USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1012 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 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 CYS SG : rot 84:sc= 0.261 USER MOD Single : A 17 TYR OH : rot 30:sc= 0 USER MOD Single : A 18 ASN : amide:sc=-0.000737 X(o=-0.00074,f=-0.35) USER MOD Single : A 25 SER OG : rot -104:sc= 0.871 USER MOD Single : A 31 THR OG1 : rot -49:sc= 0.555 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 39:sc= 1.84 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.056 X(o=-0.056,f=0) USER MOD Single : A 48 TYR OH : rot 175:sc= 1.09 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 HIS : no HE2:sc= 0.0346 X(o=0.035,f=-0.2) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 GLN : amide:sc= 0.553 K(o=0.55,f=0.0055) USER MOD Single : A 55 CYS SG : rot 65:sc= 0.763 USER MOD Single : A 56 THR OG1 : rot -92:sc= -1.05 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 24:sc= 0.144 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -119:sc= -0.0339 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc=-0.00275 K(o=-0.0028,f=-1.1) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -1.04 X(o=-1,f=-1.1) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 94:sc= 0.327 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 141:sc= 1.3 (180deg=0.298) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 168:sc= -0.011 (180deg=-0.185) USER MOD Single : A 109 GLN : amide:sc= -0.551 K(o=-0.55,f=-1.8) USER MOD Single : A 110 ASN : amide:sc= 0.448 X(o=0.45,f=-0.015) USER MOD Single : A 113 LYS NZ :NH3+ 148:sc= 1.15 (180deg=-0.273) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ -160:sc= 0.148 (180deg=-0.15) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.0975) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 67 N ALA A 5 -0.082 -20.546 -0.049 1.00 0.00 N ATOM 68 CA ALA A 5 0.176 -21.225 1.224 1.00 0.00 C ATOM 69 C ALA A 5 1.657 -21.108 1.590 1.00 0.00 C ATOM 70 O ALA A 5 2.317 -22.047 2.051 1.00 0.00 O ATOM 71 CB ALA A 5 -0.362 -22.658 1.199 1.00 0.00 C ATOM 0 HA ALA A 5 -0.372 -20.732 2.027 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -0.158 -23.140 2.155 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -1.438 -22.640 1.024 1.00 0.00 H new ATOM 0 HB3 ALA A 5 0.126 -23.216 0.400 1.00 0.00 H new ATOM 77 N THR A 6 2.153 -19.899 1.397 1.00 0.00 N ATOM 78 CA THR A 6 3.490 -19.431 1.718 1.00 0.00 C ATOM 79 C THR A 6 3.370 -18.745 3.096 1.00 0.00 C ATOM 80 O THR A 6 2.255 -18.547 3.602 1.00 0.00 O ATOM 81 CB THR A 6 3.904 -18.440 0.612 1.00 0.00 C ATOM 82 OG1 THR A 6 3.469 -18.833 -0.675 1.00 0.00 O ATOM 83 CG2 THR A 6 5.422 -18.312 0.468 1.00 0.00 C ATOM 0 H THR A 6 1.587 -19.161 0.979 1.00 0.00 H new ATOM 0 HA THR A 6 4.242 -20.219 1.765 1.00 0.00 H new ATOM 0 HB THR A 6 3.440 -17.507 0.932 1.00 0.00 H new ATOM 0 HG1 THR A 6 3.757 -18.168 -1.335 1.00 0.00 H new ATOM 0 HG21 THR A 6 5.654 -17.601 -0.325 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.848 -17.959 1.407 1.00 0.00 H new ATOM 0 HG23 THR A 6 5.847 -19.284 0.219 1.00 0.00 H new ATOM 91 N LYS A 7 4.482 -18.371 3.728 1.00 0.00 N ATOM 92 CA LYS A 7 4.459 -17.686 5.025 1.00 0.00 C ATOM 93 C LYS A 7 5.487 -16.567 5.076 1.00 0.00 C ATOM 94 O LYS A 7 6.022 -16.162 4.051 1.00 0.00 O ATOM 95 CB LYS A 7 4.590 -18.720 6.161 1.00 0.00 C ATOM 96 CG LYS A 7 3.829 -18.294 7.432 1.00 0.00 C ATOM 97 CD LYS A 7 4.683 -18.450 8.695 1.00 0.00 C ATOM 98 CE LYS A 7 3.894 -17.996 9.931 1.00 0.00 C ATOM 99 NZ LYS A 7 3.126 -19.108 10.522 1.00 0.00 N ATOM 0 H LYS A 7 5.420 -18.532 3.360 1.00 0.00 H new ATOM 0 HA LYS A 7 3.499 -17.190 5.166 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.210 -19.683 5.818 1.00 0.00 H new ATOM 0 HB3 LYS A 7 5.644 -18.861 6.401 1.00 0.00 H new ATOM 0 HG2 LYS A 7 3.514 -17.255 7.334 1.00 0.00 H new ATOM 0 HG3 LYS A 7 2.924 -18.894 7.530 1.00 0.00 H new ATOM 0 HD2 LYS A 7 4.986 -19.490 8.811 1.00 0.00 H new ATOM 0 HD3 LYS A 7 5.595 -17.861 8.601 1.00 0.00 H new ATOM 0 HE2 LYS A 7 4.581 -17.592 10.674 1.00 0.00 H new ATOM 0 HE3 LYS A 7 3.214 -17.190 9.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 2.605 -18.766 11.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 2.453 -19.477 9.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 3.778 -19.866 10.809 1.00 0.00 H new ATOM 113 N ILE A 8 5.684 -16.002 6.258 1.00 0.00 N ATOM 114 CA ILE A 8 6.643 -14.933 6.509 1.00 0.00 C ATOM 115 C ILE A 8 7.350 -15.130 7.842 1.00 0.00 C ATOM 116 O ILE A 8 6.763 -15.701 8.763 1.00 0.00 O ATOM 117 CB ILE A 8 5.940 -13.551 6.516 1.00 0.00 C ATOM 118 CG1 ILE A 8 5.205 -13.136 7.810 1.00 0.00 C ATOM 119 CG2 ILE A 8 4.971 -13.381 5.353 1.00 0.00 C ATOM 120 CD1 ILE A 8 3.997 -13.976 8.243 1.00 0.00 C ATOM 0 H ILE A 8 5.168 -16.281 7.092 1.00 0.00 H new ATOM 0 HA ILE A 8 7.378 -14.965 5.704 1.00 0.00 H new ATOM 0 HB ILE A 8 6.798 -12.885 6.425 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.929 -13.145 8.625 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.872 -12.105 7.691 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.507 -12.396 5.407 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.512 -13.476 4.412 1.00 0.00 H new ATOM 0 HG23 ILE A 8 4.199 -14.149 5.407 1.00 0.00 H new ATOM 0 HD11 ILE A 8 3.583 -13.569 9.165 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.237 -13.951 7.462 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.311 -15.006 8.410 1.00 0.00 H new ATOM 132 N ASP A 9 8.586 -14.647 7.973 1.00 0.00 N ATOM 133 CA ASP A 9 9.287 -14.694 9.252 1.00 0.00 C ATOM 134 C ASP A 9 8.986 -13.311 9.810 1.00 0.00 C ATOM 135 O ASP A 9 9.774 -12.371 9.668 1.00 0.00 O ATOM 136 CB ASP A 9 10.795 -14.947 9.171 1.00 0.00 C ATOM 137 CG ASP A 9 11.351 -15.145 10.589 1.00 0.00 C ATOM 138 OD1 ASP A 9 10.696 -14.775 11.599 1.00 0.00 O ATOM 139 OD2 ASP A 9 12.419 -15.774 10.708 1.00 0.00 O ATOM 0 H ASP A 9 9.118 -14.222 7.213 1.00 0.00 H new ATOM 0 HA ASP A 9 8.955 -15.535 9.861 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.996 -15.829 8.562 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.291 -14.106 8.687 1.00 0.00 H new ATOM 144 N LYS A 10 7.780 -13.143 10.356 1.00 0.00 N ATOM 145 CA LYS A 10 7.343 -11.844 10.827 1.00 0.00 C ATOM 146 C LYS A 10 8.261 -11.283 11.884 1.00 0.00 C ATOM 147 O LYS A 10 8.374 -10.069 11.920 1.00 0.00 O ATOM 148 CB LYS A 10 5.872 -11.846 11.280 1.00 0.00 C ATOM 149 CG LYS A 10 5.711 -12.291 12.735 1.00 0.00 C ATOM 150 CD LYS A 10 4.253 -12.295 13.176 1.00 0.00 C ATOM 151 CE LYS A 10 4.236 -12.490 14.695 1.00 0.00 C ATOM 152 NZ LYS A 10 2.867 -12.445 15.230 1.00 0.00 N ATOM 0 H LYS A 10 7.098 -13.891 10.479 1.00 0.00 H new ATOM 0 HA LYS A 10 7.401 -11.172 9.971 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.456 -10.845 11.161 1.00 0.00 H new ATOM 0 HB3 LYS A 10 5.297 -12.509 10.634 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.128 -13.291 12.856 1.00 0.00 H new ATOM 0 HG3 LYS A 10 6.283 -11.626 13.382 1.00 0.00 H new ATOM 0 HD2 LYS A 10 3.767 -11.358 12.904 1.00 0.00 H new ATOM 0 HD3 LYS A 10 3.704 -13.095 12.680 1.00 0.00 H new ATOM 0 HE2 LYS A 10 4.694 -13.447 14.945 1.00 0.00 H new ATOM 0 HE3 LYS A 10 4.838 -11.715 15.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 2.892 -12.580 16.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 2.439 -11.522 15.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 2.299 -13.201 14.796 1.00 0.00 H new ATOM 166 N GLU A 11 8.867 -12.113 12.725 1.00 0.00 N ATOM 167 CA GLU A 11 9.701 -11.669 13.827 1.00 0.00 C ATOM 168 C GLU A 11 11.025 -11.157 13.278 1.00 0.00 C ATOM 169 O GLU A 11 11.370 -9.994 13.497 1.00 0.00 O ATOM 170 CB GLU A 11 9.882 -12.822 14.819 1.00 0.00 C ATOM 171 CG GLU A 11 8.542 -13.152 15.491 1.00 0.00 C ATOM 172 CD GLU A 11 8.672 -14.257 16.532 1.00 0.00 C ATOM 173 OE1 GLU A 11 8.715 -15.451 16.159 1.00 0.00 O ATOM 174 OE2 GLU A 11 8.603 -13.938 17.743 1.00 0.00 O ATOM 0 H GLU A 11 8.789 -13.128 12.656 1.00 0.00 H new ATOM 0 HA GLU A 11 9.230 -10.846 14.365 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.265 -13.701 14.301 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.620 -12.551 15.574 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.145 -12.254 15.965 1.00 0.00 H new ATOM 0 HG3 GLU A 11 7.822 -13.455 14.731 1.00 0.00 H new ATOM 181 N ALA A 12 11.725 -11.977 12.486 1.00 0.00 N ATOM 182 CA ALA A 12 12.992 -11.562 11.903 1.00 0.00 C ATOM 183 C ALA A 12 12.808 -10.343 11.007 1.00 0.00 C ATOM 184 O ALA A 12 13.685 -9.475 10.973 1.00 0.00 O ATOM 185 CB ALA A 12 13.616 -12.718 11.118 1.00 0.00 C ATOM 0 H ALA A 12 11.433 -12.923 12.239 1.00 0.00 H new ATOM 0 HA ALA A 12 13.667 -11.284 12.713 1.00 0.00 H new ATOM 0 HB1 ALA A 12 14.563 -12.395 10.687 1.00 0.00 H new ATOM 0 HB2 ALA A 12 13.790 -13.560 11.788 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.939 -13.023 10.320 1.00 0.00 H new ATOM 191 N CYS A 13 11.678 -10.252 10.297 1.00 0.00 N ATOM 192 CA CYS A 13 11.413 -9.074 9.500 1.00 0.00 C ATOM 193 C CYS A 13 10.963 -7.908 10.385 1.00 0.00 C ATOM 194 O CYS A 13 11.304 -6.773 10.056 1.00 0.00 O ATOM 195 CB CYS A 13 10.387 -9.382 8.408 1.00 0.00 C ATOM 196 SG CYS A 13 10.971 -10.711 7.315 1.00 0.00 S ATOM 0 H CYS A 13 10.953 -10.969 10.264 1.00 0.00 H new ATOM 0 HA CYS A 13 12.338 -8.773 9.009 1.00 0.00 H new ATOM 0 HB2 CYS A 13 9.441 -9.673 8.865 1.00 0.00 H new ATOM 0 HB3 CYS A 13 10.195 -8.483 7.822 1.00 0.00 H new ATOM 0 HG CYS A 13 10.690 -11.864 7.845 1.00 0.00 H new ATOM 202 N ARG A 14 10.255 -8.146 11.505 1.00 0.00 N ATOM 203 CA ARG A 14 9.829 -7.090 12.429 1.00 0.00 C ATOM 204 C ARG A 14 11.051 -6.368 12.930 1.00 0.00 C ATOM 205 O ARG A 14 10.944 -5.161 13.078 1.00 0.00 O ATOM 206 CB ARG A 14 9.007 -7.566 13.659 1.00 0.00 C ATOM 207 CG ARG A 14 8.294 -6.436 14.440 1.00 0.00 C ATOM 208 CD ARG A 14 9.097 -5.806 15.593 1.00 0.00 C ATOM 209 NE ARG A 14 8.378 -4.669 16.212 1.00 0.00 N ATOM 210 CZ ARG A 14 7.763 -4.658 17.404 1.00 0.00 C ATOM 211 NH1 ARG A 14 7.722 -5.749 18.159 1.00 0.00 N ATOM 212 