USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 747 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 2 SER OG : rot 180:sc= 0.229 USER MOD Set 1.2: A 7 ASN : amide:sc= 0.201 X(o=0.43,f=0.32) USER MOD Single : A 1 GLY N :NH3+ -175:sc= -0.224 (180deg=-0.293) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -137:sc= 0.11 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.55 K(o=1.5,f=-0.18) USER MOD Single : A 20 SER OG : rot -130:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.00219 USER MOD Single : A 28 LYS NZ :NH3+ -132:sc= 0.319 (180deg=-1.96!) USER MOD Single : A 32 MET CE :methyl -130:sc= -0.444 (180deg=-1.37) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 98:sc= 1.23 USER MOD Single : A 40 GLN : amide:sc= 0.0285 X(o=0.028,f=0) USER MOD Single : A 48 CYS SG : rot 57:sc= -0.0674 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.057) USER MOD Single : A 60 ASN : amide:sc= 0.548 K(o=0.55,f=-1.9!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -173:sc= 0 (180deg=-0.0449) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 171:sc= 0.137 (180deg=-0.0073) USER MOD Single : A 72 LYS NZ :NH3+ 174:sc= 0.561 (180deg=0.541) USER MOD Single : A 76 SER OG : rot 180:sc= 0.0246 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 96:sc= 0.902 USER MOD Single : A 91 LYS NZ :NH3+ 161:sc= 1.18 (180deg=0.812) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.339 -2.050 -0.956 1.00 25.00 N ATOM 2 CA GLY A 1 2.499 -1.469 0.418 1.00 25.00 C ATOM 3 C GLY A 1 3.909 -1.025 0.727 1.00 25.00 C ATOM 4 O GLY A 1 4.218 -0.313 1.657 1.00 25.00 O ATOM 0 H1 GLY A 1 1.335 -2.255 -1.132 1.00 25.00 H new ATOM 0 H2 GLY A 1 2.682 -1.369 -1.663 1.00 25.00 H new ATOM 0 H3 GLY A 1 2.889 -2.930 -1.027 1.00 25.00 H new ATOM 0 HA2 GLY A 1 1.828 -0.617 0.523 1.00 25.00 H new ATOM 0 HA3 GLY A 1 2.191 -2.211 1.155 1.00 25.00 H new ATOM 9 N SER A 2 4.805 -1.482 -0.146 1.00 25.00 N ATOM 10 CA SER A 2 6.222 -1.145 -0.057 1.00 25.00 C ATOM 11 C SER A 2 6.422 0.289 -0.535 1.00 25.00 C ATOM 12 O SER A 2 5.976 0.658 -1.620 1.00 25.00 O ATOM 13 CB SER A 2 7.060 -2.094 -0.916 1.00 25.00 C ATOM 14 OG SER A 2 8.437 -1.777 -0.817 1.00 25.00 O ATOM 0 H SER A 2 4.570 -2.092 -0.929 1.00 25.00 H new ATOM 0 HA SER A 2 6.545 -1.244 0.979 1.00 25.00 H new ATOM 0 HB2 SER A 2 6.895 -3.123 -0.596 1.00 25.00 H new ATOM 0 HB3 SER A 2 6.741 -2.028 -1.956 1.00 25.00 H new ATOM 0 HG SER A 2 8.956 -2.396 -1.372 1.00 25.00 H new ATOM 20 N MET A 3 7.089 1.091 0.281 1.00 25.00 N ATOM 21 CA MET A 3 7.382 2.481 -0.050 1.00 25.00 C ATOM 22 C MET A 3 8.752 2.786 0.533 1.00 25.00 C ATOM 23 O MET A 3 8.957 2.585 1.732 1.00 25.00 O ATOM 24 CB MET A 3 6.318 3.406 0.549 1.00 25.00 C ATOM 25 CG MET A 3 6.564 4.886 0.284 1.00 25.00 C ATOM 26 SD MET A 3 6.657 5.248 -1.483 1.00 25.00 S ATOM 27 CE MET A 3 6.915 7.024 -1.466 1.00 25.00 C ATOM 0 H MET A 3 7.443 0.799 1.192 1.00 25.00 H new ATOM 0 HA MET A 3 7.376 2.641 -1.128 1.00 25.00 H new ATOM 0 HB2 MET A 3 5.344 3.132 0.145 1.00 25.00 H new ATOM 0 HB3 MET A 3 6.274 3.243 1.626 1.00 25.00 H new ATOM 0 HG2 MET A 3 5.763 5.473 0.733 1.00 25.00 H new ATOM 0 HG3 MET A 3 7.492 5.192 0.766 1.00 25.00 H new ATOM 0 HE1 MET A 3 6.992 7.390 -2.490 1.00 25.00 H new ATOM 0 HE2 MET A 3 6.075 7.509 -0.969 1.00 25.00 H new ATOM 0 HE3 MET A 3 7.835 7.253 -0.929 1.00 25.00 H new ATOM 37 N LYS A 4 9.676 3.205 -0.338 1.00 25.00 N ATOM 38 CA LYS A 4 11.118 3.385 -0.022 1.00 25.00 C ATOM 39 C LYS A 4 11.732 2.000 0.255 1.00 25.00 C ATOM 40 O LYS A 4 11.017 1.068 0.571 1.00 25.00 O ATOM 41 CB LYS A 4 11.321 4.359 1.165 1.00 25.00 C ATOM 42 CG LYS A 4 12.770 4.795 1.425 1.00 25.00 C ATOM 43 CD LYS A 4 12.838 5.725 2.628 1.00 25.00 C ATOM 44 CE LYS A 4 14.285 5.978 3.078 1.00 25.00 C ATOM 45 NZ LYS A 4 15.112 6.716 2.059 1.00 25.00 N ATOM 0 H LYS A 4 9.449 3.436 -1.305 1.00 25.00 H new ATOM 0 HA LYS A 4 11.628 3.839 -0.872 1.00 25.00 H new ATOM 0 HB2 LYS A 4 10.719 5.250 0.988 1.00 25.00 H new ATOM 0 HB3 LYS A 4 10.935 3.888 2.069 1.00 25.00 H new ATOM 0 HG2 LYS A 4 13.394 3.919 1.599 1.00 25.00 H new ATOM 0 HG3 LYS A 4 13.168 5.300 0.545 1.00 25.00 H new ATOM 0 HD2 LYS A 4 12.364 6.675 2.379 1.00 25.00 H new ATOM 0 HD3 LYS A 4 12.272 5.293 3.453 1.00 25.00 H new ATOM 0 HE2 LYS A 4 14.274 6.549 4.007 1.00 25.00 H new ATOM 0 HE3 LYS A 4 14.761 5.022 3.297 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 16.075 6.853 2.427 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 15.153 6.163 1.179 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 14.680 7.642 1.867 1.00 25.00 H new ATOM 59 N TYR A 5 13.051 1.889 0.128 1.00 25.00 N ATOM 60 CA TYR A 5 13.785 0.658 0.420 1.00 25.00 C ATOM 61 C TYR A 5 13.353 -0.571 -0.405 1.00 25.00 C ATOM 62 O TYR A 5 12.506 -0.487 -1.287 1.00 25.00 O ATOM 63 CB TYR A 5 13.701 0.369 1.928 1.00 25.00 C ATOM 64 CG TYR A 5 14.554 1.289 2.778 1.00 25.00 C ATOM 65 CD1 TYR A 5 14.001 1.984 3.872 1.00 25.00 C ATOM 66 CD2 TYR A 5 15.937 1.442 2.519 1.00 25.00 C ATOM 67 CE1 TYR A 5 14.815 2.814 4.695 1.00 25.00 C ATOM 68 CE2 TYR A 5 16.742 2.275 3.333 1.00 25.00 C ATOM 69 CZ TYR A 5 16.179 2.947 4.411 1.00 25.00 C ATOM 70 OH TYR A 5 16.972 3.741 5.195 1.00 25.00 O ATOM 0 H TYR A 5 13.647 2.656 -0.183 1.00 25.00 H new ATOM 0 HA TYR A 5 14.817 0.835 0.117 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.662 0.455 2.247 1.00 25.00 H new ATOM 0 HB3 TYR A 5 14.006 -0.662 2.108 1.00 25.00 H new ATOM 0 HD1 TYR A 5 12.948 1.886 4.089 1.00 25.00 H new ATOM 0 HD2 TYR A 5 16.385 0.916 1.689 1.00 25.00 H new ATOM 0 HE1 TYR A 5 14.382 3.338 5.534 1.00 25.00 H new ATOM 0 HE2 TYR A 5 17.794 2.388 3.116 1.00 25.00 H new ATOM 0 HH TYR A 5 17.892 3.719 4.858 1.00 25.00 H new ATOM 80 N LEU A 6 14.016 -1.692 -0.156 1.00 25.00 N ATOM 81 CA LEU A 6 13.764 -2.938 -0.877 1.00 25.00 C ATOM 82 C LEU A 6 12.541 -3.670 -0.307 1.00 25.00 C ATOM 83 O LEU A 6 11.754 -4.236 -1.053 1.00 25.00 O ATOM 84 CB LEU A 6 14.992 -3.860 -0.762 1.00 25.00 C ATOM 85 CG LEU A 6 16.358 -3.366 -1.267 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.435 -4.419 -0.931 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.351 -3.100 -2.767 1.00 25.00 C ATOM 0 H LEU A 6 14.746 -1.766 0.553 1.00 25.00 H new ATOM 0 HA LEU A 6 13.572 -2.690 -1.921 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.107 -4.121 0.290 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.760 -4.782 -1.296 1.00 25.00 H new ATOM 0 HG LEU A 6 16.580 -2.423 -0.768 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.405 -4.073 -1.287 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.476 -4.566 0.148 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.185 -5.362 -1.417 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.336 -2.753 -3.080 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.105 -4.019 -3.298 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.607 -2.337 -2.998 1.00 25.00 H new ATOM 99 N ASN A 7 12.423 -3.663 1.019 1.00 25.00 N ATOM 100 CA ASN A 7 11.346 -4.352 1.759 1.00 25.00 C ATOM 101 C ASN A 7 11.145 -5.815 1.337 1.00 25.00 C ATOM 102 O ASN A 7 10.046 -6.232 0.978 1.00 25.00 O ATOM 103 CB ASN A 7 10.030 -3.576 1.656 1.00 25.00 C ATOM 104 CG ASN A 7 10.046 -2.324 2.477 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.281 -2.363 3.673 1.00 25.00 O ATOM 106 ND2 ASN A 7 9.817 -1.215 1.852 1.00 25.00 N ATOM 0 H ASN A 7 13.079 -3.173 1.627 1.00 25.00 H new ATOM 0 HA ASN A 7 11.669 -4.377 2.800 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.841 -3.322 0.613 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.208 -4.213 1.983 1.00 25.00 H new ATOM 0 HD21 ASN A 7 9.829 -0.331 2.361 1.00 25.00 H new ATOM 0 HD22 ASN A 7 9.624 -1.224 0.850 1.00 25.00 H new ATOM 113 N VAL A 8 12.212 -6.597 1.411 1.00 25.00 N ATOM 114 CA VAL A 8 12.158 -8.023 1.079 1.00 25.00 C ATOM 115 C VAL A 8 12.270 -8.781 2.394 1.00 25.00 C ATOM 116 O VAL A 8 12.732 -8.228 3.379 1.00 25.00 O ATOM 117 CB VAL A 8 13.296 -8.432 0.066 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.826 -7.210 -0.671 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.464 -9.134 0.750 1.00 25.00 C ATOM 0 H VAL A 8 13.134 -6.270 1.700 1.00 25.00 H new ATOM 0 HA VAL A 8 11.223 -8.266 0.575 1.00 25.00 H new ATOM 0 HB VAL A 8 12.841 -9.129 -0.637 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.610 -7.515 -1.364 1.00 25.00 H new ATOM 0 HG12 VAL A 8 13.014 -6.739 -1.225 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.234 -6.500 0.048 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.218 -9.393 0.007 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.902 -8.470 1.495 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.108 -10.042 1.238 1.00 25.00 H new ATOM 129 N LEU A 9 11.868 -10.039 2.429 1.00 25.00 N ATOM 130 CA LEU A 9 11.989 -10.829 3.653 1.00 25.00 C ATOM 131 C LEU A 9 13.247 -11.683 3.585 1.00 25.00 C ATOM 132 O LEU A 9 13.596 -12.197 2.525 1.00 25.00 O ATOM 133 CB LEU A 9 10.759 -11.720 3.838 1.00 25.00 C ATOM 134 CG LEU A 9 9.416 -10.983 3.986 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.290 -12.008 4.101 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.402 -10.058 5.208 1.00 25.00 C ATOM 0 H LEU A 9 11.459 -10.536 1.637 1.00 25.00 H new ATOM 0 HA LEU A 9 12.056 -10.153 4.506 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.690 -12.394 2.984 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.912 -12.339 4.722 1.00 25.00 H new ATOM 0 HG LEU A 9 9.273 -10.361 3.102 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.336 -11.491 4.206 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.270 -12.628 3.205 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.459 -12.638 4.974 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.436 -9.558 5.275 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.570 -10.645 6.111 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.191 -9.312 5.109 1.00 25.00 H new ATOM 148 N ALA A 10 13.922 -11.852 4.712 1.00 25.00 N ATOM 149 CA ALA A 10 15.116 -12.692 4.773 1.00 25.00 C ATOM 150 C ALA A 10 15.087 -13.565 6.029 1.00 25.00 C ATOM 151 O ALA A 10 14.629 -13.119 7.075 1.00 25.00 O ATOM 152 CB ALA A 10 16.358 -11.823 4.759 1.00 25.00 C ATOM 0 H ALA A 10 13.666 -11.419 5.599 1.00 25.00 H new ATOM 0 HA ALA A 10 15.135 -13.346 3.901 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.245 -12.455 4.805 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.379 -11.234 3.842 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.344 -11.155 5.620 1.00 25.00 H new ATOM 158 N LYS A 11 15.584 -14.795 5.919 1.00 25.00 N ATOM 159 CA LYS A 11 15.642 -15.727 7.046 1.00 25.00 C ATOM 160 C LYS A 11 17.053 -15.827 7.596 1.00 25.00 C ATOM 161 O LYS A 11 18.013 -15.973 6.839 1.00 25.00 O ATOM 162 CB LYS A 11 15.196 -17.129 6.615 1.00 25.00 C ATOM 163 CG LYS A 11 15.427 -18.205 7.696 1.00 25.00 C ATOM 164 CD LYS A 11 14.550 -19.432 7.524 1.00 25.00 C ATOM 165 CE LYS A 11 13.130 -19.140 8.001 1.00 25.00 C ATOM 166 NZ LYS A 11 12.586 -20.176 8.949 1.00 25.00 N ATOM 0 H LYS A 11 15.957 -15.174 5.049 1.00 25.00 H new ATOM 0 HA LYS A 11 14.972 -15.343 7.816 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.137 -17.103 6.360 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.735 -17.412 5.711 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.473 -18.510 7.676 1.00 25.00 H new ATOM 0 HG3 LYS A 11 15.240 -17.769 8.677 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.534 -19.732 