USER MOD reduce.3.24.130724 H: found=0, std=0, add=520, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 520 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 Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= 0.127 X(o=0.13,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (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=-1.9) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0129 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl -131:sc= -0.37 (180deg=-1.27) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 69:sc= 1.22 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 CYS SG : rot 57:sc= -0.179 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc=-0.00473 X(o=-0.0047,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.0576 X(o=-0.058,f=-0.025) USER MOD Single : A 60 ASN : amide:sc= 0.766 K(o=0.77,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 159:sc= 1.13 (180deg=0.672) USER MOD ----------------------------------------------------------------- ATOM 59 N TYR A 5 13.019 1.771 0.071 1.00 25.00 N ATOM 60 CA TYR A 5 13.732 0.598 0.554 1.00 25.00 C ATOM 61 C TYR A 5 13.225 -0.653 -0.138 1.00 25.00 C ATOM 62 O TYR A 5 12.118 -0.668 -0.679 1.00 25.00 O ATOM 63 CB TYR A 5 13.558 0.483 2.063 1.00 25.00 C ATOM 64 CG TYR A 5 14.355 1.525 2.809 1.00 25.00 C ATOM 65 CD1 TYR A 5 15.765 1.511 2.764 1.00 25.00 C ATOM 66 CD2 TYR A 5 13.717 2.537 3.552 1.00 25.00 C ATOM 67 CE1 TYR A 5 16.526 2.479 3.458 1.00 25.00 C ATOM 68 CE2 TYR A 5 14.479 3.513 4.253 1.00 25.00 C ATOM 69 CZ TYR A 5 15.881 3.469 4.201 1.00 25.00 C ATOM 70 OH TYR A 5 16.617 4.405 4.885 1.00 25.00 O ATOM 0 HA TYR A 5 14.792 0.704 0.325 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.502 0.586 2.314 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.867 -0.510 2.388 1.00 25.00 H new ATOM 0 HD1 TYR A 5 16.271 0.749 2.190 1.00 25.00 H new ATOM 0 HD2 TYR A 5 12.638 2.573 3.590 1.00 25.00 H new ATOM 0 HE1 TYR A 5 17.605 2.453 3.413 1.00 25.00 H new ATOM 0 HE2 TYR A 5 13.981 4.284 4.822 1.00 25.00 H new ATOM 0 HH TYR A 5 16.012 5.021 5.349 1.00 25.00 H new ATOM 80 N LEU A 6 14.055 -1.685 -0.127 1.00 25.00 N ATOM 81 CA LEU A 6 13.772 -2.944 -0.816 1.00 25.00 C ATOM 82 C LEU A 6 12.559 -3.665 -0.224 1.00 25.00 C ATOM 83 O LEU A 6 11.742 -4.202 -0.960 1.00 25.00 O ATOM 84 CB LEU A 6 14.998 -3.872 -0.716 1.00 25.00 C ATOM 85 CG LEU A 6 16.356 -3.379 -1.244 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.439 -4.420 -0.906 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.333 -3.130 -2.745 1.00 25.00 C ATOM 0 H LEU A 6 14.950 -1.677 0.362 1.00 25.00 H new ATOM 0 HA LEU A 6 13.551 -2.704 -1.856 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.129 -4.131 0.335 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.756 -4.794 -1.244 1.00 25.00 H new ATOM 0 HG LEU A 6 16.578 -2.428 -0.760 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.404 -4.075 -1.278 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.493 -4.551 0.175 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.188 -5.371 -1.375 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.314 -2.783 -3.071 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.084 -4.056 -3.264 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.585 -2.372 -2.977 1.00 25.00 H new ATOM 99 N ASN A 7 12.471 -3.673 1.103 1.00 25.00 N ATOM 100 CA ASN A 7 11.374 -4.320 1.847 1.00 25.00 C ATOM 101 C ASN A 7 11.138 -5.782 1.441 1.00 25.00 C ATOM 102 O ASN A 7 10.020 -6.186 1.125 1.00 25.00 O ATOM 103 CB ASN A 7 10.081 -3.513 1.717 1.00 25.00 C ATOM 104 CG ASN A 7 10.157 -2.203 2.428 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.027 -2.134 3.637 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.390 -1.160 1.699 1.00 25.00 N ATOM 0 H ASN A 7 13.163 -3.228 1.706 1.00 25.00 H new ATOM 0 HA ASN A 7 11.686 -4.337 2.891 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.868 -3.340 0.662 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.251 -4.094 2.118 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.471 -0.241 2.134 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.493 -1.257 0.689 1.00 25.00 H new ATOM 113 N VAL A 8 12.196 -6.580 1.482 1.00 25.00 N ATOM 114 CA VAL A 8 12.114 -8.003 1.141 1.00 25.00 C ATOM 115 C VAL A 8 12.229 -8.775 2.451 1.00 25.00 C ATOM 116 O VAL A 8 12.715 -8.238 3.431 1.00 25.00 O ATOM 117 CB VAL A 8 13.241 -8.425 0.122 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.748 -7.216 -0.650 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.423 -9.088 0.809 1.00 25.00 C ATOM 0 H VAL A 8 13.130 -6.268 1.749 1.00 25.00 H new ATOM 0 HA VAL A 8 11.169 -8.223 0.644 1.00 25.00 H new ATOM 0 HB VAL A 8 12.785 -9.145 -0.558 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.525 -7.529 -1.347 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.924 -6.766 -1.203 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.159 -6.486 0.047 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.171 -9.360 0.064 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.861 -8.396 1.528 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.086 -9.985 1.328 1.00 25.00 H new ATOM 129 N LEU A 9 11.804 -10.027 2.481 1.00 25.00 N ATOM 130 CA LEU A 9 11.936 -10.831 3.696 1.00 25.00 C ATOM 131 C LEU A 9 13.211 -11.656 3.614 1.00 25.00 C ATOM 132 O LEU A 9 13.572 -12.140 2.544 1.00 25.00 O ATOM 133 CB LEU A 9 10.731 -11.761 3.864 1.00 25.00 C ATOM 134 CG LEU A 9 9.357 -11.082 4.005 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.279 -12.157 4.124 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.297 -10.153 5.222 1.00 25.00 C ATOM 0 H LEU A 9 11.370 -10.508 1.693 1.00 25.00 H new ATOM 0 HA LEU A 9 11.979 -10.164 4.557 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.694 -12.431 3.005 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.898 -12.381 4.745 1.00 25.00 H new ATOM 0 HG LEU A 9 9.189 -10.470 3.119 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.302 -11.683 4.224 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.289 -12.783 3.231 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.475 -12.773 5.001 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.309 -9.696 5.282 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.486 -10.728 6.128 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.052 -9.374 5.122 1.00 25.00 H new ATOM 148 N ALA A 10 13.881 -11.839 4.742 1.00 25.00 N ATOM 149 CA ALA A 10 15.081 -12.670 4.798 1.00 25.00 C ATOM 150 C ALA A 10 15.047 -13.538 6.053 1.00 25.00 C ATOM 151 O ALA A 10 14.593 -13.088 7.098 1.00 25.00 O ATOM 152 CB ALA A 10 16.319 -11.797 4.790 1.00 25.00 C ATOM 0 H ALA A 10 13.615 -11.423 5.635 1.00 25.00 H new ATOM 0 HA ALA A 10 15.111 -13.318 3.922 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.208 -12.426 4.832 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.339 -11.202 3.877 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.302 -11.134 5.655 1.00 25.00 H new ATOM 158 N LYS A 11 15.529 -14.771 5.938 1.00 25.00 N ATOM 159 CA LYS A 11 15.584 -15.702 7.066 1.00 25.00 C ATOM 160 C LYS A 11 16.999 -15.824 7.609 1.00 25.00 C ATOM 161 O LYS A 11 17.956 -15.944 6.842 1.00 25.00 O ATOM 162 CB LYS A 11 15.101 -17.096 6.642 1.00 25.00 C ATOM 163 CG LYS A 11 15.254 -18.159 7.745 1.00 25.00 C ATOM 164 CD LYS A 11 14.425 -19.414 7.517 1.00 25.00 C ATOM 165 CE LYS A 11 12.959 -19.169 7.861 1.00 25.00 C ATOM 166 NZ LYS A 11 12.186 -20.436 8.100 1.00 25.00 N ATOM 0 H LYS A 11 15.892 -15.155 5.065 1.00 25.00 H new ATOM 0 HA LYS A 11 14.932 -15.305 7.844 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.053 -17.035 6.349 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.660 -17.414 5.762 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.305 -18.439 7.821 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.971 -17.718 8.701 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.511 -19.727 6.477 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.815 -20.228 8.128 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.901 -18.543 8.751 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.490 -18.613 7.049 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.199 -20.202 8.329 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.213 -21.026 7.244 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.611 -20.958 8.893 1.00 25.00 H new ATOM 180 N ALA A 12 17.117 -15.859 8.925 1.00 25.00 N ATOM 181 CA ALA A 12 18.386 -16.089 9.596 1.00 25.00 C ATOM 182 C ALA A 12 18.792 -17.562 9.466 1.00 25.00 C ATOM 183 O ALA A 12 18.014 -18.445 9.815 1.00 25.00 O ATOM 184 CB ALA A 12 18.229 -15.706 11.056 1.00 25.00 C ATOM 0 H ALA A 12 16.331 -15.728 9.562 1.00 25.00 H new ATOM 0 HA ALA A 12 19.169 -15.484 9.139 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.171 -15.871 11.579 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.953 -14.654 11.129 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.450 -16.317 11.511 1.00 25.00 H new ATOM 190 N LEU A 13 20.004 -17.833 8.998 1.00 25.00 N ATOM 191 CA LEU A 13 20.509 -19.209 8.939 1.00 25.00 C ATOM 192 C LEU A 13 21.202 -19.541 10.238 1.00 25.00 C ATOM 193 O LEU A 13 21.431 -20.700 10.543 1.00 25.00 O ATOM 194 CB LEU A 13 21.549 -19.386 7.830 1.00 25.00 C ATOM 195 CG LEU A 13 21.197 -19.199 6.353 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.748 -19.573 6.015 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.493 -17.782 5.941 1.00 25.00 C ATOM 0 H LEU A 13 20.656 -17.127 8.655 1.00 25.00 H new ATOM 0 HA LEU A 13 19.654 -19.858 8.749 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.363 -18.695 8.049 1.00 25.00 H new ATOM 0 HB3 LEU A 13 21.950 -20.394 7.933 1.00 25.00 H new ATOM 0 HG LEU A 13 21.820 -19.891 5.786 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.570 -19.415 4.951 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.576 -20.621 6.260 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.067 -18.949 6.593 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.242 -17.649 4.889 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.899 -17.096 6.545 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.552 -17.573 6.091 1.00 25.00 H new ATOM 209 N TYR A 14 21.561 -18.503 10.975 1.00 25.00 N ATOM 210 CA TYR A 14 22.310 -18.635 12.211 1.00 25.00 C ATOM 211 C TYR A 14 21.825 -17.569 13.160 1.00 25.00 C ATOM 212 O TYR A 14 21.253 -16.573 12.728 1.00 25.00 O ATOM 213 CB TYR A 14 23.797 -18.407 11.961 1.00 25.00 C ATOM 214 CG TYR A 14 24.395 -19.329 10.931 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.490 -18.936 9.582 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.869 -20.604 11.291 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.031 -19.809 8.601 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.421 -21.471 10.316 1.00 25.00 C ATOM 219 CZ TYR A 14 25.487 -21.072 8.981 1.00 25.00 C ATOM 220 OH TYR A 14 26.008 -21.923 8.044 1.00 25.00 O ATOM 0 H TYR A 14 21.339 -17.538 10.729 1.00 25.00 H new ATOM 0 HA TYR A 14 22.165 -19.635 12.619 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.947 -17.376 11.641 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.336 -18.531 12.900 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.146 -17.955 9.289 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.811 -20.925 12.321 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.089 -19.498 7.568 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.791 -22.443 10.607 1.00 25.00 H new ATOM 0 HH TYR A 14 26.279 -22.760 8.477 1.00 25.00 H new ATOM 230 N ASP A 15 22.089 -17.753 14.438 1.00 25.00 N ATOM 231 CA ASP A 15 21.783 -16.753 15.441 1.00 25.00 C ATOM 232 C ASP A 15 22.713 -15.561 15.283 1.00 25.00 C ATOM 233 O ASP A 15 23.834 -15.694 14.776 1.00 25.00 O ATOM 234 CB ASP A 15 21.994 -17.365 16.818 1.00 25.00 C ATOM 235 CG ASP A 15 21.141 -18.580 17.032 1.00 25.00 C ATOM 236 OD1 ASP A 15 19.925 -18.415 17.215 1.00 25.00 O ATOM 237 OD2 ASP A 15 21.643 -19.707 16.925 1.00 25.00 O ATOM 0 H ASP A 15 22.521 -18.599 14.810 1.00 25.00 H new ATOM 0 HA ASP A 15 20.751 -16.422 15.324 1.00 25.00 H new ATOM 0 HB2 ASP A 15 23.044 -17.634 16.938 1.00 25.00 H new ATOM 0 HB3 ASP A 15 21.766 -16.623 17.583 1.00 25.00 H new ATOM 242 N ASN A 16 22.286 -14.413 15.777 1.00 25.00 N ATOM 243 CA ASN A 16 23.149 -13.244 15.815 1.00 25.00 C ATOM 244 C ASN A 16 22.982 -12.515 17.125 1.00 25.00 C ATOM 245 O ASN A 16 21.865 -12.303 17.594 1.00 25.00 O ATOM 246 CB ASN A 16 22.864 -12.282 14.663 1.00 25.00 C ATOM 247 CG ASN A 16 23.993 -11.308 14.461 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.133 -11.716 14.282 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.711 -10.043 14.546 1.00 25.00 N ATOM 0 H ASN A 16 21.351 -14.264 16.156 1.00 25.00 H new ATOM 0 HA ASN A 16 24.174 -13.599 15.713 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.704 -12.849 13.746 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.943 -11.735 14.865 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.453 -9.348 14.463 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.747 -9.744 14.696 1.00 25.00 H new ATOM 256 N VAL A 17 24.099 -12.105 17.695 1.00 25.00 N ATOM 257 CA VAL A 17 24.112 -11.339 18.922 1.00 25.00 C ATOM 258 C VAL A 17 24.585 -9.970 18.494 1.00 25.00 C ATOM 259 O VAL A 17 25.608 -9.843 17.821 1.00 25.00 O ATOM 260 CB VAL A 17 25.061 -11.960 19.980 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.100 -11.101 21.253 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.599 -13.388 20.327 1.00 25.00 C ATOM 0 H VAL A 17 25.027 -12.296 17.316 1.00 25.00 H new ATOM 0 HA VAL A 17 23.134 -11.314 19.402 1.00 25.00 H new ATOM 0 HB VAL A 17 26.066 -11.997 19.559 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.772 -11.557 21.980 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.457 -10.101 21.006 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.098 -11.034 21.678 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.271 -13.817 21.071 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.586 -13.355 20.729 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.613 -14.004 19.428 1.00 25.00 H new ATOM 272 N ALA A 18 23.798 -8.964 18.826 1.00 25.00 N ATOM 273 CA ALA A 18 24.115 -7.597 18.468 1.00 25.00 C ATOM 274 C ALA A 18 25.206 -7.097 19.406 1.00 25.00 C ATOM 275 O ALA A 18 24.995 -6.986 20.613 1.00 25.00 O ATOM 276 CB ALA A 18 22.876 -6.738 18.573 1.00 25.00 C ATOM 0 H ALA A 18 22.928 -9.071 19.347 1.00 25.00 H new ATOM 0 HA ALA A 18 24.471 -7.545 17.439 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.121 -5.711 18.302 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.111 -7.119 17.896 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.501 -6.764 19.596 1.00 25.00 H new ATOM 282 N GLU A 19 26.373 -6.847 18.848 1.00 25.00 N ATOM 283 CA GLU A 19 27.522 -6.381 19.618 1.00 25.00 C ATOM 284 C GLU A 19 27.692 -4.890 19.386 1.00 25.00 C ATOM 285 O GLU A 19 28.325 -4.183 20.164 1.00 25.00 O ATOM 286 CB GLU A 19 28.774 -7.134 19.174 1.00 25.00 C ATOM 287 CG GLU A 19 28.699 -8.624 19.500 1.00 25.00 C ATOM 288 CD GLU A 19 29.934 -9.388 19.045 1.00 25.00 C ATOM 289 OE1 GLU A 19 30.936 -9.417 19.781 1.00 25.00 O ATOM 290 OE2 GLU A 19 29.878 -9.994 17.946 1.00 25.00 O ATOM 0 H GLU A 19 26.558 -6.959 17.851 1.00 25.00 H new ATOM 0 HA GLU A 19 27.364 -6.566 20.680 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.911 -7.006 18.100 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.648 -6.701 19.661 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.574 -8.751 20.575 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.816 -9.052 19.024 1.00 25.00 H new ATOM 297 N SER A 20 27.083 -4.420 18.310 1.00 25.00 N ATOM 298 CA SER A 20 27.129 -3.013 17.941 1.00 25.00 C ATOM 299 C SER A 20 25.797 -2.374 18.304 1.00 25.00 C ATOM 300 O SER A 20 24.763 -3.047 18.300 1.00 25.00 O ATOM 301 CB SER A 20 27.379 -2.900 16.440 1.00 25.00 C ATOM 302 OG SER A 20 28.214 -3.963 16.007 1.00 25.00 O ATOM 0 H SER A 20 26.544 -5.001 17.668 1.00 25.00 H new ATOM 0 HA SER A 20 27.932 -2.502 18.472 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.432 -2.928 15.902 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.847 -1.942 16.212 1.00 25.00 H new ATOM 0 HG SER A 20 28.369 -3.885 15.042 1.00 25.00 H new ATOM 308 N PRO A 21 25.788 -1.062 18.591 1.00 25.00 N ATOM 309 CA PRO A 21 24.531 -0.401 18.970 1.00 25.00 C ATOM 310 C PRO A 21 23.539 -0.281 17.818 1.00 25.00 C ATOM 311 O PRO A 21 22.358 -0.012 18.030 1.00 25.00 O ATOM 312 CB PRO A 21 25.006 0.976 19.440 1.00 25.00 C ATOM 313 CG PRO A 21 26.256 1.212 18.666 1.00 25.00 C ATOM 314 CD PRO A 21 26.922 -0.115 18.605 1.00 25.00 C ATOM 0 HA PRO A 21 23.981 -0.965 19.724 1.00 25.00 H new ATOM 0 HB2 PRO A 21 24.261 1.745 19.238 1.00 25.00 H new ATOM 0 HB3 PRO A 21 25.194 0.988 20.514 1.00 25.00 H new ATOM 0 HG2 PRO A 21 26.037 1.591 17.668 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.891 1.951 19.155 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.541 -0.214 17.713 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.573 -0.279 19.464 1.00 25.00 H new ATOM 322 N ASP A 22 24.012 -0.510 16.604 1.00 25.00 N ATOM 323 CA ASP A 22 23.187 -0.416 15.409 1.00 25.00 C ATOM 324 C ASP A 22 22.882 -1.784 14.832 1.00 25.00 C ATOM 325 O ASP A 22 22.298 -1.883 13.775 1.00 25.00 O ATOM 326 CB ASP A 22 23.911 0.434 14.367 1.00 25.00 C ATOM 327 CG ASP A 22 23.836 1.906 14.686 1.00 25.00 C ATOM 328 OD1 ASP A 22 22.752 2.498 14.493 1.00 25.00 O ATOM 329 OD2 ASP A 22 24.831 2.453 15.199 1.00 25.00 O ATOM 0 H ASP A 22 24.981 -0.767 16.418 1.00 25.00 H new ATOM 0 HA ASP A 22 22.239 0.048 15.682 1.00 25.00 H new ATOM 0 HB2 ASP A 22 24.956 0.128 14.312 1.00 25.00 H new ATOM 0 HB3 ASP A 22 23.474 0.253 13.385 1.00 25.00 H new ATOM 334 N GLU A 23 23.290 -2.843 15.512 1.00 25.00 N ATOM 335 CA GLU A 23 23.109 -4.202 15.008 1.00 25.00 C ATOM 336 C GLU A 23 21.838 -4.845 15.578 1.00 25.00 C ATOM 337 O GLU A 23 21.396 -4.509 16.676 1.00 25.00 O ATOM 338 CB GLU A 23 24.349 -5.025 15.380 1.00 25.00 C ATOM 339 CG GLU A 23 24.444 -6.375 14.698 1.00 25.00 C ATOM 340 CD GLU A 23 25.716 -7.119 15.049 1.00 25.00 C ATOM 341 OE1 GLU A 23 26.458 -6.698 15.973 1.00 25.00 O ATOM 342 OE2 GLU A 23 25.958 -8.173 14.422 1.00 25.00 O ATOM 0 H GLU A 23 23.752 -2.791 16.420 1.00 25.00 H new ATOM 0 HA GLU A 23 22.992 -4.174 13.925 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.239 -4.446 15.134 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.356 -5.178 16.459 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.583 -6.982 14.980 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.395 -6.236 13.618 1.00 25.00 H new ATOM 349 N LEU A 24 21.258 -5.779 14.835 1.00 25.00 N ATOM 350 CA LEU A 24 20.093 -6.530 15.308 1.00 25.00 C ATOM 351 C LEU A 24 20.481 -7.891 15.861 1.00 25.00 C ATOM 352 O LEU A 24 21.332 -8.592 15.315 1.00 25.00 O ATOM 353 CB LEU A 24 19.085 -6.754 14.181 1.00 25.00 C ATOM 354 CG LEU A 24 18.302 -5.526 13.712 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.403 -5.925 12.553 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.471 -4.934 14.848 1.00 25.00 C ATOM 0 H LEU A 24 21.573 -6.038 13.900 1.00 25.00 H new ATOM 0 HA LEU A 24 19.648 -5.928 16.100 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.617 -7.167 13.324 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.371 -7.510 14.507 1.00 25.00 H new ATOM 0 HG LEU A 24 19.007 -4.761 13.387 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.841 -5.055 12.212 1.00 25.00 H new ATOM 0 HD12 LEU A 24 18.013 -6.306 11.734 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.710 -6.700 12.880 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.926 -4.063 14.484 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.763 -5.681 15.208 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.130 -4.635 15.663 1.00 25.00 H new ATOM 368 N SER A 25 19.799 -8.282 16.925 1.00 25.00 N ATOM 369 CA SER A 25 19.996 -9.576 17.552 1.00 25.00 C ATOM 370 C SER A 25 18.782 -10.421 17.233 1.00 25.00 C ATOM 371 O SER A 25 17.646 -9.977 17.391 1.00 25.00 O ATOM 372 CB SER A 25 20.139 -9.402 19.061 1.00 25.00 C ATOM 373 OG SER A 25 19.490 -8.212 19.481 1.00 25.00 O ATOM 0 H SER A 25 19.090 -7.707 17.379 1.00 25.00 H new ATOM 0 HA SER A 25 20.902 -10.056 17.181 1.00 25.00 H new ATOM 0 HB2 SER A 25 19.708 -10.261 19.576 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.194 -9.364 19.332 1.00 25.00 H new ATOM 0 HG SER A 25 19.587 -8.112 20.451 1.00 25.00 H new ATOM 379 N PHE A 26 19.029 -11.626 16.753 1.00 25.00 N ATOM 380 CA PHE A 26 17.959 -12.553 16.380 1.00 25.00 C ATOM 381 C PHE A 26 18.392 -14.006 16.473 1.00 25.00 C ATOM 382 O PHE A 26 19.576 -14.311 16.607 1.00 25.00 O ATOM 383 CB PHE A 26 17.466 -12.258 14.960 1.00 25.00 C ATOM 384 CG PHE A 26 18.553 -12.210 13.923 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.170 -13.386 13.454 1.00 25.00 C ATOM 386 CD2 PHE A 26 18.931 -10.979 13.369 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.147 -13.329 12.425 1.00 25.00 C ATOM 388 CE2 PHE A 26 19.885 -10.914 12.347 1.00 25.00 C ATOM 389 CZ PHE A 26 20.489 -12.098 11.860 1.00 25.00 C ATOM 0 H PHE A 26 19.969 -11.995 16.609 1.00 25.00 H new ATOM 0 HA PHE A 26 17.149 -12.400 17.093 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.741 -13.021 14.674 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.940 -11.303 14.962 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.898 -14.340 13.881 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.480 -10.069 13.736 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.624 -14.234 12.080 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.161 -9.957 11.929 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.210 -12.050 11.057 1.00 25.00 H new ATOM 399 N ARG A 27 17.418 -14.897 16.392 1.00 25.00 N ATOM 400 CA ARG A 27 17.636 -16.335 16.476 1.00 25.00 C ATOM 401 C ARG A 27 17.649 -16.930 15.073 1.00 25.00 C ATOM 402 O ARG A 27 16.991 -16.433 14.161 1.00 25.00 O ATOM 403 CB ARG A 27 16.476 -16.939 17.300 1.00 25.00 C ATOM 404 CG ARG A 27 16.564 -18.442 17.673 1.00 25.00 C ATOM 405 CD ARG A 27 17.286 -18.685 19.003 1.00 25.00 C ATOM 406 NE ARG A 27 17.215 -20.106 19.411 1.00 25.00 N ATOM 407 CZ ARG A 27 18.102 -21.053 19.102 1.00 25.00 C ATOM 408 NH1 ARG A 27 19.170 -20.824 18.396 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.901 -22.271 19.526 1.00 25.00 N ATOM 0 H ARG A 27 16.439 -14.640 16.264 1.00 25.00 H new ATOM 0 HA ARG A 27 18.591 -16.556 16.953 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.389 -16.368 18.225 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.552 -16.785 16.742 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.557 -18.856 17.731 1.00 25.00 H new ATOM 0 HG3 ARG A 27 17.084 -18.978 16.880 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.330 -18.384 18.911 1.00 25.00 H new ATOM 0 HD3 ARG A 27 16.841 -18.061 19.778 1.00 25.00 H new ATOM 0 HE ARG A 27 16.416 -20.386 19.980 1.00 25.00 H new ATOM 0 HH11 ARG A 27 19.361 -19.884 18.050 1.00 25.00 H new ATOM 0 HH12 ARG A 27 19.817 -21.585 18.188 1.00 25.00 H new ATOM 0 HH21 ARG A 27 17.075 -22.487 20.085 1.00 25.00 H new ATOM 0 HH22 ARG A 27 18.570 -23.007 19.299 1.00 25.00 H new ATOM 423 N LYS A 28 18.356 -18.033 14.922 1.00 25.00 N ATOM 424 CA LYS A 28 18.343 -18.820 13.695 1.00 25.00 C ATOM 425 C LYS A 28 16.899 -19.189 13.372 1.00 25.00 C ATOM 426 O LYS A 28 16.178 -19.709 14.216 1.00 25.00 O ATOM 427 CB LYS A 28 19.189 -20.074 13.935 1.00 25.00 C ATOM 428 CG LYS A 28 19.155 -21.121 12.841 1.00 25.00 C ATOM 429 CD LYS A 28 20.207 -22.191 13.155 1.00 25.00 C ATOM 430 CE LYS A 28 20.066 -23.446 12.304 1.00 25.00 C ATOM 431 NZ LYS A 28 21.072 -24.491 12.733 1.00 25.00 N ATOM 0 H LYS A 28 18.961 -18.414 15.649 1.00 25.00 H new ATOM 0 HA LYS A 28 18.755 -18.263 12.854 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.224 -19.766 14.083 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.858 -20.538 14.864 1.00 25.00 H new ATOM 0 HG2 LYS A 28 18.164 -21.571 12.779 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.358 -20.663 11.873 1.00 25.00 H new ATOM 0 HD2 LYS A 28 21.200 -21.768 13.004 1.00 25.00 H new ATOM 0 HD3 LYS A 28 20.133 -22.465 14.208 1.00 25.00 H new ATOM 0 HE2 LYS A 28 19.056 -23.845 12.398 1.00 25.00 H new ATOM 0 HE3 LYS A 28 20.215 -23.199 11.253 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.963 -25.341 12.143 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 22.034 -24.113 12.621 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 20.911 -24.739 13.730 1.00 25.00 H new ATOM 445 N GLY A 29 16.487 -18.897 12.145 1.00 25.00 N ATOM 446 CA GLY A 29 15.127 -19.164 11.705 1.00 25.00 C ATOM 447 C GLY A 29 14.221 -17.946 11.685 1.00 25.00 C ATOM 448 O GLY A 29 13.151 -18.003 11.072 1.00 25.00 O ATOM 0 H GLY A 29 17.082 -18.472 11.433 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.160 -19.593 10.703 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.688 -19.917 12.360 1.00 25.00 H new ATOM 452 N ASP A 30 14.635 -16.851 12.314 1.00 25.00 N ATOM 453 CA ASP A 30 13.814 -15.638 12.386 1.00 25.00 C ATOM 454 C ASP A 30 13.713 -14.977 11.024 1.00 25.00 C ATOM 455 O ASP A 30 14.554 -15.205 10.148 1.00 25.00 O ATOM 456 CB ASP A 30 14.416 -14.623 13.369 1.00 25.00 C ATOM 457 CG ASP A 30 14.147 -14.978 14.828 1.00 25.00 C ATOM 458 OD1 ASP A 30 13.318 -15.877 15.086 1.00 25.00 O ATOM 459 OD2 ASP A 30 14.746 -14.332 15.715 1.00 25.00 O ATOM 0 H ASP A 30 15.537 -16.774 12.784 1.00 25.00 H new ATOM 0 HA ASP A 30 12.824 -15.939 12.729 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.492 -14.563 13.207 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.006 -13.635 13.159 1.00 25.00 H new ATOM 464 N ILE A 31 12.691 -14.144 10.862 1.00 25.00 N ATOM 465 CA ILE A 31 12.462 -13.410 9.618 1.00 25.00 C ATOM 466 C ILE A 31 12.536 -11.921 9.898 1.00 25.00 C ATOM 467 O ILE A 31 11.857 -11.423 10.789 1.00 25.00 O ATOM 468 CB ILE A 31 11.055 -13.705 9.009 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.880 -15.209 8.726 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.842 -12.889 7.699 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.927 -15.827 7.809 1.00 25.00 C ATOM 0 H ILE A 31 11.998 -13.957 11.587 1.00 25.00 H new ATOM 0 HA ILE A 31 13.226 -13.729 8.909 1.00 25.00 H new ATOM 0 HB ILE A 31 10.305 -13.401 9.740 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.892 -15.744 9.676 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.896 -15.366 8.284 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.856 -13.108 7.290 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.915 -11.824 7.918 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.606 -13.163 6.971 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.713 -16.887 7.675 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.904 -15.327 6.841 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.915 -15.710 8.254 1.00 25.00 H new ATOM 483 N MET A 32 13.320 -11.211 9.103 1.00 25.00 N ATOM 484 CA MET A 32 13.417 -9.759 9.198 1.00 25.00 C ATOM 485 C MET A 32 13.182 -9.151 7.830 1.00 25.00 C ATOM 486 O MET A 32 13.347 -9.813 6.802 1.00 25.00 O ATOM 487 CB MET A 32 14.784 -9.340 9.737 1.00 25.00 C ATOM 488 CG MET A 32 15.964 -9.905 8.977 1.00 25.00 C ATOM 489 SD MET A 32 17.242 -10.368 10.135 1.00 25.00 S ATOM 490 CE MET A 32 16.534 -11.923 10.839 1.00 25.00 C ATOM 0 H MET A 32 13.906 -11.621 8.376 1.00 25.00 H new ATOM 0 HA MET A 32 12.658 -9.398 9.892 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.847 -8.252 9.722 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.859 -9.650 10.779 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.654 -10.772 8.393 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.346 -9.166 8.272 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.583 -11.885 11.927 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.495 -12.024 10.526 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.106 -12.778 10.480 1.00 25.00 H new ATOM 500 N THR A 33 12.786 -7.892 7.833 1.00 25.00 N ATOM 501 CA THR A 33 12.523 -7.160 6.596 1.00 25.00 C ATOM 502 C THR A 33 13.786 -6.430 6.174 1.00 25.00 C ATOM 503 O THR A 33 14.216 -5.523 6.862 1.00 25.00 O ATOM 504 CB THR A 33 11.407 -6.117 6.801 1.00 25.00 C ATOM 505 OG1 THR A 33 10.201 -6.785 7.183 1.00 25.00 O ATOM 506 CG2 THR A 33 11.142 -5.334 5.534 1.00 25.00 C ATOM 0 H THR A 33 12.637 -7.347 8.682 1.00 25.00 H new ATOM 0 HA THR A 33 12.210 -7.873 5.833 1.00 25.00 H new ATOM 0 HB THR A 33 11.732 -5.425 7.578 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.489 -6.125 7.316 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.350 -4.608 5.714 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.050 -4.813 5.232 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.835 -6.017 4.742 1.00 25.00 H new ATOM 514 N VAL A 34 14.382 -6.821 5.061 1.00 25.00 N ATOM 515 CA VAL A 34 15.592 -6.173 4.557 1.00 25.00 C ATOM 516 C VAL A 34 15.202 -4.898 3.848 1.00 25.00 C ATOM 517 O VAL A 34 14.403 -4.912 2.912 1.00 25.00 O ATOM 518 CB VAL A 34 16.361 -7.068 3.576 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.680 -6.418 3.141 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.619 -8.416 4.214 1.00 25.00 C ATOM 0 H VAL A 34 14.048 -7.591 4.481 1.00 25.00 H new ATOM 0 HA VAL A 34 16.243 -5.970 5.408 1.00 25.00 H new ATOM 0 HB VAL A 34 15.752 -7.202 2.682 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.199 -7.078 2.447 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.473 -5.467 2.651 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.307 -6.246 4.016 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.165 -9.050 3.516 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.209 -8.282 5.121 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.669 -8.887 4.465 1.00 25.00 H new ATOM 530 N LEU A 35 15.757 -3.798 4.314 1.00 25.00 N ATOM 531 CA LEU A 35 15.464 -2.488 3.773 1.00 25.00 C ATOM 532 C LEU A 35 16.503 -2.120 2.733 1.00 25.00 C ATOM 533 O LEU A 35 16.157 -1.667 1.658 1.00 25.00 O ATOM 534 CB LEU A 35 15.456 -1.472 4.906 1.00 25.00 C ATOM 535 CG LEU A 35 14.426 -1.770 6.003 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.672 -0.833 7.139 1.00 25.00 C ATOM 537 CD2 LEU A 35 12.993 -1.626 5.505 1.00 25.00 C ATOM 0 H LEU A 35 16.427 -3.788 5.083 1.00 25.00 H new ATOM 0 HA LEU A 35 14.485 -2.494 3.294 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.449 -1.435 5.354 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.256 -0.483 4.493 1.00 25.00 H new ATOM 0 HG LEU A 35 14.544 -2.806 6.321 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.950 -1.026 7.933 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.681 -0.983 7.522 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.564 0.195 6.793 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.301 -1.847 6.318 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.830 -0.606 5.157 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.822 -2.322 4.683 1.00 25.00 H new ATOM 549 N GLU A 36 17.767 -2.376 3.022 1.00 25.00 N ATOM 550 CA GLU A 36 18.819 -2.182 2.020 1.00 25.00 C ATOM 551 C GLU A 36 19.993 -3.096 2.331 1.00 25.00 C ATOM 552 O GLU A 36 20.004 -3.761 3.362 1.00 25.00 O ATOM 553 CB GLU A 36 19.261 -0.710 1.931 1.00 25.00 C ATOM 554 CG GLU A 36 20.161 -0.226 2.995 1.00 25.00 C ATOM 555 CD GLU A 36 20.445 1.264 2.881 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.651 1.899 3.933 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.464 1.794 1.754 1.00 25.00 O ATOM 0 H GLU A 36 18.094 -2.714 3.927 1.00 25.00 H new ATOM 0 HA GLU A 36 18.416 -2.444 1.042 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.756 -0.560 0.972 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.368 -0.085 1.930 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.715 -0.435 3.967 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.101 -0.777 2.951 1.00 25.00 H new ATOM 564 N ARG A 37 20.970 -3.144 1.442 1.00 25.00 N ATOM 565 CA ARG A 37 22.161 -3.962 1.636 1.00 25.00 C ATOM 566 C ARG A 37 23.333 -3.039 1.453 1.00 25.00 C ATOM 567 O ARG A 37 23.205 -2.059 0.730 1.00 25.00 O ATOM 568 CB ARG A 37 22.232 -5.065 0.591 1.00 25.00 C ATOM 569 CG ARG A 37 21.025 -5.993 0.588 1.00 25.00 C ATOM 570 CD ARG A 37 21.274 -7.169 -0.340 1.00 25.00 C ATOM 571 NE ARG A 37 21.635 -6.708 -1.692 1.00 25.00 N ATOM 572 CZ ARG A 37 22.043 -7.483 -2.689 1.00 25.00 C ATOM 573 NH1 ARG A 37 22.140 -8.786 -2.569 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.364 -6.935 -3.828 1.00 25.00 N ATOM 0 H ARG A 37 20.963 -2.620 0.567 1.00 25.00 H new ATOM 0 HA ARG A 37 22.151 -4.432 2.619 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.331 -4.611 -0.395 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.132 -5.656 0.762 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.830 -6.352 1.599 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.138 -5.447 0.267 1.00 25.00 H new ATOM 0 HD2 ARG A 37 22.074 -7.791 0.062 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.381 -7.792 -0.391 1.00 25.00 H new ATOM 0 HE ARG A 37 21.565 -5.707 -1.878 1.00 25.00 H new ATOM 0 HH11 ARG A 37 21.898 -9.236 -1.686 1.00 25.00 H new ATOM 0 HH12 ARG A 37 22.458 -9.349 -3.358 1.00 25.00 H new ATOM 0 HH21 ARG A 37 22.300 -5.924 -3.943 1.00 25.00 H new ATOM 0 HH22 ARG A 37 22.679 -7.518 -4.603 1.00 25.00 H new ATOM 588 N ASP A 38 24.444 -3.354 2.108 1.00 25.00 N ATOM 589 CA ASP A 38 25.684 -2.580 2.023 1.00 25.00 C ATOM 590 C ASP A 38 25.393 -1.150 2.497 1.00 25.00 C ATOM 591 O ASP A 38 25.882 -0.148 1.972 1.00 25.00 O ATOM 592 CB ASP A 38 26.268 -2.692 0.612 1.00 25.00 C ATOM 593 CG ASP A 38 26.358 -4.152 0.149 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.768 -4.486 -0.909 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.906 -4.992 0.910 1.00 25.00 O ATOM 0 H ASP A 38 24.513 -4.165 2.723 1.00 25.00 H new ATOM 0 HA ASP A 38 26.460 -2.971 2.680 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.648 -2.127 -0.084 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.261 -2.242 0.592 1.00 25.00 H new ATOM 600 N THR A 39 24.526 -1.108 3.499 1.00 25.00 N ATOM 601 CA THR A 39 24.011 0.130 4.076 1.00 25.00 C ATOM 602 C THR A 39 25.116 0.922 4.740 1.00 25.00 C ATOM 603 O THR A 39 26.026 0.352 5.309 1.00 25.00 O ATOM 604 CB THR A 39 22.913 -0.183 5.120 1.00 25.00 C ATOM 605 OG1 THR A 39 22.436 1.022 5.720 1.00 25.00 O ATOM 606 CG2 THR A 39 23.389 -1.098 6.194 1.00 25.00 C ATOM 0 H THR A 39 24.153 -1.947 3.943 1.00 25.00 H new ATOM 0 HA THR A 39 23.590 0.725 3.265 1.00 25.00 H new ATOM 0 HB THR A 39 22.108 -0.682 4.580 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.929 1.538 5.059 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.579 -1.284 6.899 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.710 -2.042 5.752 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.228 -0.639 6.718 1.00 25.00 H new ATOM 614 N GLN A 40 25.037 2.243 4.631 1.00 25.00 N ATOM 615 CA GLN A 40 26.042 3.176 5.175 1.00 25.00 C ATOM 616 C GLN A 40 27.442 2.947 4.590 1.00 25.00 C ATOM 617 O GLN A 40 28.427 3.482 5.088 1.00 25.00 O ATOM 618 CB GLN A 40 26.094 3.116 6.711 1.00 25.00 C ATOM 619 CG GLN A 40 24.731 3.008 7.374 1.00 25.00 C ATOM 620 CD GLN A 40 24.796 3.256 8.865 1.00 25.00 C ATOM 621 OE1 GLN A 40 25.170 4.328 9.311 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.422 2.271 9.642 1.00 25.00 N ATOM 0 H GLN A 40 24.265 2.712 4.157 1.00 25.00 H new ATOM 0 HA GLN A 40 25.720 4.173 4.873 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.700 2.261 7.010 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.597 4.009 7.082 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.050 3.726 6.918 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.318 2.016 7.191 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.115 1.388 9.234 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.438 2.387 10.655 1.00 25.00 H new ATOM 631 N GLY A 41 27.520 2.142 3.535 1.00 25.00 N ATOM 632 CA GLY A 41 28.797 1.794 2.936 1.00 25.00 C ATOM 633 C GLY A 41 29.446 0.627 3.656 1.00 25.00 C ATOM 634 O GLY A 41 30.606 0.306 3.411 1.00 25.00 O ATOM 0 H GLY A 41 26.711 1.720 3.079 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.651 1.540 1.886 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.462 2.657 2.966 1.00 25.00 H new ATOM 638 N LEU A 42 28.703 -0.002 4.556 1.00 25.00 N ATOM 639 CA LEU A 42 29.195 -1.129 5.327 1.00 25.00 C ATOM 640 C LEU A 42 28.929 -2.370 4.516 1.00 25.00 C ATOM 641 O LEU A 42 27.816 -2.892 4.493 1.00 25.00 O ATOM 642 CB LEU A 42 28.446 -1.217 6.659 1.00 25.00 C ATOM 643 CG LEU A 42 28.474 0.025 7.544 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.399 -0.101 8.615 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.814 0.188 8.187 1.00 25.00 C ATOM 0 H LEU A 42 27.740 0.258 4.771 1.00 25.00 H new ATOM 0 HA LEU A 42 30.259 -1.018 5.538 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.405 -1.461 6.448 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.860 -2.050 7.228 1.00 25.00 H new ATOM 0 HG LEU A 42 28.282 0.903 6.927 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.414 0.784 9.251 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.422 -0.191 8.141 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.591 -0.987 9.221 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.811 1.080 8.813 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.032 -0.686 8.801 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.578 0.289 7.416 1.00 25.00 H new ATOM 657 N ASP A 43 29.930 -2.806 3.788 1.00 25.00 N ATOM 658 CA ASP A 43 29.746 -3.928 2.893 1.00 25.00 C ATOM 659 C ASP A 43 29.473 -5.204 3.670 1.00 25.00 C ATOM 660 O ASP A 43 30.004 -5.434 4.758 1.00 25.00 O ATOM 661 CB ASP A 43 30.950 -4.091 1.983 1.00 25.00 C ATOM 662 CG ASP A 43 32.151 -4.700 2.689 1.00 25.00 C ATOM 663 OD1 ASP A 43 32.827 -3.977 3.449 1.00 25.00 O ATOM 664 OD2 ASP A 43 32.459 -5.883 2.418 1.00 25.00 O ATOM 0 H ASP A 43 30.869 -2.408 3.795 1.00 25.00 H new ATOM 0 HA ASP A 43 28.875 -3.726 2.269 1.00 25.00 H new ATOM 0 HB2 ASP A 43 30.676 -4.720 1.136 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.228 -3.117 1.580 1.00 25.00 H new ATOM 669 N GLY A 44 28.553 -6.000 3.152 1.00 25.00 N ATOM 670 CA GLY A 44 28.157 -7.219 3.830 1.00 25.00 C ATOM 671 C GLY A 44 27.147 -6.985 4.939 1.00 25.00 C ATOM 672 O GLY A 44 26.484 -7.937 5.367 1.00 25.00 O ATOM 0 H GLY A 44 28.070 -5.825 2.271 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.734 -7.911 3.102 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.042 -7.698 4.248 1.00 25.00 H new ATOM 676 N TRP A 45 26.984 -5.751 5.399 1.00 25.00 N ATOM 677 CA TRP A 45 25.992 -5.437 6.405 1.00 25.00 C ATOM 678 C TRP A 45 24.698 -5.045 5.708 1.00 25.00 C ATOM 679 O TRP A 45 24.694 -4.230 4.793 1.00 25.00 O ATOM 680 CB TRP A 45 26.509 -4.287 7.252 1.00 25.00 C ATOM 681 CG TRP A 45 27.578 -4.724 8.203 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.915 -4.512 8.107 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.396 -5.459 9.422 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.585 -5.030 9.175 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.682 -5.632 10.011 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.273 -5.979 10.087 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.862 -6.309 11.235 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.446 -6.643 11.315 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.737 -6.806 11.875 1.00 25.00 C ATOM 0 H TRP A 45 27.533 -4.950 5.085 1.00 25.00 H new ATOM 0 HA TRP A 45 25.803 -6.297 7.047 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.901 -3.506 6.601 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.682 -3.850 7.812 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.390 -3.996 7.285 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.592 -4.978 9.327 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.287 -5.870 9.660 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.846 -6.436 11.661 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.585 -7.033 11.837 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.847 -7.326 12.815 1.00 25.00 H new ATOM 700 N TRP A 46 23.593 -5.646 6.115 1.00 25.00 N ATOM 701 CA TRP A 46 22.303 -5.386 5.481 1.00 25.00 C ATOM 702 C TRP A 46 21.376 -4.728 6.488 1.00 25.00 C ATOM 703 O TRP A 46 21.216 -5.222 7.597 1.00 25.00 O ATOM 704 CB TRP A 46 