NH2 ARG A 14 7.178 -3.545 17.837 1.00 0.00 N ATOM 0 H ARG A 14 9.964 -9.081 11.791 1.00 0.00 H new ATOM 0 HA ARG A 14 9.160 -6.452 11.852 1.00 0.00 H new ATOM 0 HB2 ARG A 14 8.259 -8.284 13.323 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.673 -8.095 14.341 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.026 -5.648 13.737 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.363 -6.832 14.845 1.00 0.00 H new ATOM 0 HD2 ARG A 14 9.299 -6.563 16.351 1.00 0.00 H new ATOM 0 HD3 ARG A 14 10.062 -5.464 15.219 1.00 0.00 H new ATOM 0 HE ARG A 14 8.347 -3.802 15.675 1.00 0.00 H new ATOM 0 HH11 ARG A 14 8.162 -6.610 17.835 1.00 0.00 H new ATOM 0 HH12 ARG A 14 7.251 -5.726 19.063 1.00 0.00 H new ATOM 0 HH21 ARG A 14 7.198 -2.702 17.263 1.00 0.00 H new ATOM 0 HH22 ARG A 14 6.710 -3.534 18.743 1.00 0.00 H new ATOM 226 N ALA A 15 12.165 -7.060 13.189 1.00 0.00 N ATOM 227 CA ALA A 15 13.351 -6.432 13.732 1.00 0.00 C ATOM 228 C ALA A 15 13.753 -5.264 12.829 1.00 0.00 C ATOM 229 O ALA A 15 13.680 -4.112 13.247 1.00 0.00 O ATOM 230 CB ALA A 15 14.456 -7.481 13.901 1.00 0.00 C ATOM 0 H ALA A 15 12.260 -8.062 13.026 1.00 0.00 H new ATOM 0 HA ALA A 15 13.160 -6.021 14.723 1.00 0.00 H new ATOM 0 HB1 ALA A 15 15.348 -7.007 14.310 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.116 -8.262 14.581 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.691 -7.921 12.932 1.00 0.00 H new ATOM 236 N ALA A 16 14.078 -5.529 11.563 1.00 0.00 N ATOM 237 CA ALA A 16 14.543 -4.466 10.676 1.00 0.00 C ATOM 238 C ALA A 16 13.419 -3.472 10.364 1.00 0.00 C ATOM 239 O ALA A 16 13.669 -2.282 10.184 1.00 0.00 O ATOM 240 CB ALA A 16 15.070 -5.077 9.382 1.00 0.00 C ATOM 0 H ALA A 16 14.029 -6.454 11.136 1.00 0.00 H new ATOM 0 HA ALA A 16 15.343 -3.923 11.180 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.417 -4.284 8.720 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.898 -5.749 9.608 1.00 0.00 H new ATOM 0 HB3 ALA A 16 14.272 -5.635 8.892 1.00 0.00 H new ATOM 246 N TYR A 17 12.177 -3.952 10.278 1.00 0.00 N ATOM 247 CA TYR A 17 11.005 -3.112 10.087 1.00 0.00 C ATOM 248 C TYR A 17 10.881 -2.107 11.235 1.00 0.00 C ATOM 249 O TYR A 17 10.523 -0.957 10.997 1.00 0.00 O ATOM 250 CB TYR A 17 9.788 -4.037 9.966 1.00 0.00 C ATOM 251 CG TYR A 17 8.423 -3.457 10.262 1.00 0.00 C ATOM 252 CD1 TYR A 17 7.997 -3.458 11.604 1.00 0.00 C ATOM 253 CD2 TYR A 17 7.534 -3.073 9.240 1.00 0.00 C ATOM 254 CE1 TYR A 17 6.687 -3.094 11.933 1.00 0.00 C ATOM 255 CE2 TYR A 17 6.218 -2.692 9.566 1.00 0.00 C ATOM 256 CZ TYR A 17 5.792 -2.709 10.915 1.00 0.00 C ATOM 257 OH TYR A 17 4.527 -2.370 11.264 1.00 0.00 O ATOM 0 H TYR A 17 11.960 -4.947 10.340 1.00 0.00 H new ATOM 0 HA TYR A 17 11.083 -2.517 9.177 1.00 0.00 H new ATOM 0 HB2 TYR A 17 9.769 -4.433 8.951 1.00 0.00 H new ATOM 0 HB3 TYR A 17 9.944 -4.883 10.636 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.687 -3.742 12.385 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.860 -3.071 8.210 1.00 0.00 H new ATOM 0 HE1 TYR A 17 6.363 -3.108 12.963 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.535 -2.387 8.787 1.00 0.00 H new ATOM 0 HH TYR A 17 4.528 -1.990 12.167 1.00 0.00 H new ATOM 267 N ASN A 18 11.188 -2.525 12.466 1.00 0.00 N ATOM 268 CA ASN A 18 11.156 -1.689 13.654 1.00 0.00 C ATOM 269 C ASN A 18 12.225 -0.621 13.536 1.00 0.00 C ATOM 270 O ASN A 18 11.916 0.527 13.810 1.00 0.00 O ATOM 271 CB ASN A 18 11.362 -2.506 14.935 1.00 0.00 C ATOM 272 CG ASN A 18 11.020 -1.686 16.167 1.00 0.00 C ATOM 273 OD1 ASN A 18 9.955 -1.082 16.250 1.00 0.00 O ATOM 274 ND2 ASN A 18 11.859 -1.733 17.182 1.00 0.00 N ATOM 0 H ASN A 18 11.473 -3.484 12.662 1.00 0.00 H new ATOM 0 HA ASN A 18 10.171 -1.228 13.723 1.00 0.00 H new ATOM 0 HB2 ASN A 18 10.739 -3.400 14.904 1.00 0.00 H new ATOM 0 HB3 ASN A 18 12.397 -2.842 14.994 1.00 0.00 H new ATOM 0 HD21 ASN A 18 11.628 -1.262 18.057 1.00 0.00 H new ATOM 0 HD22 ASN A 18 12.739 -2.240 17.093 1.00 0.00 H new ATOM 281 N LEU A 19 13.448 -0.977 13.116 1.00 0.00 N ATOM 282 CA LEU A 19 14.525 -0.018 12.871 1.00 0.00 C ATOM 283 C LEU A 19 14.040 1.043 11.893 1.00 0.00 C ATOM 284 O LEU A 19 14.019 2.220 12.214 1.00 0.00 O ATOM 285 CB LEU A 19 15.807 -0.693 12.333 1.00 0.00 C ATOM 286 CG LEU A 19 16.756 -1.352 13.350 1.00 0.00 C ATOM 287 CD1 LEU A 19 17.660 -0.287 13.958 1.00 0.00 C ATOM 288 CD2 LEU A 19 16.083 -2.102 14.497 1.00 0.00 C ATOM 0 H LEU A 19 13.715 -1.945 12.937 1.00 0.00 H new ATOM 0 HA LEU A 19 14.786 0.440 13.825 1.00 0.00 H new ATOM 0 HB2 LEU A 19 15.507 -1.455 11.614 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.375 0.058 11.784 1.00 0.00 H new ATOM 0 HG LEU A 19 17.302 -2.100 12.774 1.00 0.00 H new ATOM 0 HD11 LEU A 19 18.334 -0.750 14.679 1.00 0.00 H new ATOM 0 HD12 LEU A 19 18.243 0.188 13.170 1.00 0.00 H new ATOM 0 HD13 LEU A 19 17.050 0.464 14.461 1.00 0.00 H new ATOM 0 HD21 LEU A 19 16.845 -2.526 15.151 1.00 0.00 H new ATOM 0 HD22 LEU A 19 15.459 -1.413 15.066 1.00 0.00 H new ATOM 0 HD23 LEU A 19 15.464 -2.904 14.094 1.00 0.00 H new ATOM 300 N VAL A 20 13.602 0.631 10.711 1.00 0.00 N ATOM 301 CA VAL A 20 13.147 1.543 9.669 1.00 0.00 C ATOM 302 C VAL A 20 11.937 2.382 10.114 1.00 0.00 C ATOM 303 O VAL A 20 11.698 3.453 9.555 1.00 0.00 O ATOM 304 CB VAL A 20 12.938 0.694 8.405 1.00 0.00 C ATOM 305 CG1 VAL A 20 12.134 1.329 7.281 1.00 0.00 C ATOM 306 CG2 VAL A 20 14.315 0.378 7.824 1.00 0.00 C ATOM 0 H VAL A 20 13.552 -0.353 10.446 1.00 0.00 H new ATOM 0 HA VAL A 20 13.888 2.311 9.448 1.00 0.00 H new ATOM 0 HB VAL A 20 12.363 -0.169 8.741 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.058 0.630 6.448 1.00 0.00 H new ATOM 0 HG12 VAL A 20 11.135 1.573 7.642 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.632 2.239 6.947 1.00 0.00 H new ATOM 0 HG21 VAL A 20 14.200 -0.225 6.923 1.00 0.00 H new ATOM 0 HG22 VAL A 20 14.827 1.308 7.575 1.00 0.00 H new ATOM 0 HG23 VAL A 20 14.902 -0.174 8.558 1.00 0.00 H new ATOM 316 N ARG A 21 11.147 1.918 11.087 1.00 0.00 N ATOM 317 CA ARG A 21 10.039 2.693 11.627 1.00 0.00 C ATOM 318 C ARG A 21 10.565 3.673 12.671 1.00 0.00 C ATOM 319 O ARG A 21 10.122 4.821 12.669 1.00 0.00 O ATOM 320 CB ARG A 21 8.967 1.742 12.194 1.00 0.00 C ATOM 321 CG ARG A 21 7.577 2.386 12.374 1.00 0.00 C ATOM 322 CD ARG A 21 7.243 2.780 13.820 1.00 0.00 C ATOM 323 NE ARG A 21 7.831 4.074 14.205 1.00 0.00 N ATOM 324 CZ ARG A 21 8.451 4.372 15.351 1.00 0.00 C ATOM 325 NH1 ARG A 21 8.605 3.469 16.311 1.00 0.00 N ATOM 326 NH2 ARG A 21 8.939 5.586 15.547 1.00 0.00 N ATOM 0 H ARG A 21 11.261 1.000 11.517 1.00 0.00 H new ATOM 0 HA ARG A 21 9.565 3.279 10.840 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.873 0.883 11.530 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.307 1.364 13.158 1.00 0.00 H new ATOM 0 HG2 ARG A 21 7.517 3.274 11.745 1.00 0.00 H new ATOM 0 HG3 ARG A 21 6.818 1.690 12.015 1.00 0.00 H new ATOM 0 HD2 ARG A 21 6.161 2.827 13.939 1.00 0.00 H new ATOM 0 HD3 ARG A 21 7.604 2.005 14.496 1.00 0.00 H new ATOM 0 HE ARG A 21 7.757 4.827 13.521 1.00 0.00 H new ATOM 0 HH11 ARG A 21 8.246 2.523 16.183 1.00 0.00 H new ATOM 0 HH12 ARG A 21 9.082 3.721 17.177 1.00 0.00 H new ATOM 0 HH21 ARG A 21 8.843 6.298 14.823 1.00 0.00 H new ATOM 0 HH22 ARG A 21 9.412 5.810 16.423 1.00 0.00 H new ATOM 340 N ASP A 22 11.443 3.224 13.569 1.00 0.00 N ATOM 341 CA ASP A 22 11.993 3.967 14.694 1.00 0.00 C ATOM 342 C ASP A 22 12.558 5.302 14.239 1.00 0.00 C ATOM 343 O ASP A 22 13.476 5.380 13.429 1.00 0.00 O ATOM 344 CB ASP A 22 13.058 3.125 15.419 1.00 0.00 C ATOM 345 CG ASP A 22 13.856 3.933 16.444 1.00 0.00 C ATOM 346 OD1 ASP A 22 13.263 4.776 17.160 1.00 0.00 O ATOM 347 OD2 ASP A 22 15.081 3.716 16.581 1.00 0.00 O ATOM 0 H ASP A 22 11.809 2.273 13.524 1.00 0.00 H new ATOM 0 HA ASP A 22 11.188 4.177 15.399 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.573 2.288 15.921 1.00 0.00 H new ATOM 0 HB3 ASP A 22 13.743 2.702 14.684 1.00 0.00 H new ATOM 352 N ASP A 23 12.050 6.374 14.842 1.00 0.00 N ATOM 353 CA ASP A 23 12.413 7.734 14.490 1.00 0.00 C ATOM 354 C ASP A 23 13.818 8.084 14.982 1.00 0.00 C ATOM 355 O ASP A 23 14.334 9.134 14.609 1.00 0.00 O ATOM 356 CB ASP A 23 11.347 8.709 15.013 1.00 0.00 C ATOM 357 CG ASP A 23 10.133 8.775 14.085 1.00 0.00 C ATOM 358 OD1 ASP A 23 10.135 9.620 13.157 1.00 0.00 O ATOM 359 OD2 ASP A 23 9.147 8.024 14.271 1.00 0.00 O ATOM 0 H ASP A 23 11.367 6.316 15.597 1.00 0.00 H new ATOM 0 HA ASP A 23 12.443 7.823 13.404 1.00 0.00 H new ATOM 0 HB2 ASP A 23 11.027 8.399 16.008 1.00 0.00 H new ATOM 0 HB3 ASP A 23 11.782 9.703 15.114 1.00 0.00 H new ATOM 364 N GLY A 24 14.447 7.244 15.810 1.00 0.00 N ATOM 365 CA GLY A 24 15.817 7.431 16.269 1.00 0.00 C ATOM 366 C GLY A 24 16.818 6.563 15.501 1.00 0.00 C ATOM 367 O GLY A 24 18.027 6.734 15.692 1.00 0.00 O ATOM 0 H GLY A 24 14.007 6.403 16.183 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.093 8.480 16.160 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.876 7.194 17.331 1.00 0.00 H new ATOM 371 N SER A 25 16.352 5.644 14.652 1.00 0.00 N ATOM 372 CA SER A 25 17.203 4.711 13.940 1.00 0.00 C ATOM 373 C SER A 25 18.060 5.428 12.904 1.00 0.00 C ATOM 374 O SER A 25 17.692 6.478 12.365 1.00 0.00 O ATOM 375 CB SER A 25 16.326 3.635 13.283 1.00 0.00 C ATOM 376 OG SER A 25 17.049 2.772 12.429 1.00 0.00 O ATOM 0 H SER A 25 15.360 5.532 14.443 1.00 0.00 H new ATOM 0 HA SER A 25 17.885 4.237 14.646 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.843 3.044 14.061 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.534 4.120 12.713 1.00 0.00 H new ATOM 0 HG SER A 25 16.866 3.007 11.495 1.00 0.00 H new ATOM 382 N ALA A 26 19.252 4.868 12.704 1.00 0.00 N ATOM 383 CA ALA A 26 20.197 5.305 11.698 1.00 0.00 C ATOM 384 C ALA A 26 19.835 4.590 10.398 1.00 0.00 C ATOM 385 O ALA A 26 19.950 5.165 9.323 1.00 0.00 O ATOM 386 CB ALA A 26 21.618 4.925 12.124 1.00 0.00 C ATOM 0 H ALA A 26 19.588 4.078 13.255 1.00 0.00 H new ATOM 0 HA ALA A 26 20.156 6.387 11.569 1.00 0.00 H new ATOM 0 HB1 ALA A 26 22.326 5.256 11.364 1.00 0.00 H new ATOM 