6.476 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.966 -20.267 8.088 1.00 25.00 H new ATOM 0 HE2 LYS A 11 13.114 -18.167 8.492 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.472 -19.071 7.135 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.601 -20.394 8.697 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 13.160 -21.041 8.884 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.621 -19.809 9.922 1.00 25.00 H new ATOM 180 N ALA A 12 17.159 -15.830 8.912 1.00 25.00 N ATOM 181 CA ALA A 12 18.423 -16.055 9.596 1.00 25.00 C ATOM 182 C ALA A 12 18.854 -17.526 9.470 1.00 25.00 C ATOM 183 O ALA A 12 18.094 -18.425 9.834 1.00 25.00 O ATOM 184 CB ALA A 12 18.242 -15.672 11.052 1.00 25.00 C ATOM 0 H ALA A 12 16.370 -15.676 9.540 1.00 25.00 H new ATOM 0 HA ALA A 12 19.207 -15.447 9.144 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.177 -15.831 11.589 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.959 -14.621 11.119 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.459 -16.287 11.496 1.00 25.00 H new ATOM 190 N LEU A 13 20.061 -17.776 8.972 1.00 25.00 N ATOM 191 CA LEU A 13 20.590 -19.141 8.879 1.00 25.00 C ATOM 192 C LEU A 13 21.227 -19.543 10.189 1.00 25.00 C ATOM 193 O LEU A 13 21.393 -20.716 10.462 1.00 25.00 O ATOM 194 CB LEU A 13 21.694 -19.253 7.826 1.00 25.00 C ATOM 195 CG LEU A 13 21.397 -19.111 6.336 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.984 -19.568 5.958 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.638 -17.700 5.893 1.00 25.00 C ATOM 0 H LEU A 13 20.694 -17.055 8.626 1.00 25.00 H new ATOM 0 HA LEU A 13 19.746 -19.779 8.618 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.443 -18.500 8.072 1.00 25.00 H new ATOM 0 HB3 LEU A 13 22.164 -20.227 7.963 1.00 25.00 H new ATOM 0 HG LEU A 13 22.082 -19.777 5.811 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.835 -19.442 4.886 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.859 -20.619 6.220 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.251 -18.969 6.499 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.423 -17.611 4.828 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.988 -17.027 6.452 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.679 -17.434 6.076 1.00 25.00 H new ATOM 209 N TYR A 14 21.610 -18.547 10.965 1.00 25.00 N ATOM 210 CA TYR A 14 22.281 -18.745 12.239 1.00 25.00 C ATOM 211 C TYR A 14 21.717 -17.667 13.130 1.00 25.00 C ATOM 212 O TYR A 14 21.070 -16.754 12.629 1.00 25.00 O ATOM 213 CB TYR A 14 23.787 -18.544 12.096 1.00 25.00 C ATOM 214 CG TYR A 14 24.424 -19.409 11.031 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.585 -18.925 9.717 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.867 -20.712 11.324 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.167 -19.732 8.709 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.466 -21.518 10.320 1.00 25.00 C ATOM 219 CZ TYR A 14 25.605 -21.022 9.023 1.00 25.00 C ATOM 220 OH TYR A 14 26.179 -21.800 8.051 1.00 25.00 O ATOM 0 H TYR A 14 21.463 -17.566 10.727 1.00 25.00 H new ATOM 0 HA TYR A 14 22.126 -19.752 12.628 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.983 -17.497 11.865 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.264 -18.754 13.053 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.260 -17.924 9.475 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.750 -21.104 12.324 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.272 -19.353 7.703 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.813 -22.512 10.560 1.00 25.00 H new ATOM 0 HH TYR A 14 26.430 -22.667 8.432 1.00 25.00 H new ATOM 230 N ASP A 15 21.972 -17.733 14.420 1.00 25.00 N ATOM 231 CA ASP A 15 21.564 -16.664 15.317 1.00 25.00 C ATOM 232 C ASP A 15 22.578 -15.528 15.200 1.00 25.00 C ATOM 233 O ASP A 15 23.625 -15.673 14.558 1.00 25.00 O ATOM 234 CB ASP A 15 21.502 -17.170 16.759 1.00 25.00 C ATOM 235 CG ASP A 15 22.866 -17.532 17.309 1.00 25.00 C ATOM 236 OD1 ASP A 15 23.508 -18.446 16.753 1.00 25.00 O ATOM 237 OD2 ASP A 15 23.270 -16.936 18.324 1.00 25.00 O ATOM 0 H ASP A 15 22.456 -18.509 14.872 1.00 25.00 H new ATOM 0 HA ASP A 15 20.570 -16.310 15.043 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.052 -16.404 17.390 1.00 25.00 H new ATOM 0 HB3 ASP A 15 20.852 -18.044 16.806 1.00 25.00 H new ATOM 242 N ASN A 16 22.274 -14.399 15.812 1.00 25.00 N ATOM 243 CA ASN A 16 23.191 -13.273 15.828 1.00 25.00 C ATOM 244 C ASN A 16 23.070 -12.533 17.140 1.00 25.00 C ATOM 245 O ASN A 16 21.966 -12.260 17.609 1.00 25.00 O ATOM 246 CB ASN A 16 22.909 -12.303 14.682 1.00 25.00 C ATOM 247 CG ASN A 16 24.048 -11.343 14.471 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.185 -11.763 14.283 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.776 -10.075 14.538 1.00 25.00 N ATOM 0 H ASN A 16 21.397 -14.236 16.306 1.00 25.00 H new ATOM 0 HA ASN A 16 24.200 -13.666 15.707 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.732 -12.865 13.765 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.997 -11.745 14.894 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.522 -9.387 14.433 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.817 -9.767 14.696 1.00 25.00 H new ATOM 256 N VAL A 17 24.208 -12.178 17.705 1.00 25.00 N ATOM 257 CA VAL A 17 24.262 -11.401 18.927 1.00 25.00 C ATOM 258 C VAL A 17 24.735 -10.034 18.489 1.00 25.00 C ATOM 259 O VAL A 17 25.758 -9.905 17.819 1.00 25.00 O ATOM 260 CB VAL A 17 25.236 -12.027 19.961 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.313 -11.163 21.232 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.771 -13.452 20.326 1.00 25.00 C ATOM 0 H VAL A 17 25.124 -12.422 17.328 1.00 25.00 H new ATOM 0 HA VAL A 17 23.294 -11.364 19.427 1.00 25.00 H new ATOM 0 HB VAL A 17 26.229 -12.073 19.513 1.00 25.00 H new ATOM 0 HG11 VAL A 17 26.001 -11.621 21.942 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.669 -10.166 20.973 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.323 -11.089 21.682 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.459 -13.885 21.052 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.770 -13.409 20.756 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.754 -14.070 19.429 1.00 25.00 H new ATOM 272 N ALA A 18 23.941 -9.030 18.813 1.00 25.00 N ATOM 273 CA ALA A 18 24.244 -7.663 18.447 1.00 25.00 C ATOM 274 C ALA A 18 25.337 -7.143 19.375 1.00 25.00 C ATOM 275 O ALA A 18 25.149 -7.080 20.588 1.00 25.00 O ATOM 276 CB ALA A 18 22.992 -6.811 18.558 1.00 25.00 C ATOM 0 H ALA A 18 23.072 -9.141 19.335 1.00 25.00 H new ATOM 0 HA ALA A 18 24.594 -7.616 17.416 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.226 -5.783 18.281 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.226 -7.202 17.889 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.625 -6.836 19.584 1.00 25.00 H new ATOM 282 N GLU A 19 26.476 -6.802 18.799 1.00 25.00 N ATOM 283 CA GLU A 19 27.617 -6.302 19.569 1.00 25.00 C ATOM 284 C GLU A 19 27.681 -4.789 19.436 1.00 25.00 C ATOM 285 O GLU A 19 28.258 -4.095 20.266 1.00 25.00 O ATOM 286 CB GLU A 19 28.909 -6.931 19.047 1.00 25.00 C ATOM 287 CG GLU A 19 28.951 -8.436 19.254 1.00 25.00 C ATOM 288 CD GLU A 19 30.215 -9.071 18.696 1.00 25.00 C ATOM 289 OE1 GLU A 19 31.321 -8.750 19.165 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.088 -9.891 17.755 1.00 25.00 O ATOM 0 H GLU A 19 26.643 -6.860 17.794 1.00 25.00 H new ATOM 0 HA GLU A 19 27.498 -6.569 20.619 1.00 25.00 H new ATOM 0 HB2 GLU A 19 29.012 -6.711 17.984 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.761 -6.475 19.551 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.880 -8.654 20.320 1.00 25.00 H new ATOM 0 HG3 GLU A 19 28.081 -8.888 18.777 1.00 25.00 H new ATOM 297 N SER A 20 27.061 -4.289 18.380 1.00 25.00 N ATOM 298 CA SER A 20 26.999 -2.855 18.121 1.00 25.00 C ATOM 299 C SER A 20 25.580 -2.366 18.359 1.00 25.00 C ATOM 300 O SER A 20 24.623 -3.123 18.200 1.00 25.00 O ATOM 301 CB SER A 20 27.423 -2.581 16.679 1.00 25.00 C ATOM 302 OG SER A 20 28.760 -2.998 16.490 1.00 25.00 O ATOM 0 H SER A 20 26.588 -4.860 17.680 1.00 25.00 H new ATOM 0 HA SER A 20 27.675 -2.324 18.792 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.766 -3.110 15.989 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.328 -1.518 16.457 1.00 25.00 H new ATOM 0 HG SER A 20 29.271 -2.277 16.067 1.00 25.00 H new ATOM 308 N PRO A 21 25.416 -1.082 18.721 1.00 25.00 N ATOM 309 CA PRO A 21 24.065 -0.560 18.968 1.00 25.00 C ATOM 310 C PRO A 21 23.237 -0.416 17.693 1.00 25.00 C ATOM 311 O PRO A 21 22.017 -0.260 17.750 1.00 25.00 O ATOM 312 CB PRO A 21 24.343 0.802 19.608 1.00 25.00 C ATOM 313 CG PRO A 21 25.648 1.212 19.027 1.00 25.00 C ATOM 314 CD PRO A 21 26.444 -0.044 18.940 1.00 25.00 C ATOM 0 HA PRO A 21 23.470 -1.229 19.590 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.558 1.521 19.373 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.395 0.730 20.694 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.517 1.665 18.044 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.145 1.951 19.655 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.162 -0.009 18.121 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.011 -0.225 19.853 1.00 25.00 H new ATOM 322 N ASP A 22 23.898 -0.505 16.548 1.00 25.00 N ATOM 323 CA ASP A 22 23.242 -0.413 15.260 1.00 25.00 C ATOM 324 C ASP A 22 22.846 -1.792 14.783 1.00 25.00 C ATOM 325 O ASP A 22 22.247 -1.917 13.749 1.00 25.00 O ATOM 326 CB ASP A 22 24.210 0.187 14.229 1.00 25.00 C ATOM 327 CG ASP A 22 23.941 1.650 13.965 1.00 25.00 C ATOM 328 OD1 ASP A 22 23.717 2.401 14.936 1.00 25.00 O ATOM 329 OD2 ASP A 22 23.941 2.047 12.778 1.00 25.00 O ATOM 0 H ASP A 22 24.907 -0.643 16.490 1.00 25.00 H new ATOM 0 HA ASP A 22 22.358 0.217 15.365 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.234 0.068 14.584 1.00 25.00 H new ATOM 0 HB3 ASP A 22 24.130 -0.368 13.294 1.00 25.00 H new ATOM 334 N GLU A 23 23.245 -2.837 15.491 1.00 25.00 N ATOM 335 CA GLU A 23 23.079 -4.203 15.003 1.00 25.00 C ATOM 336 C GLU A 23 21.827 -4.875 15.576 1.00 25.00 C ATOM 337 O GLU A 23 21.417 -4.603 16.706 1.00 25.00 O ATOM 338 CB GLU A 23 24.336 -5.007 15.363 1.00 25.00 C ATOM 339 CG GLU A 23 24.443 -6.348 14.661 1.00 25.00 C ATOM 340 CD GLU A 23 25.709 -7.104 15.011 1.00 25.00 C ATOM 341 OE1 GLU A 23 25.940 -8.159 14.381 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.454 -6.700 15.938 1.00 25.00 O ATOM 0 H GLU A 23 23.687 -2.768 16.408 1.00 25.00 H new ATOM 0 HA GLU A 23 22.947 -4.172 13.922 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.216 -4.412 15.119 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.351 -5.172 16.440 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.579 -6.958 14.923 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.407 -6.191 13.583 1.00 25.00 H new ATOM 349 N LEU A 24 21.229 -5.767 14.799 1.00 25.00 N ATOM 350 CA LEU A 24 20.082 -6.543 15.263 1.00 25.00 C ATOM 351 C LEU A 24 20.514 -7.881 15.826 1.00 25.00 C ATOM 352 O LEU A 24 21.395 -8.550 15.289 1.00 25.00 O ATOM 353 CB LEU A 24 19.098 -6.808 14.128 1.00 25.00 C ATOM 354 CG LEU A 24 18.290 -5.601 13.642 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.411 -6.016 12.479 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.441 -5.031 14.772 1.00 25.00 C ATOM 0 H LEU A 24 21.518 -5.973 13.843 1.00 25.00 H new ATOM 0 HA LEU A 24 19.602 -5.950 16.041 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.652 -7.214 13.281 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.400 -7.580 14.452 1.00 25.00 H new ATOM 0 HG LEU A 24 18.979 -4.823 13.312 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.836 -5.157 12.133 1.00 25.00 H new ATOM 0 HD12 LEU A 24 18.035 -6.387 11.666 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.729 -6.803 12.801 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.875 -4.175 14.406 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.751 -5.795 15.130 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.089 -4.715 15.590 1.00 25.00 H new ATOM 368 N SER A 25 19.828 -8.298 16.875 1.00 25.00 N ATOM 369 CA SER A 25 20.047 -9.591 17.483 1.00 25.00 C ATOM 370 C SER A 25 18.819 -10.427 17.183 1.00 25.00 C ATOM 371 O SER A 25 17.687 -9.959 17.309 1.00 25.00 O ATOM 372 CB SER A 25 20.243 -9.444 18.992 1.00 25.00 C ATOM 373 OG SER A 25 19.282 -8.555 19.541 1.00 25.00 O ATOM 0 H SER A 25 19.101 -7.744 17.328 1.00 25.00 H new ATOM 0 HA SER A 25 20.945 -10.064 17.086 1.00 25.00 H new ATOM 0 HB2 SER A 25 20.158 -10.419 19.471 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.247 -9.074 19.198 1.00 25.00 H new ATOM 0 HG SER A 25 19.424 -8.476 20.507 1.00 25.00 H new ATOM 379 N PHE A 26 19.056 -11.648 16.746 1.00 25.00 N ATOM 380 CA PHE A 26 17.979 -12.571 16.386 1.00 25.00 C ATOM 381 C PHE A 26 18.413 -14.022 16.507 1.00 25.00 C ATOM 382 O PHE A 26 19.585 -14.315 16.719 1.00 25.00 O ATOM 383 CB PHE A 26 17.483 -12.295 14.963 1.00 25.00 C ATOM 384 CG PHE A 26 18.567 -12.243 13.926 1.00 25.00 C ATOM 385 CD1 PHE A 26 18.904 -11.015 13.336 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.219 -13.413 13.483 1.00 25.00 C ATOM 387 CE1 PHE A 26 19.846 -10.949 12.305 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.183 -13.355 12.444 1.00 25.00 C ATOM 389 CZ PHE A 26 20.481 -12.127 11.839 1.00 25.00 C ATOM 0 H PHE A 26 19.993 -12.034 16.628 1.00 25.00 H new ATOM 0 HA PHE A 26 17.164 -12.403 17.090 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.768 -13.069 14.684 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.945 -11.347 14.956 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.429 -10.109 13.683 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.982 -14.363 13.940 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.091 -9.995 11.861 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.686 -14.255 12.120 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.189 -12.079 11.025 1.00 25.00 H new ATOM 399 N ARG A 27 17.458 -14.926 16.366 1.00 25.00 N ATOM 400 CA ARG A 27 17.689 -16.359 16.470 1.00 25.00 C ATOM 401 C ARG A 27 17.672 -16.967 15.070 1.00 25.00 C ATOM 402 O ARG A 27 17.050 -16.427 14.158 1.00 25.00 O ATOM 403 CB ARG A 27 16.555 -16.950 17.326 1.00 25.00 C ATOM 404 CG ARG A 27 16.751 -18.380 17.807 1.00 25.00 C ATOM 405 CD ARG A 27 17.820 -18.466 18.890 1.00 25.00 C ATOM 406 NE ARG A 27 17.946 -19.838 19.415 1.00 25.00 N ATOM 407 CZ ARG A 27 18.800 -20.222 20.358 1.00 25.00 C ATOM 408 NH1 ARG A 27 19.642 -19.390 20.921 1.00 25.00 N ATOM 409 NH2 ARG A 27 18.807 -21.468 20.741 1.00 25.00 N ATOM 0 H ARG A 27 16.486 -14.683 16.173 1.00 25.00 H new ATOM 0 HA ARG A 27 18.654 -16.574 16.930 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.416 -16.311 18.198 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.632 -16.906 16.748 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.808 -18.767 18.194 1.00 25.00 H new ATOM 0 HG3 ARG A 27 17.033 -19.012 16.965 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.778 -18.141 18.484 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.571 -17.785 19.704 1.00 25.00 H new ATOM 0 HE ARG A 27 17.329 -20.549 19.023 1.00 25.00 H new ATOM 0 HH11 ARG A 27 19.657 -18.410 20.638 1.00 25.00 H new ATOM 0 HH12 ARG A 27 20.283 -19.723 21.642 1.00 25.00 H new ATOM 0 HH21 ARG A 27 18.162 -22.135 20.318 1.00 25.00 H new ATOM 0 HH22 ARG A 27 19.458 -21.776 21.464 1.00 25.00 H new ATOM 423 N LYS A 28 18.318 -18.112 14.908 1.00 25.00 N ATOM 424 CA LYS A 28 18.251 -18.853 13.652 1.00 25.00 C ATOM 425 C LYS A 28 16.790 -19.129 13.336 1.00 25.00 C ATOM 426 O LYS A 28 16.038 -19.577 14.192 1.00 25.00 O ATOM 427 CB LYS A 28 19.002 -20.185 13.777 1.00 25.00 C ATOM 428 CG LYS A 28 18.852 -21.070 12.547 1.00 25.00 C ATOM 429 CD LYS A 28 19.684 -22.329 12.649 1.00 25.00 C ATOM 430 CE LYS A 28 19.535 -23.159 11.375 1.00 25.00 C ATOM 431 NZ LYS A 28 20.450 -24.331 11.388 1.00 25.00 N ATOM 0 H LYS A 28 18.894 -18.550 15.627 1.00 25.00 H new ATOM 0 HA LYS A 28 18.712 -18.266 12.857 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.060 -19.985 13.947 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.635 -20.722 14.651 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.803 -21.338 12.419 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.148 -20.511 11.660 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.732 -22.071 12.804 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.369 -22.914 13.513 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.504 -23.500 11.278 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.748 -22.537 10.505 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.956 -24.386 10.481 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.137 -24.227 12.162 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 19.898 -25.201 11.530 1.00 25.00 H new ATOM 445 N GLY A 29 16.411 -18.882 12.094 1.00 25.00 N ATOM 446 CA GLY A 29 15.058 -19.141 11.645 1.00 25.00 C ATOM 447 C GLY A 29 14.155 -17.924 11.668 1.00 25.00 C ATOM 448 O GLY A 29 13.065 -17.979 11.090 1.00 25.00 O ATOM 0 H GLY A 29 17.027 -18.500 11.376 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.093 -19.535 10.629 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.620 -19.917 12.273 1.00 25.00 H new ATOM 452 N ASP A 30 14.599 -16.837 12.284 1.00 25.00 N ATOM 453 CA ASP A 30 13.797 -15.614 12.367 1.00 25.00 C ATOM 454 C ASP A 30 13.710 -14.966 11.000 1.00 25.00 C ATOM 455 O ASP A 30 14.556 -15.212 10.131 1.00 25.00 O ATOM 456 CB ASP A 30 14.419 -14.611 13.348 1.00 25.00 C ATOM 457 CG ASP A 30 14.148 -14.967 14.803 1.00 25.00 C ATOM 458 OD1 ASP A 30 14.802 -14.378 15.690 1.00 25.00 O ATOM 459 OD2 ASP A 30 13.277 -15.822 15.062 1.00 25.00 O ATOM 0 H ASP A 30 15.511 -16.773 12.736 1.00 25.00 H new ATOM 0 HA ASP A 30 12.803 -15.887 12.722 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.496 -14.568 13.183 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.025 -13.616 13.142 1.00 25.00 H new ATOM 464 N ILE A 31 12.693 -14.134 10.819 1.00 25.00 N ATOM 465 CA ILE A 31 12.480 -13.413 9.568 1.00 25.00 C ATOM 466 C ILE A 31 12.548 -11.925 9.857 1.00 25.00 C ATOM 467 O ILE A 31 11.873 -11.439 10.759 1.00 25.00 O ATOM 468 CB ILE A 31 11.081 -13.719 8.945 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.916 -15.226 8.668 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.878 -12.912 7.632 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.960 -15.833 7.749 1.00 25.00 C ATOM 0 H ILE A 31 11.992 -13.939 11.534 1.00 25.00 H new ATOM 0 HA ILE A 31 13.248 -13.730 8.862 1.00 25.00 H new ATOM 0 HB ILE A 31 10.322 -13.416 9.666 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.939 -15.758 9.619 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.931 -15.393 8.233 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.898 -13.139 7.213 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.943 -11.845 7.847 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.651 -13.185 6.914 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.756 -16.896 7.618 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.926 -15.335 6.780 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.949 -15.705 8.188 1.00 25.00 H new ATOM 483 N MET A 32 13.329 -11.204 9.070 1.00 25.00 N ATOM 484 CA MET A 32 13.419 -9.755 9.186 1.00 25.00 C ATOM 485 C MET A 32 13.199 -9.135 7.826 1.00 25.00 C ATOM 486 O MET A 32 13.396 -9.781 6.788 1.00 25.00 O ATOM 487 CB MET A 32 14.780 -9.338 9.741 1.00 25.00 C ATOM 488 CG MET A 32 15.964 -9.887 8.976 1.00 25.00 C ATOM 489 SD MET A 32 17.246 -10.378 10.124 1.00 25.00 S ATOM 490 CE MET A 32 16.520 -11.922 10.830 1.00 25.00 C ATOM 0 H MET A 32 13.916 -11.602 8.337 1.00 25.00 H new ATOM 0 HA MET A 32 12.652 -9.406 9.878 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.839 -8.250 9.745 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.851 -9.665 10.779 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.656 -10.741 8.373 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.347 -9.133 8.289 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.564 -11.880 11.918 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.481 -12.014 10.512 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.085 -12.784 10.477 1.00 25.00 H new ATOM 500 N THR A 33 12.776 -7.885 7.842 1.00 25.00 N ATOM 501 CA THR A 33 12.512 -7.141 6.614 1.00 25.00 C ATOM 502 C THR A 33 13.781 -6.430 6.184 1.00 25.00 C ATOM 503 O THR A 33 14.235 -5.542 6.878 1.00 25.00 O ATOM 504 CB THR A 33 11.424 -6.077 6.846 1.00 25.00 C ATOM 505 OG1 THR A 33 10.225 -6.720 7.284 1.00 25.00 O ATOM 506 CG2 THR A 33 11.128 -5.308 5.580 1.00 25.00 C ATOM 0 H THR A 33 12.605 -7.356 8.697 1.00 25.00 H new ATOM 0 HA THR A 33 12.177 -7.842 5.850 1.00 25.00 H new ATOM 0 HB THR A 33 11.787 -5.379 7.600 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.529 -6.047 7.435 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.356 -4.565 5.778 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.034 -4.808 5.238 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.780 -5.996 4.809 1.00 25.00 H new ATOM 514 N VAL A 34 14.357 -6.820 5.059 1.00 25.00 N ATOM 515 CA VAL A 34 15.568 -6.185 4.548 1.00 25.00 C ATOM 516 C VAL A 34 15.182 -4.907 3.847 1.00 25.00 C ATOM 517 O VAL A 34 14.388 -4.909 2.904 1.00 25.00 O ATOM 518 CB VAL A 34 16.319 -7.077 3.552 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.638 -6.426 3.100 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.589 -8.425 4.182 1.00 25.00 C ATOM 0 H VAL A 34 14.005 -7.579 4.476 1.00 25.00 H new ATOM 0 HA VAL A 34 16.228 -5.998 5.395 1.00 25.00 H new ATOM 0 HB VAL A 34 15.694 -7.207 2.668 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.146 -7.084 2.395 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.426 -5.472 2.618 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.278 -6.261 3.967 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.123 -9.058 3.473 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.195 -8.293 5.078 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.644 -8.897 4.450 1.00 25.00 H new ATOM 530 N LEU A 35 15.736 -3.816 4.327 1.00 25.00 N ATOM 531 CA LEU A 35 15.452 -2.503 3.801 1.00 25.00 C ATOM 532 C LEU A 35 16.486 -2.153 2.751 1.00 25.00 C ATOM 533 O LEU A 35 16.137 -1.753 1.655 1.00 25.00 O ATOM 534 CB LEU A 35 15.480 -1.499 4.944 1.00 25.00 C ATOM 535 CG LEU A 35 14.437 -1.783 6.032 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.708 -0.888 7.193 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.016 -1.572 5.530 1.00 25.00 C ATOM 0 H LEU A 35 16.402 -3.817 5.100 1.00 25.00 H new ATOM 0 HA LEU A 35 14.466 -2.482 3.337 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.473 -1.500 5.394 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.313 -0.499 4.543 1.00 25.00 H new ATOM 0 HG LEU A 35 14.518 -2.829 6.327 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.975 -1.077 7.977 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.709 -1.084 7.578 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.639 0.152 6.874 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.311 -1.785 6.334 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.895 -0.539 5.205 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.823 -2.241 4.692 1.00 25.00 H new ATOM 549 N GLU A 36 17.752 -2.381 3.044 1.00 25.00 N ATOM 550 CA GLU A 36 18.793 -2.203 2.033 1.00 25.00 C ATOM 551 C GLU A 36 19.969 -3.101 2.354 1.00 25.00 C ATOM 552 O GLU A 36 20.025 -3.689 3.426 1.00 25.00 O ATOM 553 CB GLU A 36 19.215 -0.731 1.909 1.00 25.00 C ATOM 554 CG GLU A 36 20.148 -0.205 2.919 1.00 25.00 C ATOM 555 CD GLU A 36 20.202 1.317 2.904 1.00 25.00 C ATOM 556 OE1 GLU A 36 19.857 1.927 1.870 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.527 1.906 3.955 1.00 25.00 O ATOM 0 H GLU A 36 18.088 -2.686 3.958 1.00 25.00 H new ATOM 0 HA GLU A 36 18.392 -2.490 1.061 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.668 -0.592 0.927 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.313 -0.119 1.933 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.844 -0.548 3.908 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.145 -0.606 2.736 1.00 25.00 H new ATOM 564 N ARG A 37 20.896 -3.229 1.423 1.00 25.00 N ATOM 565 CA ARG A 37 22.076 -4.054 1.621 1.00 25.00 C ATOM 566 C ARG A 37 23.273 -3.161 1.458 1.00 25.00 C ATOM 567 O ARG A 37 23.194 -2.193 0.714 1.00 25.00 O ATOM 568 CB ARG A 37 22.152 -5.148 0.571 1.00 25.00 C ATOM 569 CG ARG A 37 20.969 -6.103 0.546 1.00 25.00 C ATOM 570 CD ARG A 37 21.219 -7.258 -0.439 1.00 25.00 C ATOM 571 NE ARG A 37 21.423 -6.780 -1.824 1.00 25.00 N ATOM 572 CZ ARG A 37 22.605 -6.542 -2.398 1.00 25.00 C ATOM 573 NH1 ARG A 37 23.740 -6.741 -1.782 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.638 -6.077 -3.615 1.00 25.00 N ATOM 0 H ARG A 37 20.854 -2.768 0.514 1.00 25.00 H new ATOM 0 HA ARG A 37 22.039 -4.519 2.606 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.244 -4.682 -0.410 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.062 -5.726 0.736 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.797 -6.502 1.546 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.066 -5.563 0.259 1.00 25.00 H new ATOM 0 HD2 ARG A 37 22.095 -7.822 -0.119 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.372 -7.943 -0.415 1.00 25.00 H new ATOM 0 HE ARG A 37 20.589 -6.618 -2.389 1.00 25.00 H new ATOM 0 HH11 ARG A 37 23.746 -7.092 -0.824 1.00 25.00 H new ATOM 0 HH12 ARG A 37 24.620 -6.546 -2.259 1.00 25.00 H new ATOM 0 HH21 ARG A 37 21.768 -5.899 -4.117 1.00 25.00 H new ATOM 0 HH22 ARG A 37 23.534 -5.891 -4.066 1.00 25.00 H new ATOM 588 N ASP A 38 24.354 -3.509 2.140 1.00 25.00 N ATOM 589 CA ASP A 38 25.633 -2.800 2.056 1.00 25.00 C ATOM 590 C ASP A 38 25.399 -1.336 2.458 1.00 25.00 C ATOM 591 O ASP A 38 25.942 -0.380 1.901 1.00 25.00 O ATOM 592 CB ASP A 38 26.247 -3.016 0.667 1.00 25.00 C ATOM 593 CG ASP A 38 26.222 -4.501 0.258 1.00 25.00 C ATOM 594 OD1 ASP A 38 26.568 -5.370 1.108 1.00 25.00 O ATOM 595 OD2 ASP A 38 25.708 -4.818 -0.846 1.00 25.00 O ATOM 0 H ASP A 38 24.373 -4.304 2.779 1.00 25.00 H new ATOM 0 HA ASP A 38 26.375 -3.190 2.752 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.700 -2.427 -0.069 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.275 -2.655 0.663 1.00 25.00 H new ATOM 600 N THR A 39 24.512 -1.208 3.437 1.00 25.00 N ATOM 601 CA THR A 39 24.049 0.073 3.962 1.00 25.00 C ATOM 602 C THR A 39 25.181 0.844 4.619 1.00 25.00 C ATOM 603 O THR A 39 26.084 0.255 5.178 1.00 25.00 O ATOM 604 CB THR A 39 22.929 -0.167 5.004 1.00 25.00 C ATOM 605 OG1 THR A 39 22.508 1.070 5.582 1.00 25.00 O ATOM 606 CG2 THR A 39 23.356 -1.106 6.095 1.00 25.00 C ATOM 0 H THR A 39 24.084 -2.010 3.900 1.00 25.00 H new ATOM 0 HA THR A 39 23.669 0.661 3.127 1.00 25.00 H new ATOM 0 HB THR A 39 22.098 -0.628 4.470 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.701 1.387 5.125 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.536 -1.242 6.800 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.625 -2.069 5.661 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.218 -0.690 6.617 1.00 25.00 H new ATOM 614 N GLN A 40 25.125 2.169 4.533 1.00 25.00 N ATOM 615 CA GLN A 40 26.141 3.073 5.103 1.00 25.00 C ATOM 616 C GLN A 40 27.558 2.812 4.567 1.00 25.00 C ATOM 617 O GLN A 40 28.536 3.274 5.139 1.00 25.00 O ATOM 618 CB GLN A 40 26.140 3.021 6.644 1.00 25.00 C ATOM 619 CG GLN A 40 24.752 2.946 7.271 1.00 25.00 C ATOM 620 CD GLN A 40 24.747 3.342 8.738 1.00 25.00 C ATOM 621 OE1 GLN A 40 24.927 4.499 9.071 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.519 2.388 9.608 1.00 25.00 N ATOM 0 H GLN A 40 24.366 2.660 4.061 1.00 25.00 H new ATOM 0 HA GLN A 40 25.856 4.074 4.779 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.718 2.155 6.967 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.650 3.905 7.026 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.074 3.598 6.721 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.368 1.931 7.172 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.373 1.430 9.288 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.488 2.603 10.605 1.00 25.00 H new ATOM 631 N GLY A 41 27.660 2.062 3.474 1.00 25.00 N ATOM 632 CA GLY A 41 28.958 1.709 2.917 1.00 25.00 C ATOM 633 C GLY A 41 29.573 0.532 3.651 1.00 25.00 C ATOM 634 O GLY A 41 30.755 0.237 3.498 1.00 25.00 O ATOM 0 H GLY A 41 26.862 1.689 2.959 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.848 1.464 1.861 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.627 2.567 2.977 1.00 25.00 H new ATOM 638 N LEU A 42 28.776 -0.130 4.476 1.00 25.00 N ATOM 639 CA LEU A 42 29.234 -1.260 5.255 1.00 25.00 C ATOM 640 C LEU A 42 29.006 -2.521 4.438 1.00 25.00 C ATOM 641 O LEU A 42 27.940 -3.129 4.492 1.00 25.00 O ATOM 642 CB LEU A 42 28.459 -1.320 6.567 1.00 25.00 C ATOM 643 CG LEU A 42 28.513 -0.079 7.457 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.434 -0.201 8.509 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.859 0.073 8.118 1.00 25.00 C ATOM 0 H LEU A 42 27.794 0.105 4.621 1.00 25.00 H new ATOM 0 HA LEU A 42 30.294 -1.164 5.490 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.414 -1.526 6.335 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.831 -2.167 7.143 1.00 25.00 H new ATOM 0 HG LEU A 42 28.352 0.805 6.841 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.456 0.676 9.156 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.460 -0.271 8.025 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.607 -1.096 9.106 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.859 0.966 8.743 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.062 -0.802 8.736 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.631 0.164 7.354 1.00 25.00 H new ATOM 657 N ASP A 43 29.995 -2.891 3.647 1.00 25.00 N ATOM 658 CA ASP A 43 29.879 -4.067 2.784 1.00 25.00 C ATOM 659 C ASP A 43 29.557 -5.309 3.605 1.00 25.00 C ATOM 660 O ASP A 43 30.210 -5.609 4.608 1.00 25.00 O ATOM 661 CB ASP A 43 31.175 -4.312 2.009 1.00 25.00 C ATOM 662 CG ASP A 43 31.274 -3.468 0.754 1.00 25.00 C ATOM 663 OD1 ASP A 43 30.326 -3.498 -0.059 1.00 25.00 O ATOM 664 OD2 ASP A 43 32.324 -2.823 0.552 1.00 25.00 O ATOM 0 H ASP A 43 30.887 -2.401 3.579 1.00 25.00 H new ATOM 0 HA ASP A 43 29.070 -3.873 2.080 1.00 25.00 H new ATOM 0 HB2 ASP A 43 32.026 -4.097 2.655 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.238 -5.366 1.739 1.00 25.00 H new ATOM 669 N GLY A 44 28.532 -6.032 3.180 1.00 25.00 N ATOM 670 CA GLY A 44 28.133 -7.245 3.870 1.00 25.00 C ATOM 671 C GLY A 44 27.140 -7.016 4.994 1.00 25.00 C ATOM 672 O GLY A 44 26.513 -7.973 5.454 1.00 25.00 O ATOM 0 H GLY A 44 27.965 -5.800 2.365 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.696 -7.935 3.148 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.021 -7.729 4.276 1.00 25.00 H new ATOM 676 N TRP A 45 26.963 -5.778 5.433 1.00 25.00 N ATOM 677 CA TRP A 45 25.983 -5.461 6.452 1.00 25.00 C ATOM 678 C TRP A 45 24.694 -5.060 5.755 1.00 25.00 C ATOM 679 O TRP A 45 24.696 -4.234 4.855 1.00 25.00 O ATOM 680 CB TRP A 45 26.506 -4.301 7.283 1.00 25.00 C ATOM 681 CG TRP A 45 27.557 -4.720 8.265 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.890 -4.472 8.213 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.356 -5.464 9.473 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.540 -4.975 9.297 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.628 -5.606 10.101 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.227 -6.015 10.101 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.786 -6.284 11.327 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.378 -6.678 11.330 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.655 -6.813 11.929 1.00 25.00 C ATOM 0 H TRP A 45 27.491 -4.974 5.094 1.00 25.00 H new ATOM 0 HA TRP A 45 25.801 -6.316 7.103 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.917 -3.541 6.619 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.676 -3.841 7.820 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.376 -3.940 7.409 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.540 -4.896 9.481 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.252 -5.930 9.643 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.759 -6.388 11.784 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.511 -7.090 11.824 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.749 -7.336 12.869 1.00 25.00 H new ATOM 700 N TRP A 46 23.583 -5.655 6.153 1.00 25.00 N ATOM 701 CA TRP A 46 22.300 -5.388 5.507 1.00 25.00 C ATOM 702 C TRP A 46 21.361 -4.741 6.508 1.00 25.00 C ATOM 703 O TRP A 46 21.182 -5.245 7.609 1.00 25.00 O ATOM 704 CB TRP A 46 21.701 -6.693 4.960 1.00 25.00 C ATOM 705 CG TRP A 46 22.548 -7.342 3.861 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.677 -6.850 3.280 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.327 -8.618 3.224 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.172 -7.691 2.335 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.376 -8.800 2.271 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.353 -9.629 3.359 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.464 -9.950 1.458 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.456 -10.793 2.561 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.502 -10.935 1.611 1.00 25.00 C ATOM 0 H TRP A 46 23.538 -6.327 6.919 1.00 25.00 H new ATOM 0 HA TRP A 46 22.447 -4.707 4.669 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.581 -7.400 5.781 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.705 -6.489 4.567 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.126 -5.903 3.540 1.00 25.00 H new ATOM 0 HE1 TRP A 46 25.002 -7.522 1.766 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.540 -9.516 4.061 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.260 -10.059 0.736 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.730 -11.584 2.676 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.548 -11.824 0.999 1.00 25.00 H new ATOM 724 N LEU A 47 20.779 -3.616 6.131 1.00 25.00 N ATOM 725 CA LEU A 47 19.848 -2.900 6.995 1.00 25.00 C ATOM 726 C LEU A 47 18.549 -3.661 6.997 1.00 25.00 C ATOM 727 O LEU A 47 17.948 -3.857 5.947 1.00 25.00 O ATOM 728 CB LEU A 47 19.597 -1.491 6.457 1.00 25.00 C ATOM 729 CG LEU A 47 18.612 -0.616 7.243 