21.687 -6.697 4.965 1.00 25.00 C ATOM 705 CG TRP A 46 22.511 -7.384 3.878 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.649 -6.928 3.281 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.259 -8.668 3.271 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.121 -7.805 2.355 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.302 -8.899 2.323 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.262 -9.651 3.430 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.363 -10.072 1.540 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.334 -10.838 2.661 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.379 -11.029 1.718 1.00 25.00 C ATOM 0 H TRP A 46 23.559 -6.318 6.881 1.00 25.00 H new ATOM 0 HA TRP A 46 22.446 -4.719 4.631 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.565 -7.384 5.803 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.691 -6.490 4.575 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.119 -5.984 3.515 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.951 -7.669 1.778 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.453 -9.501 4.130 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.156 -10.219 0.822 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.586 -11.606 2.793 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.406 -11.935 1.131 1.00 25.00 H new ATOM 724 N LEU A 47 20.775 -3.612 6.110 1.00 25.00 N ATOM 725 CA LEU A 47 19.848 -2.906 6.985 1.00 25.00 C ATOM 726 C LEU A 47 18.559 -3.679 6.984 1.00 25.00 C ATOM 727 O LEU A 47 17.957 -3.867 5.936 1.00 25.00 O ATOM 728 CB LEU A 47 19.576 -1.500 6.460 1.00 25.00 C ATOM 729 CG LEU A 47 18.593 -0.643 7.267 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.064 -0.433 8.694 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.393 0.703 6.575 1.00 25.00 C ATOM 0 H LEU A 47 20.912 -3.172 5.200 1.00 25.00 H new ATOM 0 HA LEU A 47 20.271 -2.824 7.986 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.526 -0.968 6.404 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.198 -1.584 5.441 1.00 25.00 H new ATOM 0 HG LEU A 47 17.644 -1.177 7.312 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.339 0.179 9.230 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.162 -1.398 9.191 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.030 0.071 8.688 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.694 1.308 7.152 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.349 1.221 6.504 1.00 25.00 H new ATOM 0 HD23 LEU A 47 17.993 0.542 5.574 1.00 25.00 H new ATOM 743 N CYS A 48 18.126 -4.120 8.149 1.00 25.00 N ATOM 744 CA CYS A 48 16.883 -4.851 8.266 1.00 25.00 C ATOM 745 C CYS A 48 16.071 -4.332 9.427 1.00 25.00 C ATOM 746 O CYS A 48 16.553 -3.546 10.238 1.00 25.00 O ATOM 747 CB CYS A 48 17.161 -6.351 8.440 1.00 25.00 C ATOM 748 SG CYS A 48 18.383 -7.015 7.278 1.00 25.00 S ATOM 0 H CYS A 48 18.620 -3.983 9.031 1.00 25.00 H new ATOM 0 HA CYS A 48 16.310 -4.705 7.350 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.508 -6.530 9.458 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.226 -6.899 8.321 1.00 25.00 H new ATOM 0 HG CYS A 48 19.496 -6.353 7.393 1.00 25.00 H new ATOM 754 N SER A 49 14.831 -4.775 9.490 1.00 25.00 N ATOM 755 CA SER A 49 13.922 -4.403 10.552 1.00 25.00 C ATOM 756 C SER A 49 13.353 -5.682 11.159 1.00 25.00 C ATOM 757 O SER A 49 12.927 -6.599 10.444 1.00 25.00 O ATOM 758 CB SER A 49 12.839 -3.481 9.994 1.00 25.00 C ATOM 759 OG SER A 49 11.593 -4.138 9.850 1.00 25.00 O ATOM 0 H SER A 49 14.425 -5.407 8.800 1.00 25.00 H new ATOM 0 HA SER A 49 14.432 -3.850 11.341 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.720 -2.623 10.655 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.157 -3.095 9.026 1.00 25.00 H new ATOM 0 HG SER A 49 10.931 -3.510 9.492 1.00 25.00 H new ATOM 765 N LEU A 50 13.436 -5.772 12.478 1.00 25.00 N ATOM 766 CA LEU A 50 13.019 -6.952 13.226 1.00 25.00 C ATOM 767 C LEU A 50 12.512 -6.477 14.575 1.00 25.00 C ATOM 768 O LEU A 50 13.130 -5.617 15.185 1.00 25.00 O ATOM 769 CB LEU A 50 14.223 -7.869 13.441 1.00 25.00 C ATOM 770 CG LEU A 50 13.949 -9.169 14.204 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.951 -10.349 13.282 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.993 -9.334 15.288 1.00 25.00 C ATOM 0 H LEU A 50 13.798 -5.021 13.066 1.00 25.00 H new ATOM 0 HA LEU A 50 12.246 -7.498 12.686 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.639 -8.124 12.466 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.989 -7.310 13.978 1.00 25.00 H new ATOM 0 HG LEU A 50 12.959 -9.114 14.657 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.754 -11.257 13.852 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.177 -10.221 12.525 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.924 -10.430 12.796 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.805 -10.257 15.836 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.984 -9.376 14.836 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.942 -8.488 15.974 1.00 25.00 H new ATOM 784 N HIS A 51 11.371 -7.002 15.013 1.00 25.00 N ATOM 785 CA HIS A 51 10.758 -6.642 16.307 1.00 25.00 C ATOM 786 C HIS A 51 10.515 -5.127 16.430 1.00 25.00 C ATOM 787 O HIS A 51 10.545 -4.570 17.520 1.00 25.00 O ATOM 788 CB HIS A 51 11.635 -7.117 17.484 1.00 25.00 C ATOM 789 CG HIS A 51 11.907 -8.591 17.488 1.00 25.00 C ATOM 790 ND1 HIS A 51 12.954 -9.184 18.152 1.00 25.00 N ATOM 791 CD2 HIS A 51 11.236 -9.623 16.901 1.00 25.00 C ATOM 792 CE1 HIS A 51 12.887 -10.497 17.949 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.857 -10.818 17.194 1.00 25.00 N ATOM 0 H HIS A 51 10.837 -7.692 14.485 1.00 25.00 H new ATOM 0 HA HIS A 51 9.793 -7.147 16.346 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.585 -6.583 17.454 1.00 25.00 H new ATOM 0 HB3 HIS A 51 11.146 -6.846 18.420 1.00 25.00 H new ATOM 0 HD2 HIS A 51 10.348 -9.519 16.295 1.00 25.00 H new ATOM 0 HE1 HIS A 51 13.590 -11.211 18.353 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.578 -11.751 16.891 1.00 25.00 H new ATOM 801 N GLY A 52 10.288 -4.463 15.300 1.00 25.00 N ATOM 802 CA GLY A 52 10.056 -3.021 15.311 1.00 25.00 C ATOM 803 C GLY A 52 11.316 -2.195 15.510 1.00 25.00 C ATOM 804 O GLY A 52 11.243 -0.993 15.739 1.00 25.00 O ATOM 0 H GLY A 52 10.260 -4.893 14.376 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.588 -2.731 14.370 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.348 -2.783 16.105 1.00 25.00 H new ATOM 808 N ARG A 53 12.474 -2.837 15.426 1.00 25.00 N ATOM 809 CA ARG A 53 13.759 -2.178 15.621 1.00 25.00 C ATOM 810 C ARG A 53 14.499 -2.316 14.309 1.00 25.00 C ATOM 811 O ARG A 53 14.430 -3.355 13.668 1.00 25.00 O ATOM 812 CB ARG A 53 14.524 -2.880 16.756 1.00 25.00 C ATOM 813 CG ARG A 53 15.395 -1.967 17.628 1.00 25.00 C ATOM 814 CD ARG A 53 16.731 -1.612 16.979 1.00 25.00 C ATOM 815 NE ARG A 53 17.684 -1.104 17.980 1.00 25.00 N ATOM 816 CZ ARG A 53 18.928 -0.704 17.732 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.446 -0.684 16.532 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.666 -0.315 18.728 1.00 25.00 N ATOM 0 H ARG A 53 12.549 -3.833 15.220 1.00 25.00 H new ATOM 0 HA ARG A 53 13.649 -1.129 15.897 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.803 -3.386 17.398 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.159 -3.651 16.320 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.847 -1.049 17.842 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.581 -2.457 18.583 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.147 -2.492 16.489 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.575 -0.860 16.205 1.00 25.00 H new ATOM 0 HE ARG A 53 17.362 -1.055 18.947 1.00 25.00 H new ATOM 0 HH11 ARG A 53 18.890 -0.985 15.731 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.406 -0.368 16.396 1.00 25.00 H new ATOM 0 HH21 ARG A 53 19.288 -0.321 19.675 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.623 -0.004 18.563 1.00 25.00 H new ATOM 832 N GLN A 54 15.184 -1.271 13.896 1.00 25.00 N ATOM 833 CA GLN A 54 15.958 -1.298 12.664 1.00 25.00 C ATOM 834 C GLN A 54 17.429 -1.417 