0 HB2 ALA A 26 21.854 5.405 13.074 1.00 0.00 H new ATOM 0 HB3 ALA A 26 21.687 3.843 12.238 1.00 0.00 H new ATOM 392 N VAL A 27 19.389 3.334 10.493 1.00 0.00 N ATOM 393 CA VAL A 27 18.939 2.548 9.362 1.00 0.00 C ATOM 394 C VAL A 27 17.633 3.164 8.865 1.00 0.00 C ATOM 395 O VAL A 27 16.675 3.270 9.637 1.00 0.00 O ATOM 396 CB VAL A 27 18.790 1.077 9.804 1.00 0.00 C ATOM 397 CG1 VAL A 27 18.026 0.215 8.794 1.00 0.00 C ATOM 398 CG2 VAL A 27 20.176 0.460 10.040 1.00 0.00 C ATOM 0 H VAL A 27 19.333 2.834 11.380 1.00 0.00 H new ATOM 0 HA VAL A 27 19.652 2.556 8.538 1.00 0.00 H new ATOM 0 HB VAL A 27 18.208 1.090 10.725 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.957 -0.807 9.166 1.00 0.00 H new ATOM 0 HG12 VAL A 27 17.023 0.619 8.656 1.00 0.00 H new ATOM 0 HG13 VAL A 27 18.553 0.219 7.840 1.00 0.00 H new ATOM 0 HG21 VAL A 27 20.064 -0.578 10.352 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.755 0.501 9.117 1.00 0.00 H new ATOM 0 HG23 VAL A 27 20.695 1.019 10.819 1.00 0.00 H new ATOM 408 N ILE A 28 17.596 3.530 7.582 1.00 0.00 N ATOM 409 CA ILE A 28 16.425 4.089 6.919 1.00 0.00 C ATOM 410 C ILE A 28 15.932 3.150 5.808 1.00 0.00 C ATOM 411 O ILE A 28 14.751 3.194 5.453 1.00 0.00 O ATOM 412 CB ILE A 28 16.714 5.515 6.390 1.00 0.00 C ATOM 413 CG1 ILE A 28 17.457 5.588 5.033 1.00 0.00 C ATOM 414 CG2 ILE A 28 17.448 6.387 7.419 1.00 0.00 C ATOM 415 CD1 ILE A 28 16.438 5.846 3.910 1.00 0.00 C ATOM 0 H ILE A 28 18.402 3.442 6.963 1.00 0.00 H new ATOM 0 HA ILE A 28 15.622 4.178 7.651 1.00 0.00 H new ATOM 0 HB ILE A 28 15.714 5.912 6.214 1.00 0.00 H new ATOM 0 HG12 ILE A 28 18.201 6.384 5.055 1.00 0.00 H new ATOM 0 HG13 ILE A 28 17.992 4.657 4.848 1.00 0.00 H new ATOM 0 HG21 ILE A 28 17.626 7.376 6.997 1.00 0.00 H new ATOM 0 HG22 ILE A 28 16.838 6.480 8.318 1.00 0.00 H new ATOM 0 HG23 ILE A 28 18.402 5.924 7.674 1.00 0.00 H new ATOM 0 HD11 ILE A 28 16.957 5.898 2.953 1.00 0.00 H new ATOM 0 HD12 ILE A 28 15.711 5.034 3.885 1.00 0.00 H new ATOM 0 HD13 ILE A 28 15.923 6.789 4.095 1.00 0.00 H new ATOM 427 N TRP A 29 16.816 2.303 5.261 1.00 0.00 N ATOM 428 CA TRP A 29 16.514 1.359 4.200 1.00 0.00 C ATOM 429 C TRP A 29 16.839 -0.041 4.703 1.00 0.00 C ATOM 430 O TRP A 29 17.829 -0.255 5.407 1.00 0.00 O ATOM 431 CB TRP A 29 17.281 1.708 2.907 1.00 0.00 C ATOM 432 CG TRP A 29 18.776 1.589 2.940 1.00 0.00 C ATOM 433 CD1 TRP A 29 19.656 2.615 2.998 1.00 0.00 C ATOM 434 CD2 TRP A 29 19.585 0.373 2.881 1.00 0.00 C ATOM 435 NE1 TRP A 29 20.936 2.106 3.086 1.00 0.00 N ATOM 436 CE2 TRP A 29 20.948 0.732 3.070 1.00 0.00 C ATOM 437 CE3 TRP A 29 19.315 -0.997 2.680 1.00 0.00 C ATOM 438 CZ2 TRP A 29 21.979 -0.217 3.142 1.00 0.00 C ATOM 439 CZ3 TRP A 29 20.342 -1.958 2.725 1.00 0.00 C ATOM 440 CH2 TRP A 29 21.667 -1.576 2.994 1.00 0.00 C ATOM 0 H TRP A 29 17.790 2.263 5.562 1.00 0.00 H new ATOM 0 HA TRP A 29 15.456 1.409 3.943 1.00 0.00 H new ATOM 0 HB2 TRP A 29 16.909 1.064 2.110 1.00 0.00 H new ATOM 0 HB3 TRP A 29 17.030 2.733 2.632 1.00 0.00 H new ATOM 0 HD1 TRP A 29 19.398 3.664 2.979 1.00 0.00 H new ATOM 0 HE1 TRP A 29 21.775 2.682 3.155 1.00 0.00 H new ATOM 0 HE3 TRP A 29 18.301 -1.314 2.488 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 22.999 0.095 3.309 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 20.110 -2.998 2.551 1.00 0.00 H new ATOM 0 HH2 TRP A 29 22.440 -2.324 3.086 1.00 0.00 H new ATOM 451 N VAL A 30 16.008 -0.998 4.314 1.00 0.00 N ATOM 452 CA VAL A 30 16.134 -2.421 4.589 1.00 0.00 C ATOM 453 C VAL A 30 15.772 -3.146 3.305 1.00 0.00 C ATOM 454 O VAL A 30 15.098 -2.604 2.427 1.00 0.00 O ATOM 455 CB VAL A 30 15.186 -2.792 5.750 1.00 0.00 C ATOM 456 CG1 VAL A 30 14.787 -4.269 5.898 1.00 0.00 C ATOM 457 CG2 VAL A 30 15.811 -2.362 7.079 1.00 0.00 C ATOM 0 H VAL A 30 15.176 -0.787 3.763 1.00 0.00 H new ATOM 0 HA VAL A 30 17.143 -2.701 4.893 1.00 0.00 H new ATOM 0 HB VAL A 30 14.268 -2.263 5.494 1.00 0.00 H new ATOM 0 HG11 VAL A 30 14.120 -4.382 6.753 1.00 0.00 H new ATOM 0 HG12 VAL A 30 14.277 -4.600 4.994 1.00 0.00 H new ATOM 0 HG13 VAL A 30 15.681 -4.874 6.053 1.00 0.00 H new ATOM 0 HG21 VAL A 30 15.141 -2.624 7.898 1.00 0.00 H new ATOM 0 HG22 VAL A 30 16.765 -2.871 7.214 1.00 0.00 H new ATOM 0 HG23 VAL A 30 15.972 -1.284 7.073 1.00 0.00 H new ATOM 467 N THR A 31 16.203 -4.392 3.209 1.00 0.00 N ATOM 468 CA THR A 31 15.884 -5.277 2.111 1.00 0.00 C ATOM 469 C THR A 31 15.308 -6.565 2.707 1.00 0.00 C ATOM 470 O THR A 31 15.549 -6.868 3.880 1.00 0.00 O ATOM 471 CB THR A 31 17.086 -5.436 1.165 1.00 0.00 C ATOM 472 OG1 THR A 31 18.221 -5.938 1.834 1.00 0.00 O ATOM 473 CG2 THR A 31 17.509 -4.099 0.540 1.00 0.00 C ATOM 0 H THR A 31 16.800 -4.824 3.914 1.00 0.00 H new ATOM 0 HA THR A 31 15.115 -4.869 1.456 1.00 0.00 H new ATOM 0 HB THR A 31 16.749 -6.132 0.397 1.00 0.00 H new ATOM 0 HG1 THR A 31 18.376 -5.418 2.650 1.00 0.00 H new ATOM 0 HG21 THR A 31 18.361 -4.260 -0.121 1.00 0.00 H new ATOM 0 HG22 THR A 31 16.679 -3.686 -0.033 1.00 0.00 H new ATOM 0 HG23 THR A 31 17.788 -3.401 1.329 1.00 0.00 H new ATOM 481 N PHE A 32 14.528 -7.311 1.928 1.00 0.00 N ATOM 482 CA PHE A 32 13.898 -8.554 2.347 1.00 0.00 C ATOM 483 C PHE A 32 14.217 -9.592 1.279 1.00 0.00 C ATOM 484 O PHE A 32 14.067 -9.324 0.084 1.00 0.00 O ATOM 485 CB PHE A 32 12.375 -8.381 2.511 1.00 0.00 C ATOM 486 CG PHE A 32 11.925 -7.528 3.688 1.00 0.00 C ATOM 487 CD1 PHE A 32 12.299 -7.889 4.995 1.00 0.00 C ATOM 488 CD2 PHE A 32 11.090 -6.408 3.499 1.00 0.00 C ATOM 489 CE1 PHE A 32 11.908 -7.110 6.097 1.00 0.00 C ATOM 490 CE2 PHE A 32 10.650 -5.662 4.610 1.00 0.00 C ATOM 491 CZ PHE A 32 11.074 -5.997 5.907 1.00 0.00 C ATOM 0 H PHE A 32 14.313 -7.058 0.963 1.00 0.00 H new ATOM 0 HA PHE A 32 14.279 -8.868 3.319 1.00 0.00 H new ATOM 0 HB2 PHE A 32 11.978 -7.941 1.596 1.00 0.00 H new ATOM 0 HB3 PHE A 32 11.925 -9.369 2.611 1.00 0.00 H new ATOM 0 HD1 PHE A 32 12.894 -8.776 5.153 1.00 0.00 H new ATOM 0 HD2 PHE A 32 10.788 -6.122 2.502 1.00 0.00 H new ATOM 0 HE1 PHE A 32 12.249 -7.367 7.089 1.00 0.00 H new ATOM 0 HE2 PHE A 32 9.982 -4.826 4.464 1.00 0.00 H new ATOM 0 HZ PHE A 32 10.760 -5.402 6.752 1.00 0.00 H new ATOM 501 N LYS A 33 14.687 -10.764 1.701 1.00 0.00 N ATOM 502 CA LYS A 33 15.030 -11.878 0.831 1.00 0.00 C ATOM 503 C LYS A 33 13.894 -12.888 0.963 1.00 0.00 C ATOM 504 O LYS A 33 12.974 -12.714 1.761 1.00 0.00 O ATOM 505 CB LYS A 33 16.381 -12.479 1.274 1.00 0.00 C ATOM 506 CG LYS A 33 17.574 -11.514 1.202 1.00 0.00 C ATOM 507 CD LYS A 33 18.311 -11.563 -0.150 1.00 0.00 C ATOM 508 CE LYS A 33 19.496 -12.532 -0.055 1.00 0.00 C ATOM 509 NZ LYS A 33 20.096 -12.870 -1.364 1.00 0.00 N ATOM 0 H LYS A 33 14.843 -10.967 2.688 1.00 0.00 H new ATOM 0 HA LYS A 33 15.143 -11.572 -0.209 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.284 -12.837 2.299 1.00 0.00 H new ATOM 0 HB3 LYS A 33 16.597 -13.347 0.652 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.223 -10.498 1.381 1.00 0.00 H new ATOM 0 HG3 LYS A 33 18.276 -11.754 2.001 1.00 0.00 H new ATOM 0 HD2 LYS A 33 17.628 -11.884 -0.937 1.00 0.00 H new ATOM 0 HD3 LYS A 33 18.663 -10.567 -0.420 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.263 -12.093 0.583 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.165 -13.450 0.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.889 -13.527 -1.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 19.379 -13.318 -1.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 20.442 -12.003 -1.821 1.00 0.00 H new ATOM 523 N TYR A 34 13.958 -13.961 0.188 1.00 0.00 N ATOM 524 CA TYR A 34 12.990 -15.044 0.240 1.00 0.00 C ATOM 525 C TYR A 34 13.765 -16.322 0.500 1.00 0.00 C ATOM 526 O TYR A 34 14.867 -16.478 -0.034 1.00 0.00 O ATOM 527 CB TYR A 34 12.253 -15.158 -1.105 1.00 0.00 C ATOM 528 CG TYR A 34 11.178 -14.117 -1.351 1.00 0.00 C ATOM 529 CD1 TYR A 34 11.489 -12.744 -1.394 1.00 0.00 C ATOM 530 CD2 TYR A 34 9.846 -14.527 -1.536 1.00 0.00 C ATOM 531 CE1 TYR A 34 10.469 -11.794 -1.539 1.00 0.00 C ATOM 532 CE2 TYR A 34 8.833 -13.579 -1.740 1.00 0.00 C ATOM 533 CZ TYR A 34 9.133 -12.202 -1.727 1.00 0.00 C ATOM 534 OH TYR A 34 8.146 -11.274 -1.847 1.00 0.00 O ATOM 0 H TYR A 34 14.694 -14.105 -0.503 1.00 0.00 H new ATOM 0 HA TYR A 34 12.252 -14.863 1.022 1.00 0.00 H new ATOM 0 HB2 TYR A 34 12.987 -15.094 -1.908 1.00 0.00 H new ATOM 0 HB3 TYR A 34 11.798 -16.147 -1.167 1.00 0.00 H new ATOM 0 HD1 TYR A 34 12.517 -12.422 -1.315 1.00 0.00 H new ATOM 0 HD2 TYR A 34 9.601 -15.579 -1.521 1.00 0.00 H new ATOM 0 HE1 TYR A 34 10.708 -10.741 -1.506 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.817 -13.906 -1.908 1.00 0.00 H new ATOM 0 HH TYR A 34 8.472 -10.517 -2.377 1.00 0.00 H new ATOM 544 N ASP A 35 13.244 -17.211 1.339 1.00 0.00 N ATOM 545 CA ASP A 35 13.848 -18.516 1.592 1.00 0.00 C ATOM 546 C ASP A 35 12.741 -19.552 1.473 1.00 0.00 C ATOM 547 O ASP A 35 11.752 -19.481 2.201 1.00 0.00 O ATOM 548 CB ASP A 35 14.492 -18.595 2.981 1.00 0.00 C ATOM 549 CG ASP A 35 14.922 -20.043 3.246 1.00 0.00 C ATOM 550 OD1 ASP A 35 15.815 -20.539 2.517 1.00 0.00 O ATOM 551 OD2 ASP A 35 14.328 -20.723 4.110 1.00 0.00 O ATOM 0 H ASP A 35 12.386 -17.046 1.866 1.00 0.00 H new ATOM 0 HA ASP A 35 14.645 -18.694 0.869 1.00 0.00 H new ATOM 0 HB2 ASP A 35 15.354 -17.930 3.036 1.00 0.00 H new ATOM 0 HB3 ASP A 35 13.786 -18.266 3.743 1.00 0.00 H new ATOM 556 N GLY A 36 12.918 -20.536 0.594 1.00 0.00 N ATOM 557 CA GLY A 36 11.934 -21.567 0.298 1.00 0.00 C ATOM 558 C GLY A 36 10.544 -20.984 0.066 1.00 0.00 C ATOM 559 O GLY A 36 10.263 -20.452 -1.014 1.00 0.00 O ATOM 0 H GLY A 36 13.777 -20.638 0.053 1.00 0.00 H new ATOM 0 HA2 GLY A 36 12.246 -22.122 -0.587 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.895 -22.278 1.123 1.00 0.00 H new ATOM 563 N SER A 37 9.685 -21.066 1.081 1.00 0.00 N ATOM 564 CA SER A 37 8.338 -20.531 1.065 1.00 0.00 C ATOM 565 C SER A 37 8.123 -19.485 2.171 1.00 0.00 C ATOM 566 O SER A 37 7.103 -19.554 2.871 1.00 0.00 O ATOM 567 CB SER A 37 7.336 -21.694 1.053 1.00 0.00 C ATOM 568 OG SER A 37 7.550 -22.617 2.104 1.00 0.00 O ATOM 0 H SER A 37 