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.040 -0.427 8.688 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.471 0.736 6.558 1.00 25.00 C ATOM 0 H LEU A 47 20.935 -3.173 5.225 1.00 25.00 H new ATOM 0 HA LEU A 47 20.262 -2.820 8.000 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.553 -0.969 6.411 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.232 -1.578 5.434 1.00 25.00 H new ATOM 0 HG LEU A 47 17.650 -1.128 7.256 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.312 0.199 9.204 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.098 -1.398 9.180 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.018 0.054 8.718 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.771 1.356 7.118 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.443 1.228 6.521 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.098 0.593 5.544 1.00 25.00 H new ATOM 743 N CYS A 48 18.107 -4.087 8.165 1.00 25.00 N ATOM 744 CA CYS A 48 16.854 -4.803 8.285 1.00 25.00 C ATOM 745 C CYS A 48 16.052 -4.286 9.454 1.00 25.00 C ATOM 746 O CYS A 48 16.549 -3.522 10.275 1.00 25.00 O ATOM 747 CB CYS A 48 17.112 -6.307 8.450 1.00 25.00 C ATOM 748 SG CYS A 48 18.322 -6.984 7.280 1.00 25.00 S ATOM 0 H CYS A 48 18.600 -3.948 9.047 1.00 25.00 H new ATOM 0 HA CYS A 48 16.281 -4.640 7.372 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.460 -6.496 9.466 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.170 -6.842 8.331 1.00 25.00 H new ATOM 0 HG CYS A 48 19.446 -6.342 7.398 1.00 25.00 H new ATOM 754 N SER A 49 14.808 -4.721 9.524 1.00 25.00 N ATOM 755 CA SER A 49 13.916 -4.359 10.609 1.00 25.00 C ATOM 756 C SER A 49 13.361 -5.636 11.227 1.00 25.00 C ATOM 757 O SER A 49 12.895 -6.536 10.514 1.00 25.00 O ATOM 758 CB SER A 49 12.808 -3.455 10.074 1.00 25.00 C ATOM 759 OG SER A 49 11.558 -4.121 10.017 1.00 25.00 O ATOM 0 H SER A 49 14.387 -5.337 8.828 1.00 25.00 H new ATOM 0 HA SER A 49 14.447 -3.805 11.383 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.720 -2.574 10.710 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.077 -3.103 9.078 1.00 25.00 H new ATOM 0 HG SER A 49 10.876 -3.508 9.671 1.00 25.00 H new ATOM 765 N LEU A 50 13.475 -5.733 12.543 1.00 25.00 N ATOM 766 CA LEU A 50 13.062 -6.908 13.303 1.00 25.00 C ATOM 767 C LEU A 50 12.630 -6.449 14.690 1.00 25.00 C ATOM 768 O LEU A 50 13.285 -5.601 15.280 1.00 25.00 O ATOM 769 CB LEU A 50 14.251 -7.858 13.443 1.00 25.00 C ATOM 770 CG LEU A 50 13.983 -9.161 14.201 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.950 -10.329 13.269 1.00 25.00 C ATOM 772 CD2 LEU A 50 15.053 -9.343 15.258 1.00 25.00 C ATOM 0 H LEU A 50 13.862 -4.989 13.123 1.00 25.00 H new ATOM 0 HA LEU A 50 12.243 -7.419 12.796 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.610 -8.109 12.445 1.00 25.00 H new ATOM 0 HB3 LEU A 50 15.058 -7.327 13.948 1.00 25.00 H new ATOM 0 HG LEU A 50 13.006 -9.103 14.680 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.758 -11.241 13.835 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.159 -10.185 12.533 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.909 -10.414 12.758 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.871 -10.269 15.804 1.00 25.00 H new ATOM 0 HD22 LEU A 50 16.032 -9.389 14.781 1.00 25.00 H new ATOM 0 HD23 LEU A 50 15.027 -8.502 15.951 1.00 25.00 H new ATOM 784 N HIS A 51 11.519 -6.988 15.185 1.00 25.00 N ATOM 785 CA HIS A 51 10.985 -6.661 16.524 1.00 25.00 C ATOM 786 C HIS A 51 10.764 -5.150 16.709 1.00 25.00 C ATOM 787 O HIS A 51 10.897 -4.625 17.807 1.00 25.00 O ATOM 788 CB HIS A 51 11.920 -7.186 17.633 1.00 25.00 C ATOM 789 CG HIS A 51 12.126 -8.670 17.605 1.00 25.00 C ATOM 790 ND1 HIS A 51 13.173 -9.315 18.216 1.00 25.00 N ATOM 791 CD2 HIS A 51 11.390 -9.661 17.028 1.00 25.00 C ATOM 792 CE1 HIS A 51 13.041 -10.622 17.996 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.968 -10.888 17.281 1.00 25.00 N ATOM 0 H HIS A 51 10.955 -7.667 14.675 1.00 25.00 H new ATOM 0 HA HIS A 51 10.017 -7.156 16.602 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.888 -6.693 17.541 1.00 25.00 H new ATOM 0 HB3 HIS A 51 11.510 -6.905 18.603 1.00 25.00 H new ATOM 0 HD2 HIS A 51 10.487 -9.508 16.456 1.00 25.00 H new ATOM 0 HE1 HIS A 51 13.729 -11.371 18.359 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.636 -11.804 16.979 1.00 25.00 H new ATOM 801 N GLY A 52 10.427 -4.459 15.628 1.00 25.00 N ATOM 802 CA GLY A 52 10.184 -3.024 15.702 1.00 25.00 C ATOM 803 C GLY A 52 11.445 -2.182 15.835 1.00 25.00 C ATOM 804 O GLY A 52 11.364 -0.997 16.139 1.00 25.00 O ATOM 0 H GLY A 52 10.316 -4.864 14.698 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.645 -2.712 14.807 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.534 -2.821 16.553 1.00 25.00 H new ATOM 808 N ARG A 53 12.608 -2.777 15.598 1.00 25.00 N ATOM 809 CA ARG A 53 13.877 -2.069 15.677 1.00 25.00 C ATOM 810 C ARG A 53 14.525 -2.214 14.326 1.00 25.00 C ATOM 811 O ARG A 53 14.373 -3.241 13.675 1.00 25.00 O ATOM 812 CB ARG A 53 14.767 -2.675 16.753 1.00 25.00 C ATOM 813 CG ARG A 53 15.862 -1.723 17.230 1.00 25.00 C ATOM 814 CD ARG A 53 17.204 -2.349 16.975 1.00 25.00 C ATOM 815 NE ARG A 53 18.340 -1.640 17.590 1.00 25.00 N ATOM 816 CZ ARG A 53 18.745 -1.778 18.850 1.00 25.00 C ATOM 817 NH1 ARG A 53 18.119 -2.545 19.709 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.800 -1.139 19.255 1.00 25.00 N ATOM 0 H ARG A 53 12.696 -3.761 15.346 1.00 25.00 H new ATOM 0 HA ARG A 53 13.724 -1.022 15.938 1.00 25.00 H new ATOM 0 HB2 ARG A 53 14.151 -2.967 17.604 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.227 -3.584 16.366 1.00 25.00 H new ATOM 0 HG2 ARG A 53 15.786 -0.770 16.706 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.741 -1.513 18.293 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.188 -3.374 17.346 1.00 25.00 H new ATOM 0 HD3 ARG A 53 17.366 -2.403 15.898 1.00 25.00 H new ATOM 0 HE ARG A 53 18.859 -0.989 17.001 1.00 25.00 H new ATOM 0 HH11 ARG A 53 17.289 -3.063 19.420 1.00 25.00 H new ATOM 0 HH12 ARG A 53 18.462 -2.624 20.666 1.00 25.00 H new ATOM 0 HH21 ARG A 53 20.311 -0.537 18.609 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.118 -1.239 20.219 1.00 25.00 H new ATOM 832 N GLN A 54 15.248 -1.198 13.910 1.00 25.00 N ATOM 833 CA GLN A 54 15.973 -1.235 12.656 1.00 25.00 C ATOM 834 C GLN A 54 17.441 -1.358 12.997 1.00 25.00 C ATOM 835 O GLN A 54 17.877 -0.826 14.015 1.00 25.00 O ATOM 836 CB GLN A 54 15.721 0.047 11.874 1.00 25.00 C ATOM 837 CG GLN A 54 14.960 -0.173 10.603 1.00 25.00 C ATOM 838 CD GLN A 54 14.701 1.122 9.853 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.575 1.430 9.507 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.741 1.875 9.593 1.00 25.00 N ATOM 0 H GLN A 54 15.351 -0.325 14.428 1.00 25.00 H new ATOM 0 HA GLN A 54 15.648 -2.073 12.040 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.169 0.745 12.503 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.677 0.515 11.640 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.518 -0.856 9.962 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.009 -0.655 10.831 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.670 1.585 9.899 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.622 2.751 9.085 1.00 25.00 H new ATOM 849 N GLY A 55 18.193 -2.058 12.168 1.00 25.00 N ATOM 850 CA GLY A 55 19.610 -2.213 12.414 1.00 25.00 C ATOM 851 C GLY A 55 20.300 -3.038 11.353 1.00 25.00 C ATOM 852 O GLY A 55 19.642 -3.626 10.495 1.00 25.00 O ATOM 0 H GLY A 55 17.849 -2.523 11.328 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.076 -1.229 12.463 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.756 -2.683 13.386 1.00 25.00 H new ATOM 856 N ILE A 56 21.621 -3.069 11.393 1.00 25.00 N ATOM 857 CA ILE A 56 22.409 -3.818 10.424 1.00 25.00 C ATOM 858 C ILE A 56 22.488 -5.281 10.844 1.00 25.00 C ATOM 859 O ILE A 56 22.307 -5.631 12.014 1.00 25.00 O ATOM 860 CB ILE A 56 23.834 -3.209 10.257 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.621 -3.326 11.578 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.707 -1.732 9.840 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.021 -2.753 11.537 1.00 25.00 C ATOM 0 H ILE A 56 22.177 -2.579 12.094 1.00 25.00 H new ATOM 0 HA ILE A 56 21.915 -3.754 9.455 1.00 25.00 H new ATOM 0 HB ILE A 56 24.375 -3.757 9.486 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.060 -2.821 12.364 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.682 -4.378 11.856 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.701 -1.301 9.722 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.168 -1.666 8.895 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.162 -1.183 10.608 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.495 -2.881 12.510 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.605 -3.273 10.777 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.973 -1.692 11.294 1.00 25.00 H new ATOM 875 N VAL A 57 22.703 -6.135 9.860 1.00 25.00 N ATOM 876 CA VAL A 57 22.761 -7.580 10.053 1.00 25.00 C ATOM 877 C VAL A 57 23.863 -8.138 9.167 1.00 25.00 C ATOM 878 O VAL A 57 23.986 -7.727 8.017 1.00 25.00 O ATOM 879 CB VAL A 57 21.434 -8.235 9.596 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.485 -9.734 9.675 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.264 -7.688 10.406 1.00 25.00 C ATOM 0 H VAL A 57 22.844 -5.846 8.892 1.00 25.00 H new ATOM 0 HA VAL A 57 22.940 -7.789 11.108 1.00 25.00 H new ATOM 0 HB VAL A 57 21.287 -7.977 8.547 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.532 -10.148 9.345 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.284 -10.105 9.033 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.675 -10.038 10.704 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.339 -8.158 10.072 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.420 -7.904 11.463 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.195 -6.610 10.263 1.00 25.00 H new ATOM 891 N PRO A 58 24.650 -9.103 9.663 1.00 25.00 N ATOM 892 CA PRO A 58 25.628 -9.707 8.760 1.00 25.00 C ATOM 893 C PRO A 58 24.936 -10.572 7.699 1.00 25.00 C ATOM 894 O PRO A 58 24.310 -11.589 8.016 1.00 25.00 O ATOM 895 CB PRO A 58 26.491 -10.542 9.709 1.00 25.00 C ATOM 896 CG PRO A 58 25.567 -10.917 10.823 1.00 25.00 C ATOM 897 CD PRO A 58 24.662 -9.730 10.995 1.00 25.00 C ATOM 0 HA PRO A 58 26.208 -8.981 8.191 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.890 -11.425 9.210 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.344 -9.971 10.076 1.00 25.00 H new ATOM 0 HG2 PRO A 58 24.999 -11.814 10.579 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.119 -11.128 11.739 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.661 -10.031 11.305 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.039 -9.046 11.756 1.00 25.00 H new ATOM 905 N GLY A 59 25.074 -10.193 6.437 1.00 25.00 N ATOM 906 CA GLY A 59 24.477 -10.951 5.345 1.00 25.00 C ATOM 907 C GLY A 59 25.050 -12.350 5.256 1.00 25.00 C ATOM 908 O GLY A 59 24.426 -13.260 4.737 1.00 25.00 O ATOM 0 H GLY A 59 25.594 -9.366 6.143 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.398 -11.008 5.489 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.646 -10.428 4.404 1.00 25.00 H new ATOM 912 N ASN A 60 26.221 -12.535 5.851 1.00 25.00 N ATOM 913 CA ASN A 60 26.879 -13.844 5.916 1.00 25.00 C ATOM 914 C ASN A 60 26.054 -14.864 6.724 1.00 25.00 C ATOM 915 O ASN A 60 26.247 -16.068 6.609 1.00 25.00 O ATOM 916 CB ASN A 60 28.269 -13.678 6.551 1.00 25.00 C ATOM 917 CG ASN A 60 29.240 -14.759 6.127 1.00 25.00 C ATOM 918 OD1 ASN A 60 28.985 -15.521 5.215 1.00 25.00 O ATOM 919 ND2 ASN A 60 30.374 -14.797 6.764 1.00 25.00 N ATOM 0 H ASN A 60 26.745 -11.786 6.303 1.00 25.00 H new ATOM 0 HA ASN A 60 26.970 -14.229 4.900 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.675 -12.704 6.277 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.171 -13.689 7.637 1.00 25.00 H new ATOM 0 HD21 ASN A 60 31.083 -15.482 6.503 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.554 -14.142 7.525 1.00 25.00 H new ATOM 926 N ARG A 61 25.122 -14.373 7.536 1.00 25.00 N ATOM 927 CA ARG A 61 24.241 -15.234 8.330 1.00 25.00 C ATOM 928 C ARG A 61 22.785 -15.079 7.903 1.00 25.00 C ATOM 929 O ARG A 61 21.882 -15.566 8.591 1.00 25.00 O ATOM 930 CB ARG A 61 24.366 -14.880 9.816 1.00 25.00 C ATOM 931 CG ARG A 61 25.770 -15.043 10.375 1.00 25.00 C ATOM 932 CD ARG A 61 25.767 -14.828 11.876 1.00 25.00 C ATOM 933 NE ARG A 61 27.110 -14.994 12.451 1.00 25.00 N ATOM 934 CZ ARG A 61 27.391 -15.031 13.749 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.471 -14.947 14.675 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.632 -15.174 14.114 1.00 25.00 N ATOM 0 H ARG A 61 24.954 -13.375 7.664 1.00 25.00 H new ATOM 0 HA ARG A 61 24.546 -16.267 8.164 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.046 -13.848 9.961 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.683 -15.509 10.387 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.147 -16.039 10.144 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.443 -14.329 9.900 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.396 -13.828 12.100 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.081 -15.534 12.344 1.00 25.00 H new ATOM 0 HE ARG A 61 27.890 -15.088 11.800 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.490 -14.849 14.412 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.734 -14.980 15.660 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.365 -15.255 13.409 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.872 -15.205 15.105 1.00 25.00 H new ATOM 950 N LEU A 62 22.544 -14.400 6.788 1.00 25.00 N ATOM 951 CA LEU A 62 21.180 -14.113 6.349 1.00 25.00 C ATOM 952 C LEU A 62 20.896 -14.553 4.922 1.00 25.00 C ATOM 953 O LEU A 62 21.717 -14.405 4.030 1.00 25.00 O ATOM 954 CB LEU A 62 20.916 -12.617 6.469 1.00 25.00 C ATOM 955 CG LEU A 62 19.472 -12.216 6.767 1.00 25.00 C ATOM 956 CD1 LEU A 62 18.989 -12.690 8.090 1.00 25.00 C ATOM 957 CD2 LEU A 62 19.334 -10.716 6.658 1.00 25.00 C ATOM 0 H LEU A 62 23.272 -14.038 6.172 1.00 25.00 H new ATOM 0 HA LEU A 62 20.517 -14.687 6.996 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.554 -12.217 7.257 1.00 25.00 H new ATOM 0 HB3 LEU A 62 21.221 -12.138 5.539 1.00 25.00 H new ATOM 0 HG LEU A 62 18.842 -12.707 6.025 1.00 25.00 H new ATOM 0 HD11 LEU A 62 17.957 -12.370 8.237 1.00 25.00 H new ATOM 0 HD12 LEU A 62 19.041 -13.778 8.128 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.614 -12.270 8.878 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.304 -10.429 6.870 1.00 25.00 H new ATOM 0 HD22 LEU A 62 20.000 -10.236 7.375 1.00 25.00 H new ATOM 0 HD23 LEU A 62 19.598 -10.399 5.649 1.00 25.00 H new ATOM 969 N LYS A 63 19.702 -15.080 4.711 1.00 25.00 N ATOM 970 CA LYS A 63 19.287 -15.538 3.385 1.00 25.00 C ATOM 971 C LYS A 63 18.062 -14.820 2.907 1.00 25.00 C ATOM 972 O LYS A 63 16.996 -14.927 3.502 1.00 25.00 O ATOM 973 CB LYS A 63 19.006 -17.041 3.396 1.00 25.00 C ATOM 974 CG LYS A 63 18.441 -17.582 2.075 1.00 25.00 C ATOM 975 CD LYS A 63 18.453 -19.105 2.026 1.00 25.00 C ATOM 976 CE LYS A 63 17.496 -19.741 3.035 1.00 25.00 C ATOM 977 NZ LYS A 63 17.647 -21.240 3.023 1.00 25.00 N ATOM 0 H LYS A 63 18.998 -15.204 5.439 1.00 25.00 H new ATOM 0 HA LYS A 63 20.109 -15.320 2.704 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.930 -17.571 3.628 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.302 -17.262 4.198 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.420 -17.224 1.945 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.025 -17.189 1.243 1.00 25.00 H new ATOM 0 HD2 LYS A 63 18.185 -19.433 1.022 1.00 25.00 H new ATOM 0 HD3 LYS A 63 19.465 -19.462 2.218 1.00 25.00 H new ATOM 0 HE2 LYS A 63 17.701 -19.356 4.034 1.00 25.00 H new ATOM 0 HE3 LYS A 63 16.468 -19.470 2.793 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 16.992 -21.660 3.713 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 17.430 -21.603 2.073 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 18.624 -21.493 3.275 1.00 25.00 H new ATOM 991 N ILE A 64 18.211 -14.144 1.787 1.00 25.00 N ATOM 992 CA ILE A 64 17.113 -13.430 1.162 1.00 25.00 C ATOM 993 C ILE A 64 16.097 -14.436 0.636 1.00 25.00 C ATOM 994 O ILE A 64 16.443 -15.361 -0.103 1.00 25.00 O ATOM 995 CB ILE A 64 17.643 -12.557 -0.004 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.731 -11.584 0.501 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.516 -11.779 -0.653 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.291 -10.619 1.631 1.00 25.00 C ATOM 0 H ILE A 64 19.095 -14.073 1.283 1.00 25.00 H new ATOM 0 HA ILE A 64 16.637 -12.781 1.897 1.00 25.00 H new ATOM 0 HB ILE A 64 18.080 -13.221 -0.750 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.580 -12.168 0.856 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.083 -10.991 -0.343 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.914 -11.174 -1.468 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.773 -12.474 -1.045 1.00 25.00 H new ATOM 0 HG23 ILE A 64 16.049 -11.129 0.087 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.129 -9.981 1.911 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.465 -10.000 1.280 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.969 -11.196 2.498 1.00 25.00 H new ATOM 1010 N LEU A 65 14.845 -14.270 1.029 1.00 25.00 N ATOM 1011 CA LEU A 65 13.779 -15.152 0.585 1.00 25.00 C ATOM 1012 C LEU A 65 13.120 -14.538 -0.641 1.00 25.00 C ATOM 1013 O LEU A 65 12.135 -13.822 -0.543 1.00 25.00 O ATOM 1014 CB LEU A 65 12.760 -15.367 1.707 1.00 25.00 C ATOM 1015 CG LEU A 65 13.343 -15.926 3.016 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.229 -16.039 4.043 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.025 -17.293 2.810 1.00 25.00 C ATOM 0 H LEU A 65 14.541 -13.527 1.659 1.00 25.00 H new ATOM 0 HA LEU A 65 14.189 -16.128 0.324 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.272 -14.416 1.921 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.988 -16.049 1.350 1.00 25.00 H new ATOM 0 HG LEU A 65 14.112 -15.240 3.370 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.632 -16.435 4.975 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.799 -15.054 4.223 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.456 -16.710 3.669 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.422 -17.649 3.761 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.297 -18.009 2.430 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.840 -17.189 2.093 1.00 25.00 H new ATOM 1029 N VAL A 66 13.700 -14.820 -1.798 1.00 25.00 N ATOM 1030 CA VAL A 66 13.202 -14.303 -3.077 1.00 25.00 C ATOM 1031 C VAL A 66 11.811 -14.882 -3.362 1.00 25.00 C ATOM 1032 O VAL A 66 10.994 -14.278 -4.052 1.00 25.00 O ATOM 1033 CB VAL A 66 14.190 -14.686 -4.237 1.00 25.00 C ATOM 1034 CG1 VAL A 66 13.755 -14.070 -5.577 1.00 25.00 C ATOM 1035 CG2 VAL A 66 15.621 -14.210 -3.896 1.00 25.00 C ATOM 0 H VAL A 66 14.527 -15.411 -1.884 1.00 25.00 H new ATOM 0 HA VAL A 66 13.134 -13.217 -3.019 1.00 25.00 H new ATOM 0 HB VAL A 66 14.174 -15.771 -4.337 1.00 25.00 H new ATOM 0 HG11 VAL A 66 14.462 -14.356 -6.356 1.00 25.00 H new ATOM 0 HG12 VAL A 66 12.761 -14.432 -5.838 1.00 25.00 H new ATOM 0 HG13 VAL A 66 13.733 -12.984 -5.488 1.00 25.00 H new ATOM 0 HG21 VAL A 66 16.297 -14.481 -4.707 1.00 25.00 H new ATOM 0 HG22 VAL A 66 15.623 -13.128 -3.767 1.00 25.00 H new ATOM 0 HG23 VAL A 66 15.952 -14.686 -2.973 1.00 25.00 H new ATOM 1045 N GLY A 67 11.555 -16.066 -2.822 1.00 25.00 N ATOM 1046 CA GLY A 67 10.282 -16.746 -3.022 1.00 25.00 C ATOM 1047 C GLY A 67 10.287 -17.504 -4.331 1.00 25.00 C ATOM 1048 O GLY A 67 10.057 -18.704 -4.369 1.00 25.00 O ATOM 0 H GLY A 67 12.217 -16.578 -2.239 1.00 25.00 H new ATOM 0 HA2 GLY A 67 10.097 -17.434 -2.197 1.00 25.00 H new ATOM 0 HA3 GLY A 67 9.470 -16.019 -3.019 1.00 25.00 H new ATOM 1052 N MET A 68 10.621 -16.807 -5.403 1.00 25.00 N ATOM 1053 CA MET A 68 10.767 -17.430 -6.708 1.00 25.00 C ATOM 1054 C MET A 68 12.039 -18.271 -6.720 1.00 25.00 C ATOM 1055 O MET A 68 12.970 -18.018 -5.950 1.00 25.00 O ATOM 1056 CB MET A 68 10.860 -16.363 -7.799 1.00 25.00 C ATOM 1057 CG MET A 68 9.627 -15.482 -7.903 1.00 25.00 C ATOM 1058 SD MET A 68 9.742 -14.347 -9.304 1.00 25.00 S ATOM 1059 CE MET A 68 10.974 -13.152 -8.720 1.00 25.00 C ATOM 0 H MET A 68 10.797 -15.802 -5.395 1.00 25.00 H new ATOM 0 HA MET A 68 9.898 -18.059 -6.901 1.00 25.00 H new ATOM 0 HB2 MET A 68 11.729 -15.734 -7.606 1.00 25.00 H new ATOM 0 HB3 MET A 68 11.028 -16.852 -8.759 1.00 25.00 H new ATOM 0 HG2 MET A 68 8.740 -16.106 -8.011 1.00 25.00 H new ATOM 0 HG3 MET A 68 9.506 -14.913 -6.981 1.00 25.00 H new ATOM 0 HE1 MET A 68 11.049 -12.330 -9.432 1.00 25.00 H new ATOM 0 HE2 MET A 68 10.672 -12.764 -7.747 1.00 25.00 H new ATOM 0 HE3 MET A 68 11.943 -13.643 -8.629 1.00 25.00 H new ATOM 1069 N TYR A 69 12.069 -19.240 -7.630 1.00 25.00 N ATOM 1070 CA TYR A 69 13.229 -20.116 -7.883 1.00 25.00 C ATOM 1071 C TYR A 69 13.619 -21.025 -6.710 1.00 25.00 C ATOM 1072 O TYR A 69 14.682 -21.666 -6.741 1.00 25.00 O ATOM 1073 CB TYR A 69 14.452 -19.291 -8.326 1.00 25.00 C ATOM 1074 CG TYR A 69 14.110 -18.122 -9.233 1.00 25.00 C ATOM 1075 CD1 TYR A 69 14.297 -16.793 -8.792 1.00 25.00 C ATOM 1076 CD2 TYR A 69 13.600 -18.331 -10.532 1.00 25.00 C ATOM 1077 CE1 TYR A 69 13.966 -15.692 -9.629 1.00 25.00 C ATOM 1078 CE2 TYR A 69 13.267 -17.229 -11.371 1.00 25.00 C ATOM 1079 CZ TYR A 69 13.451 -15.922 -10.905 1.00 25.00 C ATOM 1080 OH TYR A 69 13.124 -14.854 -11.700 1.00 25.00 O ATOM 0 H TYR A 69 11.272 -19.450 -8.231 1.00 25.00 H new ATOM 0 HA TYR A 69 12.905 -20.780 -8.685 1.00 25.00 H new ATOM 0 HB2 TYR A 69 14.963 -18.914 -7.440 1.00 25.00 H new ATOM 0 HB3 TYR A 69 15.152 -19.947 -8.843 1.00 25.00 H new ATOM 0 HD1 TYR A 69 14.697 -16.611 -7.805 1.00 25.00 H new ATOM 0 HD2 TYR A 69 13.460 -19.339 -10.895 1.00 25.00 H new ATOM 0 HE1 TYR A 69 14.113 -14.681 -9.278 1.00 25.00 H new ATOM 0 HE2 TYR A 69 12.874 -17.401 -12.362 1.00 25.00 H new ATOM 0 HH TYR A 69 12.780 -15.178 -12.558 1.00 25.00 H new ATOM 1090 N ASP A 70 12.767 -21.107 -5.697 1.00 25.00 N ATOM 1091 CA ASP A 70 13.014 -21.986 -4.556 1.00 25.00 C ATOM 1092 C ASP A 70 12.762 -23.440 -4.971 1.00 25.00 C ATOM 1093 O ASP A 70 12.243 -23.698 -6.057 1.00 25.00 O ATOM 1094 CB ASP A 70 12.140 -21.583 -3.364 1.00 25.00 C ATOM 1095 CG ASP A 70 10.988 -22.539 -3.131 1.00 25.00 C ATOM 1096 OD1 ASP A 70 11.143 -23.423 -2.259 1.00 25.00 O ATOM 1097 OD2 ASP A 70 9.945 -22.416 -3.785 1.00 25.00 O ATOM 0 H ASP A 70 11.898 -20.576 -5.640 1.00 25.00 H new ATOM 0 HA ASP A 70 14.053 -21.889 -4.242 1.00 25.00 H new ATOM 0 HB2 ASP A 70 12.756 -21.538 -2.466 1.00 25.00 H new ATOM 0 HB3 ASP A 70 11.746 -20.580 -3.531 1.00 25.00 H new ATOM 1102 N LYS A 71 13.235 -24.385 -4.161 1.00 25.00 N ATOM 1103 CA LYS A 71 13.183 -25.812 -4.510 1.00 25.00 C ATOM 1104 C LYS A 71 12.816 -26.692 -3.313 1.00 25.00 C ATOM 1105 O LYS A 71 13.426 -27.734 -3.087 1.00 25.00 O ATOM 1106 CB LYS A 71 14.534 -26.251 -5.106 1.00 25.00 C ATOM 1107 CG LYS A 71 14.864 -25.526 -6.410 1.00 25.00 C ATOM 1108 CD LYS A 71 16.222 -25.892 -6.969 1.00 25.00 C ATOM 1109 CE LYS A 71 16.472 -25.128 -8.274 1.00 25.00 C ATOM 1110 NZ LYS A 71 16.452 -23.628 -8.071 1.00 25.00 N ATOM 0 H LYS A 71 13.661 -24.192 -3.254 1.00 25.00 H new ATOM 0 HA LYS A 71 12.395 -25.942 -5.252 1.00 25.00 H new ATOM 0 HB2 LYS A 71 15.325 -26.064 -4.380 1.00 25.00 H new ATOM 0 HB3 LYS A 71 14.515 -27.326 -5.287 1.00 25.00 H new ATOM 0 HG2 LYS A 71 14.099 -25.758 -7.151 1.00 25.00 H new ATOM 0 HG3 LYS A 71 14.827 -24.450 -6.239 1.00 25.00 H new ATOM 0 HD2 LYS A 71 17.000 -25.654 -6.243 1.00 25.00 H new ATOM 0 HD3 LYS A 71 16.273 -26.966 -7.150 1.00 25.00 H new ATOM 0 HE2 LYS A 71 17.436 -25.424 -8.687 1.00 25.00 H new ATOM 0 HE3 LYS A 71 15.713 -25.404 -9.006 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 16.774 -23.156 -8.940 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 15.484 -23.321 -7.848 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 17.085 -23.376 -7.285 1.00 25.00 H new ATOM 1124 N LYS A 72 11.837 -26.263 -2.528 1.00 25.00 N ATOM 1125 CA LYS A 72 11.360 -27.079 -1.404 1.00 25.00 C ATOM 1126 C LYS A 72 10.709 -28.350 -1.944 1.00 25.00 C ATOM 1127 O LYS A 72 10.117 -28.333 -3.013 1.00 25.00 O ATOM 1128 CB LYS A 72 10.289 -26.332 -0.613 1.00 25.00 C ATOM 1129 CG LYS A 72 10.799 -25.324 0.388 1.00 25.00 C ATOM 1130 CD LYS A 72 9.600 -24.707 1.068 1.00 25.00 C ATOM 1131 CE LYS A 72 9.967 -23.554 1.967 1.00 25.00 C ATOM 1132 NZ LYS A 72 8.722 -23.056 2.641 1.00 25.00 N ATOM 0 H LYS A 72 11.359 -25.369 -2.640 1.00 25.00 H new ATOM 0 HA LYS A 72 12.214 -27.305 -0.765 1.00 25.00 H new ATOM 0 HB2 LYS A 72 9.635 -25.818 -1.318 1.00 25.00 H new ATOM 0 HB3 LYS A 72 9.677 -27.063 -0.085 1.00 25.00 H new ATOM 0 HG2 LYS A 72 11.448 -25.806 1.119 1.00 25.00 H new ATOM 0 HG3 LYS A 72 11.393 -24.558 -0.110 1.00 25.00 H new ATOM 0 HD2 LYS A 72 8.896 -24.361 0.311 1.00 25.00 H new ATOM 0 HD3 LYS A 72 9.088 -25.470 1.654 1.00 25.00 H new ATOM 0 HE2 LYS A 72 10.698 -23.872 2.710 1.00 25.00 H new ATOM 0 HE3 LYS A 72 10.429 -22.755 1.387 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 8.973 -22.328 3.340 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 8.082 -22.647 1.930 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 8.247 -23.847 3.120 1.00 25.00 H new ATOM 1146 N PRO A 73 10.731 -29.446 -1.162 1.00 25.00 N ATOM 1147 CA PRO A 73 9.992 -30.633 -1.608 1.00 25.00 C ATOM 1148 C PRO A 73 8.479 -30.501 -1.389 1.00 25.00 C ATOM 1149 O PRO A 73 7.696 -31.277 -1.919 1.00 25.00 O ATOM 1150 CB PRO A 73 10.576 -31.741 -0.728 1.00 25.00 C ATOM 1151 CG PRO A 73 10.906 -31.051 0.548 1.00 25.00 C ATOM 1152 CD PRO A 73 11.387 -29.671 0.143 1.00 25.00 C ATOM 0 HA PRO A 73 10.098 -30.812 -2.678 1.00 25.00 H new ATOM 0 HB2 PRO A 73 9.859 -32.547 -0.572 1.00 25.00 H new ATOM 0 HB3 PRO A 73 11.462 -32.186 -1.182 1.00 25.00 H new ATOM 0 HG2 PRO A 73 10.034 -30.988 1.198 1.00 25.00 H new ATOM 0 HG3 PRO A 73 11.676 -31.590 1.099 1.00 25.00 H new ATOM 0 HD2 PRO A 73 11.098 -28.915 0.873 1.00 25.00 H new ATOM 0 HD3 PRO A 73 12.473 -29.633 0.058 1.00 25.00 H new ATOM 1160 N ALA A 74 8.088 -29.526 -0.574 1.00 25.00 N ATOM 1161 CA ALA A 74 6.687 -29.267 -0.250 1.00 25.00 C ATOM 1162 C ALA A 74 6.550 -27.812 0.236 1.00 25.00 C ATOM 1163 O ALA A 74 6.653 -26.876 -0.539 1.00 25.00 O ATOM 1164 CB ALA A 74 6.198 -30.270 0.835 1.00 25.00 C ATOM 0 H ALA A 74 8.739 -28.888 -0.116 1.00 25.00 H new ATOM 0 HA ALA A 74 6.065 -29.405 -1.135 1.00 25.00 H new ATOM 0 HB1 ALA A 74 5.153 -30.070 1.071 1.00 25.00 H new ATOM 0 HB2 ALA A 74 6.297 -31.289 0.460 1.00 25.00 H new ATOM 0 HB3 ALA A 74 6.801 -30.155 1.735 1.00 25.00 H new ATOM 1170 N GLY A 75 6.375 -27.628 1.537 1.00 25.00 N ATOM 1171 CA GLY A 75 6.270 -26.287 2.097 1.00 25.00 C ATOM 1172 C GLY A 75 6.668 -26.271 3.555 1.00 25.00 C ATOM 1173 O GLY A 75 7.537 -25.499 3.971 1.00 25.00 O ATOM 0 H GLY A 75 6.303 -28.382 2.220 1.00 25.00 H new ATOM 0 HA2 GLY A 75 6.908 -25.605 1.536 1.00 25.00 H new ATOM 0 HA3 GLY A 75 5.247 -25.925 1.993 1.00 25.00 H new ATOM 1177 N SER A 76 6.055 -27.162 4.318 1.00 25.00 N ATOM 1178 CA SER A 76 6.364 -27.350 5.730 1.00 25.00 C ATOM 1179 C SER A 76 7.457 -28.415 5.847 1.00 25.00 C ATOM 1180 O SER A 76 7.923 -28.942 4.834 1.00 25.00 O ATOM 1181 CB SER A 76 5.095 -27.818 6.443 1.00 25.00 C ATOM 1182 OG SER A 76 4.568 -28.954 5.781 1.00 25.00 O ATOM 0 H SER A 76 5.322 -27.782 3.973 1.00 25.00 H new ATOM 0 HA SER A 76 6.713 -26.422 6.183 1.00 25.00 H new ATOM 0 HB2 SER A 76 5.318 -28.061 7.482 1.00 25.00 H new ATOM 0 HB3 SER A 76 4.356 -27.017 6.455 1.00 25.00 H new ATOM 0 HG SER A 76 3.756 -29.253 6.241 1.00 25.00 H new ATOM 1188 N GLY A 77 7.869 -28.724 7.071 1.00 25.00 N ATOM 1189 CA GLY A 77 8.855 -29.774 7.308 1.00 25.00 C ATOM 1190 C GLY A 77 10.299 -29.336 7.141 1.00 25.00 C ATOM 1191 O GLY A 77 11.128 -29.570 8.016 1.00 25.00 O ATOM 0 H GLY A 77 7.535 -28.262 7.917 1.00 25.00 H new ATOM 0 HA2 GLY A 77 8.721 -30.159 8.319 1.00 25.00 H new ATOM 0 HA3 GLY A 77 8.658 -30.600 6.624 1.00 25.00 H new ATOM 1195 N GLY A 78 10.595 -28.668 6.036 1.00 25.00 N ATOM 1196 CA GLY A 78 11.951 -28.214 5.743 1.00 25.00 C ATOM 1197 C GLY A 78 12.416 -26.992 6.521 1.00 25.00 C ATOM 1198 O GLY A 78 13.063 -26.112 5.959 1.00 25.00 O ATOM 0 H GLY A 78 9.910 -28.426 5.321 1.00 25.00 H new ATOM 0 HA2 GLY A 78 12.641 -29.034 5.942 1.00 25.00 H new ATOM 0 HA3 GLY A 78 12.019 -27.992 4.678 1.00 25.00 H new ATOM 1202 N SER A 79 12.080 -26.924 7.800 1.00 25.00 N ATOM 1203 CA SER A 79 12.485 -25.807 8.654 1.00 25.00 C ATOM 1204 C SER A 79 13.751 -26.138 9.442 1.00 25.00 C ATOM 1205 O SER A 79 14.598 -25.274 9.662 1.00 25.00 O ATOM 1206 CB SER A 79 11.367 -25.478 9.643 1.00 25.00 C ATOM 1207 OG SER A 79 10.148 -25.235 8.959 1.00 25.00 O ATOM 0 H SER A 79 11.523 -27.633 8.277 1.00 25.00 H new ATOM 0 HA SER A 79 12.685 -24.953 8.007 1.00 25.00 H new ATOM 0 HB2 SER A 79 11.239 -26.304 10.343 1.00 25.00 H new ATOM 0 HB3 SER A 79 11.641 -24.602 10.231 1.00 25.00 H new ATOM 0 HG SER A 79 9.444 -25.028 9.609 1.00 25.00 H new ATOM 1213 N GLY A 80 13.853 -27.386 9.887 1.00 25.00 N ATOM 1214 CA GLY A 80 14.959 -27.798 10.739 1.00 25.00 C ATOM 1215 C GLY A 80 14.758 -27.308 12.165 1.00 25.00 C ATOM 1216 O GLY A 80 13.815 -26.570 12.438 1.00 25.00 O ATOM 0 H GLY A 80 13.185 -28.126 9.672 1.00 25.00 H new ATOM 0 HA2 GLY A 80 15.043 -28.885 10.732 1.00 25.00 H new ATOM 0 HA3 GLY A 80 15.895 -27.403 10.343 1.00 25.00 H new ATOM 1220 N SER A 81 15.631 -27.725 13.075 1.00 25.00 N ATOM 1221 CA SER A 81 15.530 -27.324 14.488 1.00 25.00 C ATOM 1222 C SER A 81 16.786 -26.620 14.991 1.00 25.00 C ATOM 1223 O SER A 81 16.859 -26.225 16.143 1.00 25.00 O ATOM 1224 CB SER A 81 15.268 -28.555 15.353 1.00 25.00 C ATOM 1225 OG SER A 81 14.149 -29.271 14.859 1.00 25.00 O ATOM 0 H SER A 81 16.418 -28.340 12.868 1.00 25.00 H new ATOM 0 HA SER A 81 14.704 -26.617 14.561 1.00 25.00 H new ATOM 0 HB2 SER A 81 16.148 -29.199 15.358 1.00 25.00 H new ATOM 0 HB3 SER A 81 15.089 -28.252 16.385 1.00 25.00 H new ATOM 0 HG SER A 81 13.991 -30.059 15.420 1.00 25.00 H new ATOM 1231 N GLY A 82 17.781 -26.487 14.125 1.00 25.00 N ATOM 1232 CA GLY A 82 19.033 -25.843 14.502 1.00 25.00 C ATOM 1233 C GLY A 82 20.135 -26.814 14.880 1.00 25.00 C ATOM 1234 O GLY A 82 21.298 -26.464 14.783 1.00 25.00 O ATOM 0 H GLY A 82 17.747 -26.815 13.160 1.00 25.00 H new ATOM 0 HA2 GLY A 82 19.376 -25.225 13.673 1.00 25.00 H new ATOM 0 HA3 GLY A 82 18.847 -25.174 15.343 1.00 25.00 H new ATOM 1238 N LEU A 83 19.751 -28.032 15.254 1.00 25.00 N ATOM 1239 CA LEU A 83 20.694 -29.089 15.666 1.00 25.00 C ATOM 1240 C LEU A 83 21.584 -28.574 16.806 1.00 25.00 C ATOM 1241 O LEU A 83 21.127 -27.792 17.642 1.00 25.00 O ATOM 1242 CB LEU A 83 21.537 -29.586 14.468 1.00 25.00 C ATOM 1243 CG LEU A 83 20.766 -30.100 13.239 1.00 25.00 C ATOM 1244 CD1 LEU A 83 21.749 -30.370 12.107 1.00 25.00 C ATOM 1245 CD2 LEU A 83 19.976 -31.378 13.557 1.00 25.00 C ATOM 0 H LEU A 83 18.774 -28.323 15.283 1.00 25.00 H new ATOM 0 HA LEU A 83 20.126 -29.945 16.030 1.00 25.00 H new ATOM 0 HB2 LEU A 83 22.183 -28.769 14.146 1.00 25.00 H new ATOM 0 HB3 LEU A 83 22.187 -30.387 14.820 1.00 25.00 H new ATOM 0 HG LEU A 83 20.050 -29.334 12.941 1.00 25.00 H new ATOM 0 HD11 LEU A 83 21.207 -30.734 11.234 1.00 25.00 H new ATOM 0 HD12 LEU A 83 22.271 -29.448 11.851 1.00 25.00 H new ATOM 0 HD13 LEU A 83 22.472 -31.121 12.425 1.00 25.00 H new ATOM 0 HD21 LEU A 83 19.445 -31.709 12.664 1.00 25.00 H new ATOM 0 HD22 LEU A 83 20.663 -32.159 13.882 1.00 25.00 H new ATOM 0 HD23 LEU A 83 19.258 -31.174 14.351 1.00 25.00 H new ATOM 1257 N THR A 84 22.823 -29.035 16.858 1.00 25.00 N ATOM 1258 CA THR A 84 23.783 -28.620 17.873 1.00 25.00 C ATOM 1259 C THR A 84 25.083 -28.356 17.140 1.00 25.00 C ATOM 1260 O THR A 84 25.226 -28.766 15.988 1.00 25.00 O ATOM 1261 CB THR A 84 24.033 -29.738 18.923 1.00 25.00 C ATOM 1262 OG1 THR A 84 24.454 -30.932 18.260 1.00 25.00 O ATOM 1263 CG2 THR A 84 22.768 -30.057 19.706 1.00 25.00 C ATOM 0 H THR A 84 23.196 -29.713 16.193 1.00 25.00 H new ATOM 0 HA THR A 84 23.404 -27.747 18.404 1.00 25.00 H new ATOM 0 HB THR A 84 24.800 -29.380 19.610 1.00 25.00 H new ATOM 0 HG1 THR A 84 25.432 -30.987 18.274 1.00 25.00 H new ATOM 0 HG21 THR A 84 22.978 -30.843 20.432 1.00 25.00 H new ATOM 0 HG22 THR A 84 22.428 -29.163 20.228 1.00 25.00 H new ATOM 0 HG23 THR A 84 21.991 -30.395 19.020 1.00 25.00 H new ATOM 1271 N ASP A 85 26.018 -27.697 17.821 1.00 25.00 N ATOM 1272 CA ASP A 85 27.403 -27.505 17.347 1.00 25.00 C ATOM 1273 C ASP A 85 27.545 -26.768 16.008 1.00 25.00 C ATOM 1274 O ASP A 85 28.602 -26.772 15.379 1.00 25.00 O ATOM 1275 CB ASP A 85 28.094 -28.869 17.286 1.00 25.00 C ATOM 1276 CG ASP A 85 27.890 -29.666 18.561 1.00 25.00 C ATOM 1277 OD1 ASP A 85 27.285 -30.761 18.496 1.00 25.00 O ATOM 1278 OD2 ASP A 85 28.216 -29.138 19.649 1.00 25.00 O ATOM 0 H ASP A 85 25.841 -27.272 18.731 1.00 25.00 H new ATOM 0 HA ASP A 85 27.884 -26.844 18.068 1.00 25.00 H new ATOM 0 HB2 ASP A 85 27.706 -29.435 16.439 1.00 25.00 H new ATOM 0 HB3 ASP A 85 29.161 -28.728 17.113 1.00 25.00 H new ATOM 1283 N GLU A 86 26.474 -26.116 15.590 1.00 25.00 N ATOM 1284 CA GLU A 86 26.457 -25.366 14.341 1.00 25.00 C ATOM 1285 C GLU A 86 27.075 -23.986 14.562 1.00 25.00 C ATOM 1286 O GLU A 86 26.401 -23.020 14.923 1.00 25.00 O ATOM 1287 CB GLU A 86 25.028 -25.242 13.811 1.00 25.00 C ATOM 1288 CG GLU A 86 24.965 -24.696 12.394 1.00 25.00 C ATOM 1289 CD GLU A 86 23.542 -24.458 11.936 1.00 25.00 C ATOM 1290 OE1 GLU A 86 22.855 -23.596 12.528 1.00 25.00 O ATOM 1291 OE2 GLU A 86 23.086 -25.131 10.979 1.00 25.00 O ATOM 0 H GLU A 86 25.593 -26.090 16.103 1.00 25.00 H new ATOM 0 HA GLU A 86 27.047 -25.900 13.596 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.550 -26.221 13.839 1.00 25.00 H new ATOM 0 HB3 GLU A 86 24.457 -24.590 14.471 1.00 25.00 H new ATOM 0 HG2 GLU A 86 25.523 -23.761 12.341 1.00 25.00 H new ATOM 0 HG3 GLU A 86 25.451 -25.396 11.715 1.00 25.00 H new ATOM 1298 N LEU A 87 28.384 -23.913 14.398 1.00 25.00 N ATOM 1299 CA LEU A 87 29.109 -22.669 14.613 1.00 25.00 C ATOM 1300 C LEU A 87 28.895 -21.727 13.433 1.00 25.00 C ATOM 1301 O LEU A 87 29.135 -22.076 12.277 1.00 25.00 O ATOM 1302 CB LEU A 87 