13.014 1.00 25.00 C ATOM 835 O GLN A 54 17.860 -0.897 14.040 1.00 25.00 O ATOM 836 CB GLN A 54 15.715 -0.016 11.876 1.00 25.00 C ATOM 837 CG GLN A 54 14.934 -0.241 10.611 1.00 25.00 C ATOM 838 CD GLN A 54 14.561 1.054 9.914 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.404 1.284 9.608 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.531 1.890 9.653 1.00 25.00 N ATOM 0 H GLN A 54 15.223 -0.383 14.397 1.00 25.00 H new ATOM 0 HA GLN A 54 15.655 -2.149 12.054 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.179 0.694 12.505 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.674 0.438 11.628 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.521 -0.858 9.931 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.026 -0.798 10.844 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.487 1.662 9.925 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.332 2.770 9.178 1.00 25.00 H new ATOM 849 N GLY A 55 18.197 -2.082 12.168 1.00 25.00 N ATOM 850 CA GLY A 55 19.622 -2.211 12.406 1.00 25.00 C ATOM 851 C GLY A 55 20.316 -3.032 11.343 1.00 25.00 C ATOM 852 O GLY A 55 19.664 -3.616 10.478 1.00 25.00 O ATOM 0 H GLY A 55 17.861 -2.536 11.319 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.072 -1.219 12.445 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.784 -2.673 13.380 1.00 25.00 H new ATOM 856 N ILE A 56 21.637 -3.059 11.391 1.00 25.00 N ATOM 857 CA ILE A 56 22.437 -3.802 10.424 1.00 25.00 C ATOM 858 C ILE A 56 22.518 -5.267 10.844 1.00 25.00 C ATOM 859 O ILE A 56 22.346 -5.620 12.015 1.00 25.00 O ATOM 860 CB ILE A 56 23.864 -3.188 10.269 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.651 -3.314 11.589 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.737 -1.708 9.870 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.059 -2.753 11.552 1.00 25.00 C ATOM 0 H ILE A 56 22.186 -2.569 12.097 1.00 25.00 H new ATOM 0 HA ILE A 56 21.951 -3.736 9.450 1.00 25.00 H new ATOM 0 HB ILE A 56 24.405 -3.731 9.494 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.094 -2.806 12.376 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.703 -4.367 11.864 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.731 -1.274 9.760 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.201 -1.631 8.924 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.189 -1.169 10.643 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.530 -2.888 12.525 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.639 -3.276 10.792 1.00 25.00 H new ATOM 0 HD13 ILE A 56 26.021 -1.690 11.312 1.00 25.00 H new ATOM 875 N VAL A 57 22.731 -6.118 9.856 1.00 25.00 N ATOM 876 CA VAL A 57 22.790 -7.563 10.051 1.00 25.00 C ATOM 877 C VAL A 57 23.887 -8.124 9.155 1.00 25.00 C ATOM 878 O VAL A 57 23.999 -7.718 7.999 1.00 25.00 O ATOM 879 CB VAL A 57 21.455 -8.217 9.612 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.512 -9.719 9.689 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.292 -7.671 10.441 1.00 25.00 C ATOM 0 H VAL A 57 22.869 -5.828 8.888 1.00 25.00 H new ATOM 0 HA VAL A 57 22.980 -7.773 11.104 1.00 25.00 H new ATOM 0 HB VAL A 57 21.290 -7.956 8.567 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.556 -10.136 9.373 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.303 -10.087 9.035 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.719 -10.023 10.715 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.363 -8.141 10.119 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.463 -7.889 11.495 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.220 -6.592 10.301 1.00 25.00 H new ATOM 891 N PRO A 58 24.684 -9.084 9.647 1.00 25.00 N ATOM 892 CA PRO A 58 25.674 -9.693 8.759 1.00 25.00 C ATOM 893 C PRO A 58 25.004 -10.576 7.700 1.00 25.00 C ATOM 894 O PRO A 58 24.379 -11.596 8.016 1.00 25.00 O ATOM 895 CB PRO A 58 26.532 -10.513 9.723 1.00 25.00 C ATOM 896 CG PRO A 58 25.602 -10.883 10.828 1.00 25.00 C ATOM 897 CD PRO A 58 24.707 -9.689 10.992 1.00 25.00 C ATOM 0 HA PRO A 58 26.251 -8.966 8.188 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.941 -11.398 9.236 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.378 -9.933 10.093 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.029 -11.776 10.580 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.146 -11.099 11.747 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.708 -9.979 11.318 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.097 -8.995 11.737 1.00 25.00 H new ATOM 905 N GLY A 59 25.149 -10.204 6.437 1.00 25.00 N ATOM 906 CA GLY A 59 24.559 -10.955 5.342 1.00 25.00 C ATOM 907 C GLY A 59 25.075 -12.379 5.256 1.00 25.00 C ATOM 908 O GLY A 59 24.406 -13.255 4.726 1.00 25.00 O ATOM 0 H GLY A 59 25.675 -9.380 6.145 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.476 -10.973 5.463 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.766 -10.442 4.403 1.00 25.00 H new ATOM 912 N ASN A 60 26.239 -12.632 5.838 1.00 25.00 N ATOM 913 CA ASN A 60 26.823 -13.979 5.862 1.00 25.00 C ATOM 914 C ASN A 60 25.968 -14.955 6.688 1.00 25.00 C ATOM 915 O ASN A 60 26.123 -16.169 6.582 1.00 25.00 O ATOM 916 CB ASN A 60 28.244 -13.927 6.444 1.00 25.00 C ATOM 917 CG ASN A 60 29.194 -14.896 5.761 1.00 25.00 C ATOM 918 OD1 ASN A 60 30.231 -14.506 5.271 1.00 25.00 O ATOM 919 ND2 ASN A 60 28.833 -16.149 5.713 1.00 25.00 N ATOM 0 H ASN A 60 26.805 -11.923 6.304 1.00 25.00 H new ATOM 0 HA ASN A 60 26.856 -14.341 4.834 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.634 -12.914 6.348 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.204 -14.154 7.509 1.00 25.00 H new ATOM 0 HD21 ASN A 60 29.431 -16.835 5.252 1.00 25.00 H new ATOM 0 HD22 ASN A 60 27.953 -16.443 6.136 1.00 25.00 H new ATOM 926 N ARG A 61 25.070 -14.427 7.511 1.00 25.00 N ATOM 927 CA ARG A 61 24.187 -15.257 8.333 1.00 25.00 C ATOM 928 C ARG A 61 22.736 -15.106 7.905 1.00 25.00 C ATOM 929 O ARG A 61 21.828 -15.586 8.590 1.00 25.00 O ATOM 930 CB ARG A 61 24.326 -14.864 9.810 1.00 25.00 C ATOM 931 CG ARG A 61 25.728 -15.058 10.367 1.00 25.00 C ATOM 932 CD ARG A 61 25.773 -14.725 11.849 1.00 25.00 C ATOM 933 NE ARG A 61 27.131 -14.892 12.392 1.00 25.00 N ATOM 934 CZ ARG A 61 27.479 -14.737 13.662 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.621 -14.414 14.594 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.721 -14.920 13.999 1.00 25.00 N ATOM 0 H ARG A 61 24.931 -13.423 7.630 1.00 25.00 H new ATOM 0 HA ARG A 61 24.481 -16.298 8.198 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.040 -13.819 9.927 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.625 -15.454 10.401 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.046 -16.089 10.212 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.430 -14.423 9.826 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.440 -13.699 12.004 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.080 -15.370 12.390 1.00 25.00 H new ATOM 0 HE ARG A 61 27.868 -15.149 11.735 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.639 -14.271 14.356 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.933 -14.305 15.559 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.409 -15.178 13.291 1.00 25.00 H new ATOM 0 HH22 ARG A 61 29.008 -14.805 14.971 1.00 25.00 H new ATOM 950 N LEU A 62 22.508 -14.433 6.786 1.00 25.00 N ATOM 951 CA LEU A 62 21.153 -14.130 6.342 1.00 25.00 C ATOM 952 C LEU A 62 20.869 -14.569 4.918 1.00 25.00 C ATOM 953 O LEU A 62 21.700 -14.439 4.032 1.00 25.00 O ATOM 954 CB LEU A 62 20.913 -12.628 6.453 1.00 25.00 C ATOM 955 CG LEU A 62 19.481 -12.212 6.796 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.043 -12.677 8.146 1.00 25.00 C ATOM 957 CD2 LEU A 62 19.357 -10.707 6.697 1.00 25.00 C ATOM 0 H LEU A 62 23.242 -14.086 6.169 1.00 25.00 H new ATOM 0 HA LEU A 62 20.479 -14.692 6.989 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.581 -12.226 7.215 1.00 25.00 H new ATOM 0 HB3 LEU A 62 21.191 -12.163 5.507 1.00 25.00 H new ATOM 0 HG LEU A 62 18.822 -12.695 6.074 1.00 25.00 H new ATOM 0 HD11 LEU A 62 18.019 -12.350 8.329 1.00 25.00 H new ATOM 0 HD12 LEU A 62 19.090 -13.765 8.189 