9.922 -21.522 1.962 1.00 0.00 H new ATOM 0 HA SER A 37 8.165 -19.966 0.149 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.324 -21.296 1.127 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.404 -22.216 0.099 1.00 0.00 H new ATOM 0 HG SER A 37 6.885 -23.334 2.050 1.00 0.00 H new ATOM 574 N THR A 38 9.071 -18.567 2.414 1.00 0.00 N ATOM 575 CA THR A 38 8.857 -17.507 3.388 1.00 0.00 C ATOM 576 C THR A 38 9.687 -16.261 3.051 1.00 0.00 C ATOM 577 O THR A 38 10.670 -16.339 2.309 1.00 0.00 O ATOM 578 CB THR A 38 9.155 -18.069 4.787 1.00 0.00 C ATOM 579 OG1 THR A 38 8.531 -17.339 5.816 1.00 0.00 O ATOM 580 CG2 THR A 38 10.634 -18.081 5.173 1.00 0.00 C ATOM 0 H THR A 38 9.980 -18.544 1.951 1.00 0.00 H new ATOM 0 HA THR A 38 7.819 -17.175 3.363 1.00 0.00 H new ATOM 0 HB THR A 38 8.772 -19.086 4.702 1.00 0.00 H new ATOM 0 HG1 THR A 38 8.752 -17.740 6.682 1.00 0.00 H new ATOM 0 HG21 THR A 38 10.745 -18.494 6.176 1.00 0.00 H new ATOM 0 HG22 THR A 38 11.190 -18.694 4.464 1.00 0.00 H new ATOM 0 HG23 THR A 38 11.023 -17.063 5.155 1.00 0.00 H new ATOM 588 N ILE A 39 9.292 -15.115 3.611 1.00 0.00 N ATOM 589 CA ILE A 39 9.999 -13.841 3.493 1.00 0.00 C ATOM 590 C ILE A 39 10.970 -13.783 4.677 1.00 0.00 C ATOM 591 O ILE A 39 10.563 -14.093 5.802 1.00 0.00 O ATOM 592 CB ILE A 39 9.020 -12.637 3.570 1.00 0.00 C ATOM 593 CG1 ILE A 39 7.742 -12.758 2.708 1.00 0.00 C ATOM 594 CG2 ILE A 39 9.748 -11.316 3.255 1.00 0.00 C ATOM 595 CD1 ILE A 39 7.962 -12.896 1.205 1.00 0.00 C ATOM 0 H ILE A 39 8.445 -15.048 4.176 1.00 0.00 H new ATOM 0 HA ILE A 39 10.510 -13.778 2.532 1.00 0.00 H new ATOM 0 HB ILE A 39 8.669 -12.642 4.602 1.00 0.00 H new ATOM 0 HG12 ILE A 39 7.175 -13.622 3.053 1.00 0.00 H new ATOM 0 HG13 ILE A 39 7.123 -11.879 2.886 1.00 0.00 H new ATOM 0 HG21 ILE A 39 9.042 -10.488 3.315 1.00 0.00 H new ATOM 0 HG22 ILE A 39 10.550 -11.162 3.976 1.00 0.00 H new ATOM 0 HG23 ILE A 39 10.168 -11.362 2.250 1.00 0.00 H new ATOM 0 HD11 ILE A 39 6.998 -12.973 0.702 1.00 0.00 H new ATOM 0 HD12 ILE A 39 8.496 -12.021 0.834 1.00 0.00 H new ATOM 0 HD13 ILE A 39 8.549 -13.792 1.004 1.00 0.00 H new ATOM 607 N VAL A 40 12.213 -13.355 4.446 1.00 0.00 N ATOM 608 CA VAL A 40 13.248 -13.212 5.477 1.00 0.00 C ATOM 609 C VAL A 40 13.923 -11.830 5.358 1.00 0.00 C ATOM 610 O VAL A 40 13.776 -11.184 4.317 1.00 0.00 O ATOM 611 CB VAL A 40 14.235 -14.402 5.407 1.00 0.00 C ATOM 612 CG1 VAL A 40 13.527 -15.746 5.264 1.00 0.00 C ATOM 613 CG2 VAL A 40 15.215 -14.342 4.246 1.00 0.00 C ATOM 0 H VAL A 40 12.537 -13.092 3.516 1.00 0.00 H new ATOM 0 HA VAL A 40 12.802 -13.248 6.471 1.00 0.00 H new ATOM 0 HB VAL A 40 14.768 -14.317 6.354 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.268 -16.545 5.220 1.00 0.00 H new ATOM 0 HG12 VAL A 40 12.872 -15.905 6.121 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.935 -15.750 4.349 1.00 0.00 H new ATOM 0 HG21 VAL A 40 15.868 -15.215 4.275 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.664 -14.332 3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 40 15.817 -13.436 4.324 1.00 0.00 H new ATOM 623 N PRO A 41 14.659 -11.332 6.369 1.00 0.00 N ATOM 624 CA PRO A 41 15.383 -10.067 6.251 1.00 0.00 C ATOM 625 C PRO A 41 16.570 -10.194 5.289 1.00 0.00 C ATOM 626 O PRO A 41 16.995 -11.297 4.939 1.00 0.00 O ATOM 627 CB PRO A 41 15.838 -9.720 7.673 1.00 0.00 C ATOM 628 CG PRO A 41 15.976 -11.090 8.327 1.00 0.00 C ATOM 629 CD PRO A 41 14.821 -11.875 7.710 1.00 0.00 C ATOM 0 HA PRO A 41 14.754 -9.280 5.835 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.782 -9.174 7.674 1.00 0.00 H new ATOM 0 HB3 PRO A 41 15.109 -9.096 8.190 1.00 0.00 H new ATOM 0 HG2 PRO A 41 16.940 -11.548 8.107 1.00 0.00 H new ATOM 0 HG3 PRO A 41 15.891 -11.031 9.412 1.00 0.00 H new ATOM 0 HD2 PRO A 41 15.043 -12.942 7.678 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.909 -11.757 8.295 1.00 0.00 H new ATOM 637 N GLY A 42 17.101 -9.053 4.862 1.00 0.00 N ATOM 638 CA GLY A 42 18.279 -8.913 4.023 1.00 0.00 C ATOM 639 C GLY A 42 19.201 -7.862 4.638 1.00 0.00 C ATOM 640 O GLY A 42 19.288 -7.735 5.860 1.00 0.00 O ATOM 0 H GLY A 42 16.695 -8.151 5.108 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.798 -9.868 3.940 1.00 0.00 H new ATOM 0 HA3 GLY A 42 17.991 -8.618 3.014 1.00 0.00 H new ATOM 644 N GLU A 43 19.909 -7.123 3.785 1.00 0.00 N ATOM 645 CA GLU A 43 20.780 -6.017 4.164 1.00 0.00 C ATOM 646 C GLU A 43 19.961 -4.839 4.711 1.00 0.00 C ATOM 647 O GLU A 43 18.767 -4.719 4.411 1.00 0.00 O ATOM 648 CB GLU A 43 21.579 -5.552 2.933 1.00 0.00 C ATOM 649 CG GLU A 43 22.562 -6.590 2.377 1.00 0.00 C ATOM 650 CD GLU A 43 23.776 -6.726 3.290 1.00 0.00 C ATOM 651 OE1 GLU A 43 23.680 -7.343 4.375 1.00 0.00 O ATOM 652 OE2 GLU A 43 24.846 -6.161 2.980 1.00 0.00 O ATOM 0 H GLU A 43 19.890 -7.285 2.778 1.00 0.00 H new ATOM 0 HA GLU A 43 21.459 -6.362 4.944 1.00 0.00 H new ATOM 0 HB2 GLU A 43 20.878 -5.277 2.145 1.00 0.00 H new ATOM 0 HB3 GLU A 43 22.133 -4.651 3.196 1.00 0.00 H new ATOM 0 HG2 GLU A 43 22.064 -7.555 2.280 1.00 0.00 H new ATOM 0 HG3 GLU A 43 22.883 -6.295 1.378 1.00 0.00 H new ATOM 659 N GLN A 44 20.624 -3.937 5.443 1.00 0.00 N ATOM 660 CA GLN A 44 20.055 -2.747 6.074 1.00 0.00 C ATOM 661 C GLN A 44 21.110 -1.639 6.166 1.00 0.00 C ATOM 662 O GLN A 44 22.298 -1.957 6.267 1.00 0.00 O ATOM 663 CB GLN A 44 19.552 -3.112 7.483 1.00 0.00 C ATOM 664 CG GLN A 44 20.522 -3.922 8.370 1.00 0.00 C ATOM 665 CD GLN A 44 20.143 -5.403 8.372 1.00 0.00 C ATOM 666 OE1 GLN A 44 19.141 -5.790 8.975 1.00 0.00 O ATOM 667 NE2 GLN A 44 20.906 -6.250 7.704 1.00 0.00 N ATOM 0 H GLN A 44 21.625 -4.025 5.619 1.00 0.00 H new ATOM 0 HA GLN A 44 19.223 -2.383 5.472 1.00 0.00 H new ATOM 0 HB2 GLN A 44 19.301 -2.189 8.006 1.00 0.00 H new ATOM 0 HB3 GLN A 44 18.628 -3.681 7.379 1.00 0.00 H new ATOM 0 HG2 GLN A 44 21.542 -3.803 8.005 1.00 0.00 H new ATOM 0 HG3 GLN A 44 20.501 -3.535 9.389 1.00 0.00 H new ATOM 0 HE21 GLN A 44 21.732 -5.912 7.210 1.00 0.00 H new ATOM 0 HE22 GLN A 44 20.669 -7.242 7.682 1.00 0.00 H new ATOM 676 N GLY A 45 20.714 -0.362 6.201 1.00 0.00 N ATOM 677 CA GLY A 45 21.646 0.758 6.308 1.00 0.00 C ATOM 678 C GLY A 45 20.966 2.123 6.195 1.00 0.00 C ATOM 679 O GLY A 45 19.736 2.226 6.190 1.00 0.00 O ATOM 0 H GLY A 45 19.735 -0.079 6.156 1.00 0.00 H new ATOM 0 HA2 GLY A 45 22.168 0.698 7.263 1.00 0.00 H new ATOM 0 HA3 GLY A 45 22.401 0.670 5.526 1.00 0.00 H new ATOM 683 N ALA A 46 21.785 3.175 6.125 1.00 0.00 N ATOM 684 CA ALA A 46 21.385 4.585 6.090 1.00 0.00 C ATOM 685 C ALA A 46 21.760 5.282 4.776 1.00 0.00 C ATOM 686 O ALA A 46 21.210 6.335 4.463 1.00 0.00 O ATOM 687 CB ALA A 46 22.124 5.325 7.212 1.00 0.00 C ATOM 0 H ALA A 46 22.798 3.061 6.089 1.00 0.00 H new ATOM 0 HA ALA A 46 20.301 4.612 6.200 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.840 6.377 7.203 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.859 4.886 8.174 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.200 5.239 7.058 1.00 0.00 H new ATOM 693 N GLU A 47 22.717 4.745 4.017 1.00 0.00 N ATOM 694 CA GLU A 47 23.235 5.340 2.787 1.00 0.00 C ATOM 695 C GLU A 47 22.729 4.468 1.649 1.00 0.00 C ATOM 696 O GLU A 47 23.046 3.275 1.624 1.00 0.00 O ATOM 697 CB GLU A 47 24.771 5.374 2.859 1.00 0.00 C ATOM 698 CG GLU A 47 25.435 6.150 1.713 1.00 0.00 C ATOM 699 CD GLU A 47 25.459 7.659 1.970 1.00 0.00 C ATOM 700 OE1 GLU A 47 24.445 8.225 2.430 1.00 0.00 O ATOM 701 OE2 GLU A 47 26.514 8.297 1.745 1.00 0.00 O ATOM 0 H GLU A 47 23.165 3.859 4.249 1.00 0.00 H new ATOM 0 HA GLU A 47 22.902 6.367 2.637 1.00 0.00 H new ATOM 0 HB2 GLU A 47 25.070 5.821 3.807 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.147 4.351 2.856 1.00 0.00 H new ATOM 0 HG2 GLU A 47 26.455 5.791 1.577 1.00 0.00 H new ATOM 0 HG3 GLU A 47 24.900 5.950 0.784 1.00 0.00 H new ATOM 708 N TYR A 48 22.011 5.038 0.683 1.00 0.00 N ATOM 709 CA TYR A 48 21.391 4.283 -0.410 1.00 0.00 C ATOM 710 C TYR A 48 22.377 3.980 -1.548 1.00 0.00 C ATOM 711 O TYR A 48 22.092 3.185 -2.440 1.00 0.00 O ATOM 712 CB TYR A 48 20.213 5.118 -0.919 1.00 0.00 C ATOM 713 CG TYR A 48 19.331 4.473 -1.973 1.00 0.00 C ATOM 714 CD1 TYR A 48 18.306 3.582 -1.604 1.00 0.00 C ATOM 715 CD2 TYR A 48 19.503 4.814 -3.327 1.00 0.00 C ATOM 716 CE1 TYR A 48 17.455 3.040 -2.587 1.00 0.00 C ATOM 717 CE2 TYR A 48 18.665 4.267 -4.314 1.00 0.00 C ATOM 718 CZ TYR A 48 17.630 3.381 -3.947 1.00 0.00 C ATOM 719 OH TYR A 48 16.776 2.893 -4.888 1.00 0.00 O ATOM 0 H TYR A 48 21.841 6.042 0.634 1.00 0.00 H new ATOM 0 HA TYR A 48 21.059 3.312 -0.041 1.00 0.00 H new ATOM 0 HB2 TYR A 48 19.588 5.382 -0.066 1.00 0.00 H new ATOM 0 HB3 TYR A 48 20.606 6.050 -1.326 1.00 0.00 H new ATOM 0 HD1 TYR A 48 18.172 3.314 -0.567 1.00 0.00 H new ATOM 0 HD2 TYR A 48 20.286 5.502 -3.611 1.00 0.00 H new ATOM 0 HE1 TYR A 48 16.666 2.361 -2.300 1.00 0.00 H new ATOM 0 HE2 TYR A 48 18.813 4.525 -5.352 1.00 0.00 H new ATOM 0 HH TYR A 48 16.986 3.291 -5.758 1.00 0.00 H new ATOM 729 N GLN A 49 23.591 4.531 -1.485 1.00 0.00 N ATOM 730 CA GLN A 49 24.649 4.303 -2.452 1.00 0.00 C ATOM 731 C GLN A 49 25.007 2.818 -2.599 1.00 0.00 C ATOM 732 O GLN A 49 25.468 2.385 -3.660 1.00 0.00 O ATOM 733 CB GLN A 49 25.859 5.115 -1.982 1.00 0.00 C ATOM 734 CG GLN A 49 26.926 5.182 -3.071 1.00 0.00 C ATOM 735 CD GLN A 49 27.966 6.261 -2.808 1.00 0.00 C ATOM 736 OE1 GLN A 49 28.027 7.250 -3.535 1.00 0.00 O ATOM 737 NE2 GLN A 49 28.789 6.100 -1.789 1.00 0.00 N ATOM 0 H GLN A 49 23.866 5.166 -0.735 1.00 0.00 H new ATOM 0 HA GLN A 49 24.317 4.619 -3.441 1.00 0.00 H new ATOM 0 HB2 GLN A 49 25.543 6.123 -1.714 1.00 0.00 H new ATOM 0 HB3 GLN A 49 26.279 4.663 -1.083 1.00 0.00 H new ATOM 0 HG2 GLN A 49 27.423 4.215 -3.147 1.00 0.00 H new ATOM 0 HG3 GLN A 49 26.447 5.371 -4.032 1.00 0.00 H new ATOM 0 HE21 GLN A 49 28.717 5.269 -1.201 1.00 0.00 H new ATOM 0 HE22 GLN A 49 29.497 6.806 -1.589 1.00 0.00 H new ATOM 746 N HIS A 50 24.827 2.045 -1.529 1.00 0.00 N ATOM 747 CA HIS A 50 25.074 0.608 -1.505 1.00 0.00 C ATOM 748 C HIS A 50 23.972 -0.157 -2.245 1.00 0.00 C ATOM 749 O HIS A 50 24.266 -1.133 -2.939 1.00 0.00 O ATOM 750 CB HIS A 50 25.218 0.133 -0.053 1.00 0.00 C ATOM 751 CG HIS A 50 26.238 0.924 0.718 1.00 0.00 C ATOM 752 ND1 HIS A 50 25.983 1.933 1.626 1.00 0.00 N ATOM 753 CD2 HIS A 50 27.591 0.841 0.545 1.00 0.00 C ATOM 754 CE1 HIS A 50 27.170 2.455 1.982 1.00 0.00 C ATOM 755 NE2 HIS A 50 28.174 1.823 1.347 1.00 0.00 N ATOM 0 H HIS A 50 24.498 2.411 -0.636 1.00 0.00 H new ATOM 0 HA HIS A 50 26.007 0.401 -2.029 1.00 0.00 H new ATOM 0 HB2 HIS A 50 24.252 0.208 0.447 1.00 0.00 H new ATOM 0 HB3 HIS A 50 25.500 -0.920 -0.046 1.00 0.00 H new ATOM 0 HD1 HIS A 50 25.066 2.227 1.963 1.00 0.00 H new ATOM 0 HD2 HIS A 50 28.113 0.144 -0.094 1.00 0.00 H new ATOM 0 HE1 HIS A 50 27.300 3.268 2.681 1.00 0.00 H new ATOM 763 N PHE A 51 22.722 0.302 -2.148 1.00 0.00 N ATOM 764 CA PHE A 51 21.525 -0.303 -2.710 1.00 0.00 C ATOM 765 C PHE A 51 21.706 -0.461 -4.215 1.00 0.00 C ATOM 766 O PHE A 51 21.363 -1.502 -4.778 1.00 0.00 O ATOM 767 CB PHE A 51 20.311 0.592 -2.412 1.00 0.00 C ATOM 768 CG PHE A 51 18.960 -0.093 -2.469 1.00 0.00 C ATOM 769 CD1 PHE A 51 18.429 -0.528 -3.695 1.00 0.00 C ATOM 770 CD2 PHE A 51 18.204 -0.234 -1.290 1.00 0.00 C ATOM 771 CE1 PHE A 51 17.136 -1.070 -3.748 1.00 0.00 C ATOM 772 CE2 PHE A 51 16.901 -0.755 -1.349 1.00 0.00 C ATOM 773 CZ PHE A 51 16.364 -1.162 -2.584 1.00 0.00 C ATOM 0 H PHE A 51 22.512 1.162 -1.641 1.00 0.00 H new ATOM 0 HA PHE A 51 21.358 -1.283 -2.264 1.00 0.00 H new ATOM 0 HB2 PHE A 51 20.437 1.025 -1.420 1.00 0.00 H new ATOM 0 HB3 PHE A 51 20.309 1.419 -3.122 1.00 0.00 H new ATOM 0 HD1 PHE A 51 19.017 -0.445 -4.597 1.00 0.00 H new ATOM 0 HD2 PHE A 51 18.626 0.058 -0.340 1.00 0.00 H new ATOM 0 HE1 PHE A 51 16.735 -1.417 -4.689 1.00 0.00 H new ATOM 0 HE2 PHE A 51 16.312 -0.843 -0.448 1.00 0.00 H new ATOM 0 HZ PHE A 51 15.356 -1.546 -2.634 1.00 0.00 H new ATOM 783 N ILE A 52 22.294 0.559 -4.852 1.00 0.00 N ATOM 784 CA ILE A 52 22.483 0.619 -6.295 1.00 0.00 C ATOM 785 C ILE A 52 23.246 -0.633 -6.740 1.00 0.00 C ATOM 786 O ILE A 52 22.896 -1.254 -7.740 1.00 0.00 O ATOM 787 CB ILE A 52 23.251 1.896 -6.722 1.00 0.00 C ATOM 788 CG1 ILE A 52 22.916 3.191 -5.953 1.00 0.00 C ATOM 789 CG2 ILE A 52 22.973 2.144 -8.216 1.00 0.00 C ATOM 790 CD1 ILE A 52 21.461 3.653 -5.969 1.00 0.00 C ATOM 0 H ILE A 52 22.656 1.378 -4.364 1.00 0.00 H new ATOM 0 HA ILE A 52 21.506 0.658 -6.776 1.00 0.00 H new ATOM 0 HB ILE A 52 24.296 1.689 -6.492 1.00 0.00 H new ATOM 0 HG12 ILE A 52 23.216 3.055 -4.914 1.00 0.00 H new ATOM 0 HG13 ILE A 52 23.530 3.994 -6.360 1.00 0.00 H new ATOM 0 HG21 ILE A 52 23.503 3.039 -8.541 1.00 0.00 H new ATOM 0 HG22 ILE A 52 23.316 1.288 -8.797 1.00 0.00 H new ATOM 0 HG23 ILE A 52 21.903 2.281 -8.369 1.00 0.00 H new ATOM 0 HD11 ILE A 52 21.365 4.573 -5.392 1.00 0.00 H new ATOM 0 HD12 ILE A 52 21.148 3.835 -6.997 1.00 0.00 H new ATOM 0 HD13 ILE A 52 20.829 2.881 -5.529 1.00 0.00 H new ATOM 802 N GLN A 53 24.292 -1.009 -6.000 1.00 0.00 N ATOM 803 CA GLN A 53 25.134 -2.158 -6.297 1.00 0.00 C ATOM 804 C GLN A 53 24.555 -3.457 -5.725 1.00 0.00 C ATOM 805 O GLN A 53 24.818 -4.525 -6.276 1.00 0.00 O ATOM 806 CB GLN A 53 26.534 -1.907 -5.727 1.00 0.00 C ATOM 807 CG GLN A 53 27.278 -0.772 -6.444 1.00 0.00 C ATOM 808 CD GLN A 53 28.686 -0.626 -5.879 1.00 0.00 C ATOM 809 OE1 GLN A 53 28.918 0.135 -4.942 1.00 0.00 O ATOM 810 NE2 GLN A 53 29.644 -1.377 -6.390 1.00 0.00 N ATOM 0 H GLN A 53 24.579 -0.508 -5.159 1.00 0.00 H new ATOM 0 HA GLN A 53 25.183 -2.279 -7.379 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.451 -1.667 -4.667 1.00 0.00 H new ATOM 0 HB3 GLN A 53 27.120 -2.823 -5.802 1.00 0.00 H new ATOM 0 HG2 GLN A 53 27.327 -0.978 -7.513 1.00 0.00 H new ATOM 0 HG3 GLN A 53 26.731 0.163 -6.324 1.00 0.00 H new ATOM 0 HE21 GLN A 53 29.440 -2.005 -7.167 1.00 0.00 H new ATOM 0 HE22 GLN A 53 30.588 -1.329 -6.007 1.00 0.00 H new ATOM 819 N GLN A 54 23.781 -3.394 -4.635 1.00 0.00 N ATOM 820 CA GLN A 54 23.122 -4.559 -4.044 1.00 0.00 C ATOM 821 C GLN A 54 22.100 -5.168 -5.009 1.00 0.00 C ATOM 822 O GLN A 54 21.835 -6.366 -4.900 1.00 0.00 O ATOM 823 CB GLN A 54 22.435 -4.187 -2.721 1.00 0.00 C ATOM 824 CG GLN A 54 23.400 -4.115 -1.528 1.00 0.00 C ATOM 825 CD GLN A 54 22.725 -3.542 -0.284 1.00 0.00 C ATOM 826 OE1 GLN A 54 21.549 -3.782 -0.026 1.00 0.00 O ATOM 827 NE2 GLN A 54 23.444 -2.768 0.508 1.00 0.00 N ATOM 0 H GLN A 54 23.594 -2.524 -4.136 1.00 0.00 H new ATOM 0 HA GLN A 54 23.893 -5.303 -3.843 1.00 0.00 H new ATOM 0 HB2 GLN A 54 21.940 -3.223 -2.836 1.00 0.00 H new ATOM 0 HB3 GLN A 54 21.658 -4.920 -2.506 1.00 0.00 H new ATOM 0 HG2 GLN A 54 23.780 -5.113 -1.308 1.00 0.00 H new ATOM 0 HG3 GLN A 54 24.259 -3.498 -1.792 1.00 0.00 H new ATOM 0 HE21 GLN A 54 24.420 -2.575 0.284 1.00 0.00 H new ATOM 0 HE22 GLN A 54 23.023 -2.363 1.344 1.00 0.00 H new ATOM 836 N CYS A 55 21.519 -4.380 -5.921 1.00 0.00 N ATOM 837 CA CYS A 55 20.606 -4.878 -6.937 1.00 0.00 C ATOM 838 C CYS A 55 21.369 -5.887 -7.798 1.00 0.00 C ATOM 839 O CYS A 55 22.407 -5.555 -8.372 1.00 0.00 O ATOM 840 CB CYS A 55 20.070 -3.719 -7.784 1.00 0.00 C ATOM 841 SG CYS A 55 19.095 -2.594 -6.741 1.00 0.00 S ATOM 0 H CYS A 55 21.675 -3.373 -5.969 1.00 0.00 H new ATOM 0 HA CYS A 55 19.746 -5.364 -6.476 1.00 0.00 H new ATOM 0 HB2 CYS A 55 20.898 -3.178 -8.243 1.00 0.00 H new ATOM 0 HB3 CYS A 55 19.452 -4.105 -8.595 1.00 0.00 H new ATOM 0 HG CYS A 55 19.870 -2.042 -5.855 1.00 0.00 H new ATOM 847 N THR A 56 20.900 -7.129 -7.850 1.00 0.00 N ATOM 848 CA THR A 56 21.501 -8.215 -8.575 1.00 0.00 C ATOM 849 C THR A 56 21.038 -8.155 -10.042 1.00 0.00 C ATOM 850 O THR A 56 20.007 -7.553 -10.348 1.00 0.00 O ATOM 851 CB THR A 56 21.153 -9.465 -7.751 1.00 0.00 C ATOM 852 OG1 THR A 56 19.826 -9.354 -7.233 1.00 0.00 O ATOM 853 CG2 THR A 56 22.054 -9.650 -6.531 1.00 0.00 C ATOM 0 H THR A 56 20.049 -7.407 -7.360 1.00 0.00 H new ATOM 0 HA THR A 56 22.586 -8.193 -8.676 1.00 0.00 H new ATOM 0 HB THR A 56 21.276 -10.306 -8.434 1.00 0.00 H new ATOM 0 HG1 THR A 56 19.856 -8.951 -6.340 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.757 -10.550 -5.992 1.00 0.00 H new ATOM 0 HG22 THR A 56 23.090 -9.747 -6.855 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.959 -8.785 -5.874 1.00 0.00 H new ATOM 861 N ASP A 57 21.788 -8.780 -10.946 1.00 0.00 N ATOM 862 CA ASP A 57 21.595 -8.774 -12.396 1.00 0.00 C ATOM 863 C ASP A 57 20.184 -9.113 -12.873 1.00 0.00 C ATOM 864 O ASP A 57 19.479 -8.228 -13.360 1.00 0.00 O ATOM 865 CB ASP A 57 22.678 -9.610 -13.105 1.00 0.00 C ATOM 866 CG ASP A 57 22.862 -11.019 -12.543 1.00 0.00 C ATOM 867 OD1 ASP A 57 22.085 -11.943 -12.872 1.00 0.00 O ATOM 868 OD2 ASP A 57 23.739 -11.185 -11.671 1.00 0.00 O ATOM 0 H ASP A 57 22.596 -9.338 -10.670 1.00 0.00 H new ATOM 0 HA ASP A 57 21.716 -7.732 -12.693 1.00 0.00 H new ATOM 0 HB2 ASP A 57 22.426 -9.685 -14.163 1.00 0.00 H new ATOM 0 HB3 ASP A 57 23.628 -9.080 -13.040 1.00 0.00 H new ATOM 873 N ASP A 58 19.792 -10.379 -12.796 1.00 0.00 N ATOM 874 CA ASP A 58 18.523 -10.897 -13.294 1.00 0.00 C ATOM 875 C ASP A 58 17.517 -11.215 -12.194 1.00 0.00 C ATOM 876 O ASP A 58 16.329 -10.972 -12.365 1.00 0.00 O ATOM 877 CB ASP A 58 18.814 -12.178 -14.093 1.00 0.00 C ATOM 878 CG ASP A 58 17.573 -13.036 -14.359 1.00 0.00 C ATOM 879 OD1 ASP A 58 17.280 -13.943 -13.538 1.00 0.00 O ATOM 880 OD2 ASP A 58 16.965 -12.914 -15.441 1.00 0.00 O ATOM 0 H ASP A 58 20.372 -11.101 -12.368 1.00 0.00 H new ATOM 0 HA ASP A 58 18.071 -10.119 -13.910 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.267 -11.905 -15.046 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.547 -12.775 -13.551 1.00 0.00 H new ATOM 885 N VAL A 59 17.986 -11.716 -11.055 1.00 0.00 N ATOM 886 CA VAL A 59 17.135 -12.155 -9.963 1.00 0.00 C ATOM 887 C VAL A 59 16.274 -11.010 -9.414 1.00 0.00 C ATOM 888 O VAL A 59 16.641 -9.836 -9.518 1.00 0.00 O ATOM 889 CB VAL A 59 18.003 -12.824 -8.880 1.00 0.00 C ATOM 890 CG1 VAL A 59 19.129 -13.697 -9.455 1.00 0.00 C ATOM 891 CG2 VAL A 59 18.695 -11.794 -8.003 1.00 0.00 C ATOM 0 H VAL A 59 18.982 -11.828 -10.866 1.00 0.00 H new ATOM 0 HA VAL A 59 16.427 -12.895 -10.335 1.00 0.00 H new ATOM 0 HB VAL A 59 17.299 -13.437 -8.317 1.00 0.00 H new ATOM 0 HG11 VAL A 59 19.701 -14.138 -8.638 1.00 0.00 H new ATOM 0 HG12 VAL A 59 18.698 -14.490 -10.066 1.00 0.00 H new ATOM 0 HG13 VAL A 59 19.788 -13.083 -10.069 1.00 0.00 H new ATOM 0 HG21 VAL A 59 19.298 -12.303 -7.251 1.00 0.00 H new ATOM 0 HG22 VAL A 59 19.338 -11.165 -8.619 1.00 0.00 H new ATOM 0 HG23 VAL A 59 17.946 -11.175 -7.509 1.00 0.00 H new ATOM 901 N ARG A 60 15.187 -11.358 -8.722 1.00 0.00 N ATOM 902 CA ARG A 60 14.262 -10.389 -8.149 1.00 0.00 C ATOM 903 C ARG A 60 14.496 -10.292 -6.641 1.00 0.00 C ATOM 904 O ARG A 60 14.946 -11.269 -6.027 1.00 0.00 O ATOM 905 CB ARG A 60 12.814 -10.728 -8.564 1.00 0.00 C ATOM 906 CG ARG A 60 12.040 -11.824 -7.801 1.00 0.00 C ATOM 907 CD ARG A 60 12.285 -13.265 -8.277 1.00 0.00 C ATOM 908 NE ARG A 60 13.482 -13.891 -7.681 1.00 0.00 N ATOM 909 CZ ARG A 60 14.420 -14.616 -8.309 1.00 0.00 C ATOM 910 NH1 ARG A 60 14.461 -14.657 -9.640 1.00 0.00 N ATOM 911 NH2 ARG A 60 15.342 -15.261 -7.607 1.00 0.00 N ATOM 0 H ARG A 60 14.926 -12.328 -8.545 1.00 0.00 H new ATOM 0 HA ARG A 60 14.445 -9.389 -8.544 1.00 0.00 H new ATOM 0 HB2 ARG A 60 12.231 -9.809 -8.496 1.00 0.00 H new ATOM 0 HB3 ARG A 60 12.835 -11.015 -9.615 1.00 0.00 H new ATOM 0 HG2 ARG A 60 12.302 -11.760 -6.745 1.00 0.00 H new ATOM 0 HG3 ARG A 60 10.974 -11.611 -7.878 1.00 0.00 H new ATOM 0 HD2 ARG A 60 11.411 -13.871 -8.037 1.00 0.00 H new ATOM 0 HD3 ARG A 60 12.387 -13.268 -9.362 1.00 0.00 H new ATOM 0 HE ARG A 60 13.610 -13.757 -6.678 1.00 0.00 H new ATOM 0 HH11 ARG A 60 13.777 -14.135 -10.188 1.00 0.00 H new ATOM 0 HH12 ARG A 60 15.177 -15.210 -10.111 1.00 0.00 H new ATOM 0 HH21 ARG A 60 15.338 -15.206 -6.588 1.00 0.00 H new ATOM 0 HH22 ARG A 60 16.055 -15.812 -8.086 1.00 0.00 H new ATOM 925 N LEU A 61 14.226 -9.138 -6.035 1.00 0.00 N ATOM 926 CA LEU A 61 14.459 -8.849 -4.616 1.00 0.00 C ATOM 927 C LEU A 61 13.427 -7.823 -4.155 1.00 0.00 C ATOM 928 O LEU A 61 12.702 -7.268 -4.977 1.00 0.00 O ATOM 929 CB LEU A 61 15.908 -8.352 -4.429 1.00 0.00 C ATOM 930 CG LEU A 61 16.394 -8.088 -2.991 1.00 0.00 C ATOM 931 CD1 LEU A 61 16.359 -9.367 -2.147 1.00 0.00 C ATOM 932 CD2 LEU A 61 17.827 -7.555 -3.019 1.00 0.00 C ATOM 0 H LEU A 61 13.823 -8.346 -6.536 1.00 0.00 H new ATOM 0 HA LEU A 61 14.342 -9.744 -4.005 1.00 0.00 H new ATOM 0 HB2 LEU A 61 16.575 -9.087 -4.879 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.022 -7.428 -4.996 1.00 0.00 H new ATOM 0 HG LEU A 61 15.725 -7.354 -2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 61 16.708 -9.147 -1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 61 15.338 -9.746 -2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 61 17.006 -10.119 -2.599 1.00 0.00 H new ATOM 0 HD21 LEU A 61 18.166 -7.370 -2.000 1.00 0.00 H new ATOM 0 HD22 LEU A 61 18.479 -8.290 -3.491 1.00 0.00 H new ATOM 0 HD23 LEU A 61 17.858 -6.625 -3.586 1.00 0.00 H new ATOM 944 N PHE A 62 13.312 -7.609 -2.846 1.00 0.00 N ATOM 945 CA PHE A 62 12.345 -6.670 -2.271 1.00 0.00 C ATOM 946 C PHE A 62 13.046 -5.765 -1.257 1.00 0.00 C ATOM 947 O PHE A 62 14.065 -6.163 -0.680 1.00 0.00 O ATOM 948 CB PHE A 62 11.186 -7.447 -1.621 1.00 0.00 C ATOM 949 CG PHE A 62 10.227 -8.151 -2.575 1.00 0.00 C ATOM 950 CD1 PHE A 62 10.660 -9.215 -3.395 1.00 0.00 C ATOM 951 CD2 PHE A 62 8.870 -7.775 -2.612 1.00 0.00 C ATOM 952 CE1 PHE A 62 9.762 -9.896 -4.229 1.00 0.00 C ATOM 953 CE2 PHE A 62 7.962 -8.473 -3.430 1.00 0.00 C ATOM 954 CZ PHE A 62 8.409 -9.534 -4.237 1.00 0.00 C ATOM 0 H PHE A 62 13.888 -8.083 -2.150 1.00 0.00 H new ATOM 0 HA PHE A 62 11.930 -6.041 -3.058 1.00 0.00 H new ATOM 0 HB2 PHE A 62 11.609 -8.193 -0.948 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.611 -6.754 -1.007 1.00 0.00 H new ATOM 0 HD1 PHE A 62 11.699 -9.509 -3.380 1.00 0.00 H new ATOM 0 HD2 PHE A 62 8.525 -6.947 -2.010 1.00 0.00 H new ATOM 0 HE1 PHE A 62 10.112 -10.697 -4.863 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.919 -8.193 -3.438 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.710 -10.069 -4.862 1.00 0.00 H new ATOM 964 N ALA A 63 12.520 -4.560 -1.003 1.00 0.00 N ATOM 965 CA ALA A 63 13.051 -3.652 -0.013 1.00 0.00 C ATOM 966 C ALA A 63 11.968 -2.813 0.640 1.00 0.00 C ATOM 967 O ALA A 63 10.831 -2.768 0.180 1.00 0.00 O ATOM 968 CB ALA A 63 14.102 -2.770 -0.678 1.00 0.00 C ATOM 0 H ALA A 63 11.703 -4.196 -1.493 1.00 0.00 H new ATOM 0 HA ALA A 63 13.505 -4.235 0.788 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.514 -2.078 0.056 1.00 0.00 H new ATOM 0 HB2 ALA A 63 14.902 -3.394 -1.076 1.00 0.00 H new ATOM 0 HB3 ALA A 63 13.643 -2.207 -1.490 1.00 0.00 H new ATOM 974 N PHE A 64 12.336 -2.150 1.726 1.00 0.00 N ATOM 975 CA PHE A 64 11.454 -1.331 2.538 1.00 0.00 C ATOM 976 C PHE A 64 12.291 -0.119 2.941 1.00 0.00 C ATOM 977 O PHE A 64 13.357 -0.289 3.535 1.00 0.00 O ATOM 978 CB PHE A 64 11.008 -2.239 3.701 1.00 0.00 C ATOM 979 CG PHE A 64 10.120 -1.657 4.784 1.00 0.00 C ATOM 980 CD1 PHE A 64 8.802 -1.252 4.491 1.00 0.00 C ATOM 981 CD2 PHE A 64 10.596 -1.566 6.108 1.00 0.00 C ATOM 982 CE1 PHE A 64 7.991 -0.709 5.507 1.00 0.00 C ATOM 983 CE2 PHE A 64 9.782 -1.021 7.117 1.00 0.00 C ATOM 984 CZ PHE A 64 8.487 -0.578 6.814 1.00 0.00 C ATOM 0 H PHE A 64 13.293 -2.170 2.077 1.00 0.00 H new ATOM 0 HA PHE A 64 10.550 -0.956 2.059 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.486 -3.094 3.271 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.907 -2.624 4.183 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.414 -1.358 3.489 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.589 -1.916 6.348 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.984 -0.392 5.280 1.00 0.00 H new ATOM 0 HE2 PHE A 64 10.155 -0.944 8.127 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.872 -0.137 7.584 1.00 0.00 H new ATOM 994 N VAL A 65 11.832 1.093 2.628 1.00 0.00 N ATOM 995 CA VAL A 65 12.574 2.328 2.876 1.00 0.00 C ATOM 996 C VAL A 65 11.615 3.367 3.453 1.00 0.00 C ATOM 997 O VAL A 65 10.513 3.580 2.929 1.00 0.00 O ATOM 998 CB VAL A 65 13.220 2.831 1.569 1.00 0.00 C ATOM 999 CG1 VAL A 65 14.131 4.042 1.793 1.00 0.00 C ATOM 1000 CG2 VAL A 65 14.067 1.747 0.876 1.00 0.00 C ATOM 0 H VAL A 65 10.924 1.246 2.190 1.00 0.00 H new ATOM 0 HA VAL A 65 13.376 2.147 3.591 1.00 0.00 H new ATOM 0 HB VAL A 65 12.377 3.109 0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.560 4.356 0.841 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.550 4.861 2.217 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.932 3.772 2.481 1.00 0.00 H new ATOM 0 HG21 VAL A 65 14.499 2.153 -0.039 1.00 0.00 H new ATOM 0 HG22 VAL A 65 14.867 1.427 1.544 1.00 0.00 H new ATOM 0 HG23 VAL A 65 13.435 0.893 0.631 1.00 0.00 H new ATOM 1010 N ARG A 66 12.025 4.001 4.555 1.00 0.00 N ATOM 1011 CA ARG A 66 11.248 5.068 5.175 1.00 0.00 C ATOM 1012 C ARG A 66 11.468 6.321 4.359 1.00 0.00 C ATOM 1013 O ARG A 66 12.564 6.883 4.397 1.00 0.00 O ATOM 1014 CB ARG A 66 11.572 5.235 6.665 1.00 0.00 C ATOM 1015 CG ARG A 66 10.594 6.209 7.351 1.00 0.00 C ATOM 1016 CD ARG A 66 10.964 7.698 7.264 1.00 0.00 C ATOM 1017 NE ARG A 66 11.919 8.078 8.306 1.00 0.00 N ATOM 1018 CZ ARG A 66 13.246 8.187 8.222 1.00 0.00 C ATOM 1019 NH1 ARG A 66 13.907 7.951 7.088 1.00 0.00 N ATOM 1020 NH2 ARG A 66 13.899 8.548 9.316 1.00 0.00 N ATOM 0 H ARG A 66 12.899 3.788 5.037 1.00 0.00 H new ATOM 0 HA ARG A 66 10.186 4.822 5.167 1.00 0.00 H new ATOM 0 HB2 ARG A 66 11.527 4.264 7.159 1.00 0.00 H new ATOM 0 HB3 ARG A 66 12.592 5.603 6.777 1.00 0.00 H new ATOM 0 HG2 ARG A 66 9.606 6.073 6.911 1.00 0.00 H new ATOM 0 HG3 ARG A 66 10.515 5.934 8.403 1.00 0.00 H new ATOM 0 HD2 ARG A 66 11.391 7.911 6.284 1.00 0.00 H new ATOM 0 HD3 ARG A 66 10.063 8.304 7.358 1.00 0.00 H new ATOM 0 HE ARG A 66 11.516 8.288 9.219 1.00 0.00 H new ATOM 0 HH11 ARG A 66 13.397 7.677 6.248 1.00 0.00 H new ATOM 0 HH12 ARG A 66 14.922 8.044 7.061 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.387 8.731 10.179 1.00 0.00 H new ATOM 0 HH22 ARG A 66 14.914 8.643 9.296 1.00 0.00 H new ATOM 1034 N PHE A 67 10.408 6.799 3.716 1.00 0.00 N ATOM 1035 CA PHE A 67 10.442 7.926 2.813 1.00 0.00 C ATOM 1036 C PHE A 67 9.544 9.029 3.374 1.00 0.00 C ATOM 1037 O PHE A 67 8.871 8.858 4.397 1.00 0.00 O ATOM 1038 CB PHE A 67 10.018 7.371 1.444 1.00 0.00 C ATOM 1039 CG PHE A 67 10.457 8.210 0.282 1.00 0.00 C ATOM 1040 CD1 PHE A 67 11.741 8.014 -0.253 1.00 0.00 C ATOM 1041 CD2 PHE A 67 9.594 9.172 -0.267 1.00 0.00 C ATOM 1042 CE1 PHE A 67 12.177 8.807 -1.320 1.00 0.00 C ATOM 1043 CE2 PHE A 67 10.035 9.974 -1.330 1.00 0.00 C ATOM 1044 CZ PHE A 67 11.335 9.801 -1.836 1.00 0.00 C ATOM 0 H PHE A 67 9.477 6.395 3.817 1.00 0.00 H new ATOM 0 HA PHE A 67 11.422 8.390 2.701 1.00 0.00 H new ATOM 0 HB2 PHE A 67 10.426 6.367 1.328 1.00 0.00 H new ATOM 0 HB3 PHE A 67 8.932 7.278 1.422 1.00 0.00 H new ATOM 0 HD1 PHE A 67 12.389 7.254 0.158 1.00 0.00 H new ATOM 0 HD2 PHE A 67 8.596 9.294 0.127 1.00 0.00 H new ATOM 0 HE1 PHE A 67 13.158 8.654 -1.744 1.00 0.00 H new ATOM 0 HE2 PHE A 67 9.380 10.719 -1.757 1.00 0.00 H new ATOM 0 HZ PHE A 67 11.689 10.441 -2.631 1.00 0.00 H new ATOM 1054 N THR A 68 9.586 10.220 2.787 1.00 0.00 N ATOM 1055 CA THR A 68 8.858 11.381 3.260 1.00 0.00 C ATOM 1056 C THR A 68 8.207 12.121 2.089 1.00 0.00 C ATOM 1057 O THR A 68 8.896 12.625 1.194 1.00 0.00 O ATOM 1058 CB THR A 68 9.870 12.208 4.057 1.00 0.00 C ATOM 1059 OG1 THR A 68 10.319 11.436 5.166 1.00 0.00 O ATOM 1060 CG2 THR A 68 9.261 13.506 4.557 1.00 0.00 C ATOM 0 H THR A 68 10.141 10.404 1.951 1.00 0.00 H new ATOM 0 HA THR A 68 8.019 11.128 3.909 1.00 0.00 H new ATOM 0 HB THR A 68 10.703 12.462 3.402 1.00 0.00 H new ATOM 0 HG1 THR A 68 10.969 11.955 5.684 1.00 0.00 H new ATOM 0 HG21 THR A 68 10.009 14.066 5.118 1.00 0.00 H new ATOM 0 HG22 THR A 68 8.924 14.101 3.708 1.00 0.00 H new ATOM 0 HG23 THR A 68 8.413 13.284 5.204 1.00 0.00 H new ATOM 1128 N SER A 74 2.550 19.129 10.692 1.00 0.00 N ATOM 1129 CA SER A 74 3.575 18.315 11.319 1.00 0.00 C ATOM 1130 C SER A 74 4.276 17.512 10.217 1.00 0.00 C ATOM 1131 O SER A 74 3.804 17.473 9.074 1.00 0.00 O ATOM 1132 CB SER A 74 2.909 17.372 12.333 1.00 0.00 C ATOM 1133 OG SER A 74 2.140 18.095 13.276 1.00 0.00 O ATOM 0 HA SER A 74 4.305 18.932 11.844 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.271 16.661 11.808 1.00 0.00 H new ATOM 0 HB3 SER A 74 3.673 16.792 12.851 1.00 0.00 H new ATOM 0 HG SER A 74 1.881 18.959 12.893 1.00 0.00 H new ATOM 1139 N LYS A 75 5.389 16.843 10.547 1.00 0.00 N ATOM 1140 CA LYS A 75 6.071 15.984 9.580 1.00 0.00 C ATOM 1141 C LYS A 75 5.152 14.849 9.130 1.00 0.00 C ATOM 1142 O LYS A 75 4.195 14.483 9.821 1.00 0.00 O ATOM 1143 CB LYS A 75 7.364 15.386 10.157 1.00 0.00 C ATOM 1144 CG LYS A 75 8.473 16.418 10.415 1.00 0.00 C ATOM 1145 CD LYS A 75 9.862 15.772 10.310 1.00 0.00 C ATOM 1146 CE LYS A 75 10.088 14.661 11.346 1.00 0.00 C ATOM 1147 NZ LYS A 75 11.223 13.792 10.979 1.00 0.00 N ATOM 0 H LYS A 75 5.829 16.881 11.466 1.00 0.00 H new ATOM 0 HA LYS A 75 6.331 16.610 8.726 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.131 14.878 11.093 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.740 14.629 9.469 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.391 17.232 9.695 1.00 0.00 H new ATOM 0 HG3 LYS A 75 8.345 16.854 11.406 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.990 15.359 9.309 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.624 16.540 10.438 1.00 0.00 H new ATOM 0 HE2 LYS A 75 10.273 15.107 12.323 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.184 14.059 11.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.344 13.055 11.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.035 13.346 10.