30.599 -22.954 14.814 1.00 25.00 C ATOM 1303 CG LEU A 87 30.925 -23.792 16.066 1.00 25.00 C ATOM 1304 CD1 LEU A 87 32.399 -24.189 16.040 1.00 25.00 C ATOM 1305 CD2 LEU A 87 30.622 -23.023 17.361 1.00 25.00 C ATOM 0 H LEU A 87 28.969 -24.700 14.116 1.00 25.00 H new ATOM 0 HA LEU A 87 28.727 -22.187 15.513 1.00 25.00 H new ATOM 0 HB2 LEU A 87 30.979 -23.474 13.935 1.00 25.00 H new ATOM 0 HB3 LEU A 87 31.132 -22.006 14.878 1.00 25.00 H new ATOM 0 HG LEU A 87 30.294 -24.681 16.050 1.00 25.00 H new ATOM 0 HD11 LEU A 87 32.632 -24.782 16.925 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.602 -24.778 15.145 1.00 25.00 H new ATOM 0 HD13 LEU A 87 33.017 -23.291 16.032 1.00 25.00 H new ATOM 0 HD21 LEU A 87 30.865 -23.648 18.220 1.00 25.00 H new ATOM 0 HD22 LEU A 87 31.221 -22.113 17.393 1.00 25.00 H new ATOM 0 HD23 LEU A 87 29.564 -22.762 17.390 1.00 25.00 H new ATOM 1317 N ALA A 88 28.400 -20.538 13.741 1.00 25.00 N ATOM 1318 CA ALA A 88 28.065 -19.553 12.725 1.00 25.00 C ATOM 1319 C ALA A 88 29.319 -18.881 12.129 1.00 25.00 C ATOM 1320 O ALA A 88 30.320 -18.690 12.827 1.00 25.00 O ATOM 1321 CB ALA A 88 27.151 -18.504 13.348 1.00 25.00 C ATOM 0 H ALA A 88 28.220 -20.230 14.697 1.00 25.00 H new ATOM 0 HA ALA A 88 27.560 -20.061 11.904 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.890 -17.757 12.598 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.243 -18.984 13.714 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.665 -18.020 14.178 1.00 25.00 H new ATOM 1327 N PRO A 89 29.258 -18.467 10.848 1.00 25.00 N ATOM 1328 CA PRO A 89 30.421 -17.796 10.254 1.00 25.00 C ATOM 1329 C PRO A 89 30.617 -16.373 10.795 1.00 25.00 C ATOM 1330 O PRO A 89 29.710 -15.797 11.416 1.00 25.00 O ATOM 1331 CB PRO A 89 30.074 -17.789 8.764 1.00 25.00 C ATOM 1332 CG PRO A 89 28.607 -17.696 8.738 1.00 25.00 C ATOM 1333 CD PRO A 89 28.161 -18.584 9.869 1.00 25.00 C ATOM 0 HA PRO A 89 31.362 -18.297 10.483 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.536 -16.946 8.251 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.425 -18.694 8.269 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.270 -16.669 8.881 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.203 -18.034 7.783 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.211 -18.254 10.289 1.00 25.00 H new ATOM 0 HD3 PRO A 89 28.023 -19.614 9.541 1.00 25.00 H new ATOM 1341 N PRO A 90 31.810 -15.786 10.586 1.00 25.00 N ATOM 1342 CA PRO A 90 32.035 -14.454 11.161 1.00 25.00 C ATOM 1343 C PRO A 90 31.251 -13.336 10.478 1.00 25.00 C ATOM 1344 O PRO A 90 30.858 -13.439 9.312 1.00 25.00 O ATOM 1345 CB PRO A 90 33.542 -14.258 10.977 1.00 25.00 C ATOM 1346 CG PRO A 90 33.863 -15.032 9.760 1.00 25.00 C ATOM 1347 CD PRO A 90 33.005 -16.269 9.865 1.00 25.00 C ATOM 0 HA PRO A 90 31.693 -14.403 12.195 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.795 -13.205 10.857 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.099 -14.623 11.840 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.635 -14.466 8.857 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.922 -15.285 9.718 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.750 -16.667 8.883 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.511 -17.066 10.411 1.00 25.00 H new ATOM 1355 N LYS A 91 31.037 -12.259 11.217 1.00 25.00 N ATOM 1356 CA LYS A 91 30.375 -11.067 10.692 1.00 25.00 C ATOM 1357 C LYS A 91 31.455 -10.186 10.049 1.00 25.00 C ATOM 1358 O LYS A 91 32.618 -10.251 10.454 1.00 25.00 O ATOM 1359 CB LYS A 91 29.651 -10.314 11.829 1.00 25.00 C ATOM 1360 CG LYS A 91 30.531 -10.004 13.060 1.00 25.00 C ATOM 1361 CD LYS A 91 29.777 -9.223 14.152 1.00 25.00 C ATOM 1362 CE LYS A 91 28.636 -10.034 14.787 1.00 25.00 C ATOM 1363 NZ LYS A 91 28.026 -9.292 15.935 1.00 25.00 N ATOM 0 H LYS A 91 31.315 -12.183 12.195 1.00 25.00 H new ATOM 0 HA LYS A 91 29.622 -11.336 9.951 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.259 -9.377 11.434 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.795 -10.907 12.151 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.903 -10.939 13.480 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.401 -9.429 12.743 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.480 -8.924 14.929 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.370 -8.308 13.722 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.873 -10.243 14.038 1.00 25.00 H new ATOM 0 HE3 LYS A 91 29.016 -10.996 15.132 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.084 -9.683 16.140 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.632 -9.392 16.774 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.937 -8.285 15.690 1.00 25.00 H new ATOM 1377 N PRO A 92 31.093 -9.380 9.033 1.00 25.00 N ATOM 1378 CA PRO A 92 32.106 -8.479 8.469 1.00 25.00 C ATOM 1379 C PRO A 92 32.493 -7.391 9.486 1.00 25.00 C ATOM 1380 O PRO A 92 31.789 -7.189 10.478 1.00 25.00 O ATOM 1381 CB PRO A 92 31.409 -7.916 7.221 1.00 25.00 C ATOM 1382 CG PRO A 92 29.976 -8.005 7.512 1.00 25.00 C ATOM 1383 CD PRO A 92 29.783 -9.210 8.375 1.00 25.00 C ATOM 0 HA PRO A 92 33.050 -8.966 8.223 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.710 -6.885 7.033 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.667 -8.491 6.332 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.629 -7.106 8.021 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.400 -8.093 6.591 1.00 25.00 H new ATOM 0 HD2 PRO A 92 28.986 -9.058 9.103 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.514 -10.086 7.785 1.00 25.00 H new ATOM 1391 N PRO A 93 33.639 -6.710 9.281 1.00 25.00 N ATOM 1392 CA PRO A 93 34.071 -5.725 10.280 1.00 25.00 C ATOM 1393 C PRO A 93 33.256 -4.436 10.254 1.00 25.00 C ATOM 1394 O PRO A 93 32.431 -4.224 9.364 1.00 25.00 O ATOM 1395 CB PRO A 93 35.524 -5.459 9.879 1.00 25.00 C ATOM 1396 CG PRO A 93 35.520 -5.617 8.419 1.00 25.00 C ATOM 1397 CD PRO A 93 34.606 -6.791 8.169 1.00 25.00 C ATOM 0 HA PRO A 93 33.943 -6.094 11.298 1.00 25.00 H new ATOM 0 HB2 PRO A 93 35.843 -4.459 10.172 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.206 -6.163 10.356 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.155 -4.717 7.923 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.523 -5.807 8.037 1.00 25.00 H new ATOM 0 HD2 PRO A 93 34.112 -6.717 7.200 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.151 -7.735 8.178 1.00 25.00 H new ATOM 1405 N LEU A 94 33.503 -3.579 11.235 1.00 25.00 N ATOM 1406 CA LEU A 94 32.830 -2.290 11.348 1.00 25.00 C ATOM 1407 C LEU A 94 33.835 -1.175 11.648 1.00 25.00 C ATOM 1408 O LEU A 94 34.897 -1.436 12.218 1.00 25.00 O ATOM 1409 CB LEU A 94 31.793 -2.337 12.481 1.00 25.00 C ATOM 1410 CG LEU A 94 30.446 -2.980 12.137 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.548 -2.920 13.328 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.752 -2.266 10.992 1.00 25.00 C ATOM 0 H LEU A 94 34.178 -3.758 11.978 1.00 25.00 H new ATOM 0 HA LEU A 94 32.338 -2.083 10.398 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.227 -2.879 13.321 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.610 -1.318 12.820 1.00 25.00 H new ATOM 0 HG LEU A 94 30.645 -4.010 11.841 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.589 -3.377 13.084 1.00 25.00 H new ATOM 0 HD12 LEU A 94 30.007 -3.459 14.157 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.392 -1.880 13.614 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.801 -2.755 10.781 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.573 -1.227 11.267 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.383 -2.303 10.104 1.00 25.00 H new ATOM 1424 N PRO A 95 33.503 0.078 11.281 1.00 25.00 N ATOM 1425 CA PRO A 95 34.345 1.239 11.588 1.00 25.00 C ATOM 1426 C PRO A 95 34.198 1.700 13.037 1.00 25.00 C ATOM 1427 O PRO A 95 33.337 1.222 13.772 1.00 25.00 O ATOM 1428 CB PRO A 95 33.799 2.306 10.637 1.00 25.00 C ATOM 1429 CG PRO A 95 32.353 1.998 10.559 1.00 25.00 C ATOM 1430 CD PRO A 95 32.276 0.486 10.568 1.00 25.00 C ATOM 0 HA PRO A 95 35.407 1.024 11.466 1.00 25.00 H new ATOM 0 HB2 PRO A 95 33.974 3.311 11.020 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.274 2.250 9.657 1.00 25.00 H new ATOM 0 HG2 PRO A 95 31.812 2.426 11.403 1.00 25.00 H new ATOM 0 HG3 PRO A 95 31.909 2.411 9.653 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.380 0.134 11.079 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.247 0.080 9.557 1.00 25.00 H new ATOM 1438 N GLU A 96 35.007 2.675 13.421 1.00 25.00 N ATOM 1439 CA GLU A 96 34.988 3.243 14.776 1.00 25.00 C ATOM 1440 C GLU A 96 33.884 4.307 14.945 1.00 25.00 C ATOM 1441 O GLU A 96 34.078 5.326 15.601 1.00 25.00 O ATOM 1442 CB GLU A 96 36.359 3.860 15.083 1.00 25.00 C ATOM 1443 CG GLU A 96 37.504 2.851 15.030 1.00 25.00 C ATOM 1444 CD GLU A 96 38.853 3.491 15.323 1.00 25.00 C ATOM 1445 OE1 GLU A 96 39.496 3.109 16.325 1.00 25.00 O ATOM 1446 OE2 GLU A 96 39.284 4.357 14.530 1.00 25.00 O ATOM 0 H GLU A 96 35.700 3.101 12.806 1.00 25.00 H new ATOM 0 HA GLU A 96 34.770 2.437 15.476 1.00 25.00 H new ATOM 0 HB2 GLU A 96 36.557 4.660 14.370 1.00 25.00 H new ATOM 0 HB3 GLU A 96 36.331 4.315 16.073 1.00 25.00 H new ATOM 0 HG2 GLU A 96 37.318 2.055 15.751 1.00 25.00 H new ATOM 0 HG3 GLU A 96 37.531 2.387 14.044 1.00 25.00 H new ATOM 1453 N GLY A 97 32.730 4.068 14.339 1.00 25.00 N ATOM 1454 CA GLY A 97 31.632 5.020 14.409 1.00 25.00 C ATOM 1455 C GLY A 97 31.694 6.035 13.284 1.00 25.00 C ATOM 1456 O GLY A 97 32.115 5.708 12.174 1.00 25.00 O ATOM 0 H GLY A 97 32.531 3.228 13.796 1.00 25.00 H new ATOM 0 HA2 GLY A 97 30.684 4.485 14.364 1.00 25.00 H new ATOM 0 HA3 GLY A 97 31.660 5.538 15.368 1.00 25.00 H new ATOM 1460 N GLU A 98 31.257 7.258 13.557 1.00 25.00 N ATOM 1461 CA GLU A 98 31.264 8.330 12.558 1.00 25.00 C ATOM 1462 C GLU A 98 32.687 8.884 12.392 1.00 25.00 C ATOM 1463 O GLU A 98 33.100 9.836 13.051 1.00 25.00 O ATOM 1464 CB GLU A 98 30.290 9.445 12.968 1.00 25.00 C ATOM 1465 CG GLU A 98 30.054 10.492 11.874 1.00 25.00 C ATOM 1466 CD GLU A 98 29.099 11.599 12.318 1.00 25.00 C ATOM 1467 OE1 GLU A 98 27.954 11.283 12.711 1.00 25.00 O ATOM 1468 OE2 GLU A 98 29.485 12.788 12.246 1.00 25.00 O ATOM 0 H GLU A 98 30.890 7.538 14.467 1.00 25.00 H new ATOM 0 HA GLU A 98 30.936 7.926 11.600 1.00 25.00 H new ATOM 0 HB2 GLU A 98 29.335 8.998 13.242 1.00 25.00 H new ATOM 0 HB3 GLU A 98 30.676 9.943 13.858 1.00 25.00 H new ATOM 0 HG2 GLU A 98 31.008 10.934 11.587 1.00 25.00 H new ATOM 0 HG3 GLU A 98 29.650 10.002 10.988 1.00 25.00 H new ATOM 1475 N VAL A 99 33.457 8.245 11.507 1.00 25.00 N ATOM 1476 CA VAL A 99 34.844 8.625 11.220 1.00 25.00 C ATOM 1477 C VAL A 99 35.053 8.936 9.736 1.00 25.00 C ATOM 1478 O VAL A 99 34.529 8.352 8.810 1.00 25.00 O ATOM 1479 CB VAL A 99 35.853 7.550 11.739 1.00 25.00 C ATOM 1480 CG1 VAL A 99 35.815 7.480 13.286 1.00 25.00 C ATOM 1481 CG2 VAL A 99 35.568 6.141 11.152 1.00 25.00 C ATOM 1482 OXT VAL A 99 35.846 9.933 9.517 1.00 25.00 O ATOM 0 H VAL A 99 33.134 7.444 10.965 1.00 25.00 H new ATOM 0 HA VAL A 99 35.047 9.546 11.767 1.00 25.00 H new ATOM 0 HB VAL A 99 36.844 7.857 11.404 1.00 25.00 H new ATOM 0 HG11 VAL A 99 36.523 6.727 13.634 1.00 25.00 H new ATOM 0 HG12 VAL A 99 36.085 8.451 13.701 1.00 25.00 H new ATOM 0 HG13 VAL A 99 34.810 7.212 13.614 1.00 25.00 H new ATOM 0 HG21 VAL A 99 36.296 5.430 11.543 1.00 25.00 H new ATOM 0 HG22 VAL A 99 34.564 5.825 11.435 1.00 25.00 H new ATOM 0 HG23 VAL A 99 35.644 6.177 10.065 1.00 25.00 H new TER 1493 VAL A 99