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.700 -12.256 8.907 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.337 -10.409 6.941 1.00 25.00 H new ATOM 0 HD22 LEU A 62 20.049 -10.238 7.396 1.00 25.00 H new ATOM 0 HD23 LEU A 62 19.595 -10.388 5.682 1.00 25.00 H new ATOM 969 N LYS A 63 19.667 -15.072 4.706 1.00 25.00 N ATOM 970 CA LYS A 63 19.243 -15.503 3.377 1.00 25.00 C ATOM 971 C LYS A 63 18.027 -14.756 2.919 1.00 25.00 C ATOM 972 O LYS A 63 16.960 -14.871 3.510 1.00 25.00 O ATOM 973 CB LYS A 63 18.928 -17.000 3.363 1.00 25.00 C ATOM 974 CG LYS A 63 18.414 -17.498 2.006 1.00 25.00 C ATOM 975 CD LYS A 63 18.279 -19.013 1.957 1.00 25.00 C ATOM 976 CE LYS A 63 17.150 -19.526 2.848 1.00 25.00 C ATOM 977 NZ LYS A 63 17.058 -21.021 2.743 1.00 25.00 N ATOM 0 H LYS A 63 18.963 -15.194 5.434 1.00 25.00 H new ATOM 0 HA LYS A 63 20.070 -15.292 2.699 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.827 -17.556 3.630 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.182 -17.215 4.128 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.446 -17.043 1.798 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.095 -17.171 1.220 1.00 25.00 H new ATOM 0 HD2 LYS A 63 18.097 -19.326 0.929 1.00 25.00 H new ATOM 0 HD3 LYS A 63 19.219 -19.469 2.268 1.00 25.00 H new ATOM 0 HE2 LYS A 63 17.331 -19.235 3.883 1.00 25.00 H new ATOM 0 HE3 LYS A 63 16.205 -19.073 2.550 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 16.288 -21.365 3.351 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 16.866 -21.289 1.757 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 17.957 -21.446 3.048 1.00 25.00 H new ATOM 991 N ILE A 64 18.179 -14.062 1.809 1.00 25.00 N ATOM 992 CA ILE A 64 17.079 -13.356 1.187 1.00 25.00 C ATOM 993 C ILE A 64 16.080 -14.376 0.658 1.00 25.00 C ATOM 994 O ILE A 64 16.441 -15.289 -0.087 1.00 25.00 O ATOM 995 CB ILE A 64 17.593 -12.487 0.012 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.675 -11.506 0.500 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.446 -11.727 -0.636 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.232 -10.521 1.607 1.00 25.00 C ATOM 0 H ILE A 64 19.067 -13.972 1.314 1.00 25.00 H new ATOM 0 HA ILE A 64 16.605 -12.707 1.923 1.00 25.00 H new ATOM 0 HB ILE A 64 18.033 -13.149 -0.734 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.523 -12.083 0.869 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.029 -10.929 -0.354 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.829 -11.123 -1.459 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.710 -12.435 -1.017 1.00 25.00 H new ATOM 0 HG23 ILE A 64 15.976 -11.078 0.103 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.069 -9.877 1.877 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.407 -9.910 1.241 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.908 -11.081 2.484 1.00 25.00 H new ATOM 1010 N LEU A 65 14.827 -14.230 1.056 1.00 25.00 N ATOM 1011 CA LEU A 65 13.776 -15.120 0.598 1.00 25.00 C ATOM 1012 C LEU A 65 13.176 -14.534 -0.672 1.00 25.00 C ATOM 1013 O LEU A 65 12.218 -13.766 -0.641 1.00 25.00 O ATOM 1014 CB LEU A 65 12.711 -15.299 1.686 1.00 25.00 C ATOM 1015 CG LEU A 65 13.257 -15.838 3.021 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.125 -15.912 4.031 1.00 25.00 C ATOM 1017 CD2 LEU A 65 13.917 -17.222 2.859 1.00 25.00 C ATOM 0 H LEU A 65 14.514 -13.501 1.697 1.00 25.00 H new ATOM 0 HA LEU A 65 14.185 -16.108 0.384 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.226 -14.339 1.866 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.943 -15.980 1.319 1.00 25.00 H new ATOM 0 HG LEU A 65 14.028 -15.153 3.374 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.507 -16.293 4.978 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.707 -14.917 4.182 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.348 -16.579 3.658 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.288 -17.564 3.825 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.183 -17.933 2.480 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.747 -17.149 2.157 1.00 25.00 H new ATOM 1327 N PRO A 89 29.156 -18.585 10.910 1.00 25.00 N ATOM 1328 CA PRO A 89 30.314 -17.947 10.273 1.00 25.00 C ATOM 1329 C PRO A 89 30.559 -16.541 10.825 1.00 25.00 C ATOM 1330 O PRO A 89 29.684 -15.964 11.486 1.00 25.00 O ATOM 1331 CB PRO A 89 29.908 -17.908 8.798 1.00 25.00 C ATOM 1332 CG PRO A 89 28.435 -17.812 8.831 1.00 25.00 C ATOM 1333 CD PRO A 89 28.031 -18.705 9.962 1.00 25.00 C ATOM 0 HA PRO A 89 31.249 -18.480 10.450 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.351 -17.055 8.285 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.237 -18.803 8.270 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.107 -16.786 8.998 1.00 25.00 H new ATOM 0 HG3 PRO A 89 27.994 -18.139 7.889 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.091 -18.385 10.411 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.892 -19.734 9.632 1.00 25.00 H new ATOM 1341 N PRO A 90 31.748 -15.972 10.577 1.00 25.00 N ATOM 1342 CA PRO A 90 32.016 -14.648 11.149 1.00 25.00 C ATOM 1343 C PRO A 90 31.179 -13.537 10.518 1.00 25.00 C ATOM 1344 O PRO A 90 30.649 -13.678 9.417 1.00 25.00 O ATOM 1345 CB PRO A 90 33.509 -14.451 10.862 1.00 25.00 C ATOM 1346 CG PRO A 90 33.748 -15.230 9.631 1.00 25.00 C ATOM 1347 CD PRO A 90 32.899 -16.464 9.795 1.00 25.00 C ATOM 0 HA PRO A 90 31.756 -14.598 12.206 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.751 -13.398 10.720 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.124 -14.811 11.687 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.462 -14.667 8.743 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.802 -15.485 9.521 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.589 -16.872 8.833 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.434 -17.256 10.319 1.00 25.00 H new ATOM 1355 N LYS A 91 31.078 -12.424 11.228 1.00 25.00 N ATOM 1356 CA LYS A 91 30.404 -11.231 10.718 1.00 25.00 C ATOM 1357 C LYS A 91 31.499 -10.355 10.093 1.00 25.00 C ATOM 1358 O LYS A 91 32.651 -10.422 10.528 1.00 25.00 O ATOM 1359 CB LYS A 91 29.673 -10.488 11.859 1.00 25.00 C ATOM 1360 CG LYS A 91 30.553 -10.158 13.083 1.00 25.00 C ATOM 1361 CD LYS A 91 29.816 -9.323 14.153 1.00 25.00 C ATOM 1362 CE LYS A 91 28.662 -10.084 14.822 1.00 25.00 C ATOM 1363 NZ LYS A 91 28.059 -9.278 15.943 1.00 25.00 N ATOM 0 H LYS A 91 31.457 -12.318 12.169 1.00 25.00 H new ATOM 0 HA LYS A 91 29.643 -11.486 9.980 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.261 -9.559 11.464 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.830 -11.096 12.188 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.902 -11.087 13.533 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.437 -9.613 12.751 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.529 -9.012 14.917 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.426 -8.416 13.692 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.896 -10.313 14.082 1.00 25.00 H new ATOM 0 HE3 LYS A 91 29.026 -11.036 15.209 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.098 -9.622 16.140 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.644 -9.378 16.797 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 28.018 -8.276 15.667 1.00 25.00 H new ATOM 1377 N PRO A 92 31.165 -9.558 9.062 1.00 25.00 N ATOM 1378 CA PRO A 92 32.200 -8.674 8.511 1.00 25.00 C ATOM 1379 C PRO A 92 32.573 -7.575 9.524 1.00 25.00 C ATOM 1380 O PRO A 92 31.853 -7.366 10.506 1.00 25.00 O ATOM 1381 CB PRO A 92 31.535 -8.117 7.240 1.00 25.00 C ATOM 1382 CG PRO A 92 30.097 -8.162 7.520 1.00 25.00 C ATOM 1383 CD PRO A 92 29.874 -9.380 8.368 1.00 25.00 C ATOM 0 HA PRO A 92 33.144 -9.173 8.293 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.866 -7.099 7.034 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.787 -8.718 6.366 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.773 -7.261 8.040 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.522 -8.220 6.596 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.056 -9.234 9.073 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.621 -10.250 7.762 1.00 25.00 H new