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 12.091 14.362 10.917 1.00 0.00 H new ATOM 1161 N ARG A 76 5.485 14.263 7.983 1.00 0.00 N ATOM 1162 CA ARG A 76 4.824 13.111 7.394 1.00 0.00 C ATOM 1163 C ARG A 76 5.904 12.050 7.198 1.00 0.00 C ATOM 1164 O ARG A 76 7.089 12.380 7.121 1.00 0.00 O ATOM 1165 CB ARG A 76 4.229 13.472 6.021 1.00 0.00 C ATOM 1166 CG ARG A 76 3.183 14.595 5.960 1.00 0.00 C ATOM 1167 CD ARG A 76 1.780 14.147 6.391 1.00 0.00 C ATOM 1168 NE ARG A 76 0.744 14.948 5.713 1.00 0.00 N ATOM 1169 CZ ARG A 76 -0.545 14.628 5.542 1.00 0.00 C ATOM 1170 NH1 ARG A 76 -1.031 13.493 6.022 1.00 0.00 N ATOM 1171 NH2 ARG A 76 -1.334 15.466 4.882 1.00 0.00 N ATOM 0 H ARG A 76 6.262 14.598 7.414 1.00 0.00 H new ATOM 0 HA ARG A 76 4.014 12.764 8.036 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.053 13.747 5.362 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.776 12.571 5.606 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.506 15.417 6.599 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.136 14.982 4.942 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.642 13.092 6.156 1.00 0.00 H new ATOM 0 HD3 ARG A 76 1.676 14.249 7.471 1.00 0.00 H new ATOM 0 HE ARG A 76 1.042 15.846 5.332 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -0.421 12.851 6.529 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -2.015 13.261 5.885 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -0.956 16.339 4.514 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -2.318 15.237 4.743 1.00 0.00 H new ATOM 1185 N SER A 77 5.497 10.795 7.089 1.00 0.00 N ATOM 1186 CA SER A 77 6.360 9.668 6.804 1.00 0.00 C ATOM 1187 C SER A 77 5.503 8.728 5.970 1.00 0.00 C ATOM 1188 O SER A 77 4.305 8.593 6.237 1.00 0.00 O ATOM 1189 CB SER A 77 6.827 9.040 8.124 1.00 0.00 C ATOM 1190 OG SER A 77 7.649 7.915 7.907 1.00 0.00 O ATOM 0 H SER A 77 4.519 10.527 7.201 1.00 0.00 H new ATOM 0 HA SER A 77 7.269 9.932 6.263 1.00 0.00 H new ATOM 0 HB2 SER A 77 7.373 9.782 8.706 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.959 8.747 8.714 1.00 0.00 H new ATOM 0 HG SER A 77 7.234 7.124 8.311 1.00 0.00 H new ATOM 1196 N LYS A 78 6.065 8.146 4.911 1.00 0.00 N ATOM 1197 CA LYS A 78 5.399 7.172 4.061 1.00 0.00 C ATOM 1198 C LYS A 78 6.451 6.146 3.745 1.00 0.00 C ATOM 1199 O LYS A 78 7.529 6.470 3.264 1.00 0.00 O ATOM 1200 CB LYS A 78 4.788 7.789 2.788 1.00 0.00 C ATOM 1201 CG LYS A 78 3.422 8.423 3.090 1.00 0.00 C ATOM 1202 CD LYS A 78 2.817 9.161 1.889 1.00 0.00 C ATOM 1203 CE LYS A 78 1.406 9.664 2.234 1.00 0.00 C ATOM 1204 NZ LYS A 78 0.679 10.163 1.046 1.00 0.00 N ATOM 0 H LYS A 78 7.021 8.347 4.617 1.00 0.00 H new ATOM 0 HA LYS A 78 4.540 6.735 4.571 1.00 0.00 H new ATOM 0 HB2 LYS A 78 5.463 8.544 2.384 1.00 0.00 H new ATOM 0 HB3 LYS A 78 4.676 7.020 2.024 1.00 0.00 H new ATOM 0 HG2 LYS A 78 2.732 7.644 3.415 1.00 0.00 H new ATOM 0 HG3 LYS A 78 3.529 9.121 3.920 1.00 0.00 H new ATOM 0 HD2 LYS A 78 3.453 10.001 1.611 1.00 0.00 H new ATOM 0 HD3 LYS A 78 2.773 8.495 1.027 1.00 0.00 H new ATOM 0 HE2 LYS A 78 0.837 8.855 2.692 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.478 10.461 2.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -0.266 10.491 1.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 1.207 10.953 0.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 0.585 9.397 0.349 1.00 0.00 H new ATOM 1218 N PHE A 79 6.136 4.908 4.064 1.00 0.00 N ATOM 1219 CA PHE A 79 7.054 3.805 3.836 1.00 0.00 C ATOM 1220 C PHE A 79 6.804 3.303 2.417 1.00 0.00 C ATOM 1221 O PHE A 79 5.648 3.274 1.966 1.00 0.00 O ATOM 1222 CB PHE A 79 6.869 2.744 4.921 1.00 0.00 C ATOM 1223 CG PHE A 79 6.975 3.302 6.332 1.00 0.00 C ATOM 1224 CD1 PHE A 79 8.220 3.351 6.982 1.00 0.00 C ATOM 1225 CD2 PHE A 79 5.845 3.850 6.974 1.00 0.00 C ATOM 1226 CE1 PHE A 79 8.338 3.914 8.259 1.00 0.00 C ATOM 1227 CE2 PHE A 79 5.973 4.456 8.235 1.00 0.00 C ATOM 1228 CZ PHE A 79 7.218 4.476 8.888 1.00 0.00 C ATOM 0 H PHE A 79 5.247 4.637 4.484 1.00 0.00 H new ATOM 0 HA PHE A 79 8.099 4.106 3.908 1.00 0.00 H new ATOM 0 HB2 PHE A 79 5.894 2.273 4.796 1.00 0.00 H new ATOM 0 HB3 PHE A 79 7.619 1.964 4.789 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.095 2.950 6.492 1.00 0.00 H new ATOM 0 HD2 PHE A 79 4.878 3.804 6.495 1.00 0.00 H new ATOM 0 HE1 PHE A 79 9.294 3.915 8.761 1.00 0.00 H new ATOM 0 HE2 PHE A 79 5.112 4.908 8.705 1.00 0.00 H new ATOM 0 HZ PHE A 79 7.311 4.921 9.868 1.00 0.00 H new ATOM 1238 N ALA A 80 7.871 2.941 1.709 1.00 0.00 N ATOM 1239 CA ALA A 80 7.847 2.519 0.318 1.00 0.00 C ATOM 1240 C ALA A 80 8.332 1.078 0.221 1.00 0.00 C ATOM 1241 O ALA A 80 9.466 0.775 0.595 1.00 0.00 O ATOM 1242 CB ALA A 80 8.716 3.481 -0.516 1.00 0.00 C ATOM 0 H ALA A 80 8.810 2.935 2.107 1.00 0.00 H new ATOM 0 HA ALA A 80 6.833 2.555 -0.079 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.703 3.170 -1.561 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.320 4.493 -0.433 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.741 3.461 -0.145 1.00 0.00 H new ATOM 1248 N LEU A 81 7.432 0.179 -0.189 1.00 0.00 N ATOM 1249 CA LEU A 81 7.770 -1.220 -0.429 1.00 0.00 C ATOM 1250 C LEU A 81 8.312 -1.220 -1.850 1.00 0.00 C ATOM 1251 O LEU A 81 7.585 -0.931 -2.792 1.00 0.00 O ATOM 1252 CB LEU A 81 6.530 -2.119 -0.273 1.00 0.00 C ATOM 1253 CG LEU A 81 6.708 -3.628 -0.573 1.00 0.00 C ATOM 1254 CD1 LEU A 81 6.512 -4.015 -2.044 1.00 0.00 C ATOM 1255 CD2 LEU A 81 8.028 -4.223 -0.083 1.00 0.00 C ATOM 0 H LEU A 81 6.452 0.404 -0.362 1.00 0.00 H new ATOM 0 HA LEU A 81 8.494 -1.619 0.282 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.166 -2.018 0.750 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.749 -1.734 -0.929 1.00 0.00 H new ATOM 0 HG LEU A 81 5.896 -4.063 0.009 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.656 -5.089 -2.160 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.503 -3.748 -2.359 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.237 -3.483 -2.660 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.066 -5.283 -0.336 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.860 -3.706 -0.561 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.101 -4.105 0.998 1.00 0.00 H new ATOM 1267 N ILE A 82 9.582 -1.504 -2.035 1.00 0.00 N ATOM 1268 CA ILE A 82 10.218 -1.457 -3.344 1.00 0.00 C ATOM 1269 C ILE A 82 10.402 -2.898 -3.771 1.00 0.00 C ATOM 1270 O ILE A 82 10.685 -3.759 -2.937 1.00 0.00 O ATOM 1271 CB ILE A 82 11.562 -0.728 -3.213 1.00 0.00 C ATOM 1272 CG1 ILE A 82 11.321 0.782 -3.019 1.00 0.00 C ATOM 1273 CG2 ILE A 82 12.545 -0.960 -4.373 1.00 0.00 C ATOM 1274 CD1 ILE A 82 12.199 1.248 -1.870 1.00 0.00 C ATOM 0 H ILE A 82 10.211 -1.776 -1.280 1.00 0.00 H new ATOM 0 HA ILE A 82 9.626 -0.920 -4.085 1.00 0.00 H new ATOM 0 HB ILE A 82 12.044 -1.162 -2.337 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.563 1.328 -3.931 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.271 0.976 -2.801 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.464 -0.404 -4.188 1.00 0.00 H new ATOM 0 HG22 ILE A 82 12.774 -2.023 -4.449 1.00 0.00 H new ATOM 0 HG23 ILE A 82 12.095 -0.618 -5.305 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.050 2.316 -1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.933 0.703 -0.964 1.00 0.00 H new ATOM 0 HD13 ILE A 82 13.245 1.060 -2.112 1.00 0.00 H new ATOM 1286 N THR A 83 10.225 -3.174 -5.055 1.00 0.00 N ATOM 1287 CA THR A 83 10.476 -4.499 -5.577 1.00 0.00 C ATOM 1288 C THR A 83 11.442 -4.360 -6.744 1.00 0.00 C ATOM 1289 O THR A 83 11.174 -3.602 -7.678 1.00 0.00 O ATOM 1290 CB THR A 83 9.166 -5.185 -5.972 1.00 0.00 C ATOM 1291 OG1 THR A 83 8.127 -4.938 -5.042 1.00 0.00 O ATOM 1292 CG2 THR A 83 9.421 -6.686 -6.044 1.00 0.00 C ATOM 0 H THR A 83 9.909 -2.496 -5.749 1.00 0.00 H new ATOM 0 HA THR A 83 10.927 -5.138 -4.818 1.00 0.00 H new ATOM 0 HB THR A 83 8.845 -4.784 -6.933 1.00 0.00 H new ATOM 0 HG1 THR A 83 7.310 -5.393 -5.335 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.501 -7.198 -6.324 1.00 0.00 H new ATOM 0 HG22 THR A 83 10.191 -6.889 -6.789 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.754 -7.046 -5.071 1.00 0.00 H new ATOM 1300 N TRP A 84 12.573 -5.055 -6.672 1.00 0.00 N ATOM 1301 CA TRP A 84 13.539 -5.105 -7.744 1.00 0.00 C ATOM 1302 C TRP A 84 13.097 -6.303 -8.576 1.00 0.00 C ATOM 1303 O TRP A 84 13.017 -7.421 -8.059 1.00 0.00 O ATOM 1304 CB TRP A 84 14.953 -5.316 -7.181 1.00 0.00 C ATOM 1305 CG TRP A 84 15.953 -5.642 -8.246 1.00 0.00 C ATOM 1306 CD1 TRP A 84 16.507 -6.854 -8.469 1.00 0.00 C ATOM 1307 CD2 TRP A 84 16.399 -4.794 -9.344 1.00 0.00 C ATOM 1308 NE1 TRP A 84 17.239 -6.820 -9.639 1.00 0.00 N ATOM 1309 CE2 TRP A 84 17.153 -5.589 -10.255 1.00 0.00 C ATOM 1310 CE3 TRP A 84 16.199 -3.442 -9.682 1.00 0.00 C ATOM 1311 CZ2 TRP A 84 17.610 -5.087 -11.482 1.00 0.00 C ATOM 1312 CZ3 TRP A 84 16.675 -2.919 -10.898 1.00 0.00 C ATOM 1313 CH2 TRP A 84 17.337 -3.750 -11.819 1.00 0.00 C ATOM 0 H TRP A 84 12.840 -5.603 -5.854 1.00 0.00 H new ATOM 0 HA TRP A 84 13.579 -4.185 -8.327 1.00 0.00 H new ATOM 0 HB2 TRP A 84 15.269 -4.415 -6.655 1.00 0.00 H new ATOM 0 HB3 TRP A 84 14.932 -6.123 -6.448 1.00 0.00 H new ATOM 0 HD1 TRP A 84 16.394 -7.717 -7.830 1.00 0.00 H new ATOM 0 HE1 TRP A 84 17.776 -7.607 -10.003 1.00 0.00 H new ATOM 0 HE3 TRP A 84 15.671 -2.796 -8.996 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 18.165 -5.720 -12.