new ATOM 0 HE1 TYR A 115 9.460 -2.179 -9.939 1.00 0.00 H new ATOM 0 HE2 TYR A 115 11.653 -1.734 -13.520 1.00 0.00 H new ATOM 0 HH TYR A 115 12.590 -1.708 -11.564 1.00 0.00 H new ATOM 1781 N CYS A 116 6.861 -5.004 -12.200 1.00 0.00 N ATOM 1782 CA CYS A 116 6.289 -5.728 -11.039 1.00 0.00 C ATOM 1783 C CYS A 116 7.037 -5.393 -9.736 1.00 0.00 C ATOM 1784 O CYS A 116 8.224 -5.120 -9.899 1.00 0.00 O ATOM 1785 CB CYS A 116 7.172 -6.976 -10.707 1.00 0.00 C ATOM 1786 SG CYS A 116 6.042 -8.346 -10.284 1.00 0.00 S ATOM 0 H CYS A 116 7.865 -5.122 -12.335 1.00 0.00 H new ATOM 0 HA CYS A 116 5.221 -5.660 -11.244 1.00 0.00 H new ATOM 0 HB2 CYS A 116 7.796 -7.243 -11.560 1.00 0.00 H new ATOM 0 HB3 CYS A 116 7.843 -6.761 -9.875 1.00 0.00 H new ATOM 0 HG CYS A 116 5.739 -9.007 -11.362 1.00 0.00 H new ATOM 1792 N TRP A 117 6.587 -5.851 -8.560 1.00 0.00 N ATOM 1793 CA TRP A 117 7.401 -6.381 -7.437 1.00 0.00 C ATOM 1794 C TRP A 117 6.653 -7.627 -6.929 1.00 0.00 C ATOM 1795 O TRP A 117 5.461 -7.552 -6.640 1.00 0.00 O ATOM 1796 CB TRP A 117 7.476 -5.470 -6.215 1.00 0.00 C ATOM 1797 CG TRP A 117 7.769 -4.049 -6.528 1.00 0.00 C ATOM 1798 CD1 TRP A 117 8.514 -3.600 -7.584 1.00 0.00 C ATOM 1799 CD2 TRP A 117 7.512 -2.977 -5.766 1.00 0.00 C ATOM 1800 NE1 TRP A 117 8.695 -2.238 -7.557 1.00 0.00 N ATOM 1801 CE2 TRP A 117 8.083 -1.882 -6.363 1.00 0.00 C ATOM 1802 CE3 TRP A 117 6.975 -2.930 -4.527 1.00 0.00 C ATOM 1803 CZ2 TRP A 117 8.250 -0.750 -5.639 1.00 0.00 C ATOM 1804 CZ3 TRP A 117 7.014 -1.753 -3.870 1.00 0.00 C ATOM 1805 CH2 TRP A 117 7.707 -0.701 -4.385 1.00 0.00 C ATOM 0 H TRP A 117 5.590 -5.866 -8.346 1.00 0.00 H new ATOM 0 HA TRP A 117 8.410 -6.529 -7.821 1.00 0.00 H new ATOM 0 HB2 TRP A 117 6.529 -5.524 -5.678 1.00 0.00 H new ATOM 0 HB3 TRP A 117 8.246 -5.848 -5.542 1.00 0.00 H new ATOM 0 HD1 TRP A 117 8.915 -4.244 -8.353 1.00 0.00 H new ATOM 0 HE1 TRP A 117 9.161 -1.641 -8.240 1.00 0.00 H new ATOM 0 HE3 TRP A 117 6.530 -3.805 -4.078 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 8.797 0.090 -6.041 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.493 -1.645 -2.930 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.831 0.192 -3.790 1.00 0.00 H new ATOM 1816 N ILE A 118 7.327 -8.752 -6.768 1.00 0.00 N ATOM 1817 CA ILE A 118 6.680 -9.992 -6.294 1.00 0.00 C ATOM 1818 C ILE A 118 7.138 -10.351 -4.875 1.00 0.00 C ATOM 1819 O ILE A 118 8.306 -10.657 -4.637 1.00 0.00 O ATOM 1820 CB ILE A 118 6.651 -11.167 -7.291 1.00 0.00 C ATOM 1821 CG1 ILE A 118 6.456 -12.541 -6.630 1.00 0.00 C ATOM 1822 CG2 ILE A 118 7.874 -11.276 -8.174 1.00 0.00 C ATOM 1823 CD1 ILE A 118 5.532 -13.376 -7.502 1.00 0.00 C ATOM 0 H ILE A 118 8.325 -8.846 -6.955 1.00 0.00 H new ATOM 0 HA ILE A 118 5.617 -9.760 -6.231 1.00 0.00 H new ATOM 0 HB ILE A 118 5.784 -10.915 -7.901 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.417 -13.042 -6.510 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.031 -12.424 -5.633 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.765 -12.130 -8.842 1.00 0.00 H new ATOM 0 HG22 ILE A 118 7.980 -10.365 -8.763 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.760 -11.411 -7.553 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.385 -14.354 -7.044 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.570 -12.873 -7.599 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.977 -13.501 -8.489 1.00 0.00 H new ATOM 1835 N LYS A 119 6.214 -10.258 -3.920 1.00 0.00 N ATOM 1836 CA LYS A 119 6.576 -10.420 -2.504 1.00 0.00 C ATOM 1837 C LYS A 119 6.738 -11.918 -2.210 1.00 0.00 C ATOM 1838 O LYS A 119 6.069 -12.794 -2.763 1.00 0.00 O ATOM 1839 CB LYS A 119 5.412 -9.816 -1.693 1.00 0.00 C ATOM 1840 CG LYS A 119 5.515 -9.965 -0.168 1.00 0.00 C ATOM 1841 CD LYS A 119 4.831 -11.236 0.350 1.00 0.00 C ATOM 1842 CE LYS A 119 4.932 -11.336 1.873 1.00 0.00 C ATOM 1843 NZ LYS A 119 4.265 -12.558 2.345 1.00 0.00 N ATOM 0 H LYS A 119 5.225 -10.075 -4.091 1.00 0.00 H new ATOM 0 HA LYS A 119 7.512 -9.925 -2.247 1.00 0.00 H new ATOM 0 HB2 LYS A 119 5.339 -8.755 -1.932 1.00 0.00 H new ATOM 0 HB3 LYS A 119 4.483 -10.282 -2.023 1.00 0.00 H new ATOM 0 HG2 LYS A 119 6.566 -9.979 0.121 1.00 0.00 H new ATOM 0 HG3 LYS A 119 5.065 -9.095 0.309 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.783 -11.236 0.052 1.00 0.00 H new ATOM 0 HD3 LYS A 119 5.292 -12.112 -0.106 1.00 0.00 H new ATOM 0 HE2 LYS A 119 5.979 -11.344 2.176 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.473 -10.461 2.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 4.339 -12.616 3.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 3.262 -12.534 2.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 4.721 -13.389 1.918 1.00 0.00 H new ATOM 1857 N MET A 120 7.834 -12.168 -1.497 1.00 0.00 N ATOM 1858 CA MET A 120 8.468 -13.496 -1.492 1.00 0.00 C ATOM 1859 C MET A 120 7.737 -14.544 -0.644 1.00 0.00 C ATOM 1860 O MET A 120 6.895 -14.244 0.201 1.00 0.00 O ATOM 1861 CB MET A 120 9.915 -13.267 -1.012 1.00 0.00 C ATOM 1862 CG MET A 120 10.850 -14.454 -1.255 1.00 0.00 C ATOM 1863 SD MET A 120 12.531 -13.982 -0.816 1.00 0.00 S ATOM 1864 CE MET A 120 13.387 -15.512 -1.227 1.00 0.00 C ATOM 0 H MET A 120 8.305 -11.475 -0.915 1.00 0.00 H new ATOM 0 HA MET A 120 8.432 -13.924 -2.494 1.00 0.00 H new ATOM 0 HB2 MET A 120 10.320 -12.390 -1.518 1.00 0.00 H new ATOM 0 HB3 MET A 120 9.901 -13.042 0.054 1.00 0.00 H new ATOM 0 HG2 MET A 120 10.533 -15.310 -0.660 1.00 0.00 H new ATOM 0 HG3 MET A 120 10.806 -14.759 -2.301 1.00 0.00 H new ATOM 0 HE1 MET A 120 14.451 -15.402 -1.017 1.00 0.00 H new ATOM 0 HE2 MET A 120 12.982 -16.328 -0.629 1.00 0.00 H new ATOM 0 HE3 MET A 120 13.248 -15.734 -2.285 1.00 0.00 H new