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 16.531 -1.873 -11.126 1.00 0.00 H new ATOM 0 HH2 TRP A 84 17.635 -3.362 -12.782 1.00 0.00 H new ATOM 1324 N ILE A 85 12.842 -6.094 -9.859 1.00 0.00 N ATOM 1325 CA ILE A 85 12.481 -7.123 -10.813 1.00 0.00 C ATOM 1326 C ILE A 85 13.293 -6.762 -12.053 1.00 0.00 C ATOM 1327 O ILE A 85 12.805 -6.011 -12.900 1.00 0.00 O ATOM 1328 CB ILE A 85 10.957 -7.140 -11.102 1.00 0.00 C ATOM 1329 CG1 ILE A 85 9.971 -7.041 -9.919 1.00 0.00 C ATOM 1330 CG2 ILE A 85 10.629 -8.370 -11.961 1.00 0.00 C ATOM 1331 CD1 ILE A 85 9.702 -8.306 -9.102 1.00 0.00 C ATOM 0 H ILE A 85 12.884 -5.165 -10.277 1.00 0.00 H new ATOM 0 HA ILE A 85 12.697 -8.127 -10.448 1.00 0.00 H new ATOM 0 HB ILE A 85 10.788 -6.193 -11.615 1.00 0.00 H new ATOM 0 HG12 ILE A 85 10.343 -6.276 -9.237 1.00 0.00 H new ATOM 0 HG13 ILE A 85 9.017 -6.685 -10.308 1.00 0.00 H new ATOM 0 HG21 ILE A 85 9.560 -8.393 -12.171 1.00 0.00 H new ATOM 0 HG22 ILE A 85 11.182 -8.317 -12.899 1.00 0.00 H new ATOM 0 HG23 ILE A 85 10.913 -9.275 -11.424 1.00 0.00 H new ATOM 0 HD11 ILE A 85 8.991 -8.081 -8.307 1.00 0.00 H new ATOM 0 HD12 ILE A 85 9.289 -9.078 -9.752 1.00 0.00 H new ATOM 0 HD13 ILE A 85 10.635 -8.662 -8.664 1.00 0.00 H new ATOM 1343 N GLY A 86 14.545 -7.222 -12.136 1.00 0.00 N ATOM 1344 CA GLY A 86 15.410 -6.911 -13.266 1.00 0.00 C ATOM 1345 C GLY A 86 14.699 -7.183 -14.593 1.00 0.00 C ATOM 1346 O GLY A 86 13.893 -8.106 -14.691 1.00 0.00 O ATOM 0 H GLY A 86 14.979 -7.814 -11.428 1.00 0.00 H new ATOM 0 HA2 GLY A 86 15.713 -5.865 -13.219 1.00 0.00 H new ATOM 0 HA3 GLY A 86 16.319 -7.509 -13.208 1.00 0.00 H new ATOM 1350 N GLU A 87 15.005 -6.397 -15.626 1.00 0.00 N ATOM 1351 CA GLU A 87 14.376 -6.514 -16.940 1.00 0.00 C ATOM 1352 C GLU A 87 14.472 -7.930 -17.524 1.00 0.00 C ATOM 1353 O GLU A 87 13.641 -8.309 -18.352 1.00 0.00 O ATOM 1354 CB GLU A 87 15.020 -5.484 -17.879 1.00 0.00 C ATOM 1355 CG GLU A 87 14.403 -5.396 -19.283 1.00 0.00 C ATOM 1356 CD GLU A 87 12.983 -4.828 -19.276 1.00 0.00 C ATOM 1357 OE1 GLU A 87 12.844 -3.582 -19.247 1.00 0.00 O ATOM 1358 OE2 GLU A 87 11.993 -5.593 -19.369 1.00 0.00 O ATOM 0 H GLU A 87 15.703 -5.655 -15.573 1.00 0.00 H new ATOM 0 HA GLU A 87 13.310 -6.313 -16.831 1.00 0.00 H new ATOM 0 HB2 GLU A 87 14.957 -4.502 -17.411 1.00 0.00 H new ATOM 0 HB3 GLU A 87 16.079 -5.722 -17.980 1.00 0.00 H new ATOM 0 HG2 GLU A 87 15.035 -4.771 -19.913 1.00 0.00 H new ATOM 0 HG3 GLU A 87 14.389 -6.390 -19.731 1.00 0.00 H new ATOM 1365 N ASN A 88 15.426 -8.747 -17.072 1.00 0.00 N ATOM 1366 CA ASN A 88 15.628 -10.069 -17.643 1.00 0.00 C ATOM 1367 C ASN A 88 14.680 -11.100 -17.048 1.00 0.00 C ATOM 1368 O ASN A 88 14.243 -11.971 -17.805 1.00 0.00 O ATOM 1369 CB ASN A 88 17.075 -10.527 -17.442 1.00 0.00 C ATOM 1370 CG ASN A 88 18.068 -9.741 -18.281 1.00 0.00 C ATOM 1371 OD1 ASN A 88 17.713 -9.105 -19.273 1.00 0.00 O ATOM 1372 ND2 ASN A 88 19.336 -9.769 -17.911 1.00 0.00 N ATOM 0 H ASN A 88 16.067 -8.512 -16.314 1.00 0.00 H new ATOM 0 HA ASN A 88 15.415 -9.990 -18.709 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.339 -10.428 -16.389 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.154 -11.585 -17.692 1.00 0.00 H new ATOM 0 HD21 ASN A 88 20.036 -9.259 -18.450 1.00 0.00 H new ATOM 0 HD22 ASN A 88 19.615 -10.301 -17.086 1.00 0.00 H new ATOM 1379 N VAL A 89 14.317 -11.026 -15.764 1.00 0.00 N ATOM 1380 CA VAL A 89 13.437 -12.028 -15.180 1.00 0.00 C ATOM 1381 C VAL A 89 12.020 -11.864 -15.736 1.00 0.00 C ATOM 1382 O VAL A 89 11.486 -10.762 -15.870 1.00 0.00 O ATOM 1383 CB VAL A 89 13.546 -12.043 -13.644 1.00 0.00 C ATOM 1384 CG1 VAL A 89 13.204 -10.722 -12.951 1.00 0.00 C ATOM 1385 CG2 VAL A 89 12.702 -13.159 -13.020 1.00 0.00 C ATOM 0 H VAL A 89 14.616 -10.292 -15.122 1.00 0.00 H new ATOM 0 HA VAL A 89 13.755 -13.027 -15.477 1.00 0.00 H new ATOM 0 HB VAL A 89 14.607 -12.224 -13.472 1.00 0.00 H new ATOM 0 HG11 VAL A 89 13.312 -10.838 -11.873 1.00 0.00 H new ATOM 0 HG12 VAL A 89 13.880 -9.942 -13.301 1.00 0.00 H new ATOM 0 HG13 VAL A 89 12.176 -10.444 -13.185 1.00 0.00 H new ATOM 0 HG21 VAL A 89 12.809 -13.133 -11.936 1.00 0.00 H new ATOM 0 HG22 VAL A 89 11.655 -13.015 -13.285 1.00 0.00 H new ATOM 0 HG23 VAL A 89 13.042 -14.125 -13.395 1.00 0.00 H new ATOM 1395 N SER A 90 11.417 -12.996 -16.079 1.00 0.00 N ATOM 1396 CA SER A 90 10.111 -13.141 -16.689 1.00 0.00 C ATOM 1397 C SER A 90 9.491 -14.432 -16.143 1.00 0.00 C ATOM 1398 O SER A 90 10.109 -15.133 -15.332 1.00 0.00 O ATOM 1399 CB SER A 90 10.290 -13.167 -18.212 1.00 0.00 C ATOM 1400 OG SER A 90 9.067 -12.942 -18.882 1.00 0.00 O ATOM 0 H SER A 90 11.865 -13.899 -15.925 1.00 0.00 H new ATOM 0 HA SER A 90 9.442 -12.313 -16.454 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.013 -12.406 -18.507 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.700 -14.131 -18.515 1.00 0.00 H new ATOM 0 HG SER A 90 9.216 -12.963 -19.850 1.00 0.00 H new ATOM 1406 N GLY A 91 8.250 -14.724 -16.527 1.00 0.00 N ATOM 1407 CA GLY A 91 7.596 -15.961 -16.147 1.00 0.00 C ATOM 1408 C GLY A 91 7.265 -16.001 -14.673 1.00 0.00 C ATOM 1409 O GLY A 91 7.117 -14.966 -14.016 1.00 0.00 O ATOM 0 H GLY A 91 7.678 -14.110 -17.107 1.00 0.00 H new ATOM 0 HA2 GLY A 91 6.681 -16.079 -16.727 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.242 -16.803 -16.396 1.00 0.00 H new ATOM 1413 N LEU A 92 7.124 -17.223 -14.162 1.00 0.00 N ATOM 1414 CA LEU A 92 6.729 -17.509 -12.793 1.00 0.00 C ATOM 1415 C LEU A 92 7.598 -16.745 -11.794 1.00 0.00 C ATOM 1416 O LEU A 92 7.069 -16.252 -10.806 1.00 0.00 O ATOM 1417 CB LEU A 92 6.739 -19.029 -12.574 1.00 0.00 C ATOM 1418 CG LEU A 92 6.022 -19.476 -11.282 1.00 0.00 C ATOM 1419 CD1 LEU A 92 5.369 -20.847 -11.496 1.00 0.00 C ATOM 1420 CD2 LEU A 92 6.954 -19.589 -10.072 1.00 0.00 C ATOM 0 H LEU A 92 7.288 -18.066 -14.712 1.00 0.00 H new ATOM 0 HA LEU A 92 5.712 -17.157 -12.618 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.265 -19.513 -13.428 1.00 0.00 H new ATOM 0 HB3 LEU A 92 7.772 -19.376 -12.544 1.00 0.00 H new ATOM 0 HG LEU A 92 5.284 -18.703 -11.069 1.00 0.00 H new ATOM 0 HD11 LEU A 92 4.865 -21.157 -10.581 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.643 -20.782 -12.306 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.135 -21.579 -11.754 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.382 -19.907 -9.201 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.734 -20.321 -10.281 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.410 -18.619 -9.872 1.00 0.00 H new ATOM 1432 N GLN A 93 8.901 -16.570 -12.050 1.00 0.00 N ATOM 1433 CA GLN A 93 9.762 -15.830 -11.129 1.00 0.00 C ATOM 1434 C GLN A 93 9.346 -14.365 -11.003 1.00 0.00 C ATOM 1435 O GLN A 93 9.476 -13.795 -9.921 1.00 0.00 O ATOM 1436 CB GLN A 93 11.245 -15.928 -11.515 1.00 0.00 C ATOM 1437 CG GLN A 93 11.803 -17.350 -11.690 1.00 0.00 C ATOM 1438 CD GLN A 93 11.508 -17.901 -13.084 1.00 0.00 C ATOM 1439 OE1 GLN A 93 11.896 -17.311 -14.087 1.00 0.00 O ATOM 1440 NE2 GLN A 93 10.805 -19.009 -13.203 1.00 0.00 N ATOM 0 H GLN A 93 9.375 -16.928 -12.879 1.00 0.00 H new ATOM 0 HA GLN A 93 9.635 -16.304 -10.156 1.00 0.00 H new ATOM 0 HB2 GLN A 93 11.394 -15.383 -12.447 1.00 0.00 H new ATOM 0 HB3 GLN A 93 11.833 -15.420 -10.751 1.00 0.00 H new ATOM 0 HG2 GLN A 93 12.880 -17.342 -11.521 1.00 0.00 H new ATOM 0 HG3 GLN A 93 11.367 -18.008 -10.938 1.00 0.00 H new ATOM 0 HE21 GLN A 93 10.482 -19.500 -12.369 1.00 0.00 H new ATOM 0 HE22 GLN A 93 10.584 -19.376 -14.129 1.00 0.00 H new ATOM 1449 N ARG A 94 8.875 -13.734 -12.083 1.00 0.00 N ATOM 1450 CA ARG A 94 8.370 -12.366 -12.003 1.00 0.00 C ATOM 1451 C ARG A 94 6.988 -12.431 -11.358 1.00 0.00 C ATOM 1452 O ARG A 94 6.717 -11.708 -10.395 1.00 0.00 O ATOM 1453 CB ARG A 94 8.347 -11.715 -13.401 1.00 0.00 C ATOM 1454 CG ARG A 94 7.824 -10.267 -13.352 1.00 0.00 C ATOM 1455 CD ARG A 94 6.384 -10.092 -13.868 1.00 0.00 C ATOM 1456 NE ARG A 94 6.328 -9.869 -15.325 1.00 0.00 N ATOM 1457 CZ ARG A 94 6.678 -8.737 -15.959 1.00 0.00 C ATOM 1458 NH1 ARG A 94 7.093 -7.665 -15.288 1.00 0.00 N ATOM 1459 NH2 ARG A 94 6.596 -8.690 -17.280 1.00 0.00 N ATOM 0 H ARG A 94 8.834 -14.147 -13.015 1.00 0.00 H new ATOM 0 HA ARG A 94 9.019 -11.736 -11.394 1.00 0.00 H new ATOM 0 HB2 ARG A 94 9.352 -11.724 -13.822 1.00 0.00 H new ATOM 0 HB3 ARG A 94 7.718 -12.306 -14.066 1.00 0.00 H new ATOM 0 HG2 ARG A 94 7.874 -9.910 -12.323 1.00 0.00 H new ATOM 0 HG3 ARG A 94 8.487 -9.634 -13.941 1.00 0.00 H new ATOM 0 HD2 ARG A 94 5.802 -10.978 -13.617 1.00 0.00 H new ATOM 0 HD3 ARG A 94 5.918 -9.249 -13.357 1.00 0.00 H new ATOM 0 HE ARG A 94 5.995 -10.641 -15.902 1.00 0.00 H new ATOM 0 HH11 ARG A 94 7.151 -7.691 -14.270 1.00 0.00 H new ATOM 0 HH12 ARG A 94 7.353 -6.817 -15.792 1.00 0.00 H new ATOM 0 HH21 ARG A 94 6.271 -9.505 -17.800 1.00 0.00 H new ATOM 0 HH22 ARG A 94 6.858 -7.839 -17.777 1.00 0.00 H new ATOM 1473 N ALA A 95 6.132 -13.318 -11.875 1.00 0.00 N ATOM 1474 CA ALA A 95 4.747 -13.484 -11.468 1.00 0.00 C ATOM 1475 C ALA A 95 4.587 -13.789 -9.979 1.00 0.00 C ATOM 1476 O ALA A 95 3.573 -13.374 -9.419 1.00 0.00 O ATOM 1477 CB ALA A 95 4.078 -14.567 -12.311 1.00 0.00 C ATOM 0 H ALA A 95 6.403 -13.962 -12.618 1.00 0.00 H new ATOM 0 HA ALA A 95 4.253 -12.527 -11.639 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.041 -14.683 -11.998 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.110 -14.281 -13.362 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.606 -15.511 -12.176 1.00 0.00 H new ATOM 1483 N LYS A 96 5.563 -14.441 -9.322 1.00 0.00 N ATOM 1484 CA LYS A 96 5.523 -14.684 -7.880 1.00 0.00 C ATOM 1485 C LYS A 96 5.184 -13.427 -7.119 1.00 0.00 C ATOM 1486 O LYS A 96 4.382 -13.490 -6.202 1.00 0.00 O ATOM 1487 CB LYS A 96 6.849 -15.276 -7.368 1.00 0.00 C ATOM 1488 CG LYS A 96 6.997 -16.790 -7.565 1.00 0.00 C ATOM 1489 CD LYS A 96 8.460 -17.266 -7.587 1.00 0.00 C ATOM 1490 CE LYS A 96 8.620 -18.616 -6.875 1.00 0.00 C ATOM 1491 NZ LYS A 96 9.952 -19.216 -7.099 1.00 0.00 N ATOM 0 H LYS A 96 6.396 -14.811 -9.779 1.00 0.00 H new ATOM 0 HA LYS A 96 4.734 -15.415 -7.703 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.674 -14.776 -7.875 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.945 -15.051 -6.306 1.00 0.00 H new ATOM 0 HG2 LYS A 96 6.467 -17.306 -6.764 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.516 -17.075 -8.501 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.800 -17.355 -8.619 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.094 -16.521 -7.105 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.461 -18.481 -5.805 1.00 0.00 H new ATOM 0 HE3 LYS A 96 7.851 -19.303 -7.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 10.012 -20.126 -6.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 10.096 -19.371 -8.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 10.687 -18.574 -6.739 1.00 0.00 H new ATOM 1505 N THR A 97 5.677 -12.271 -7.540 1.00 0.00 N ATOM 1506 CA THR A 97 5.425 -11.008 -6.864 1.00 0.00 C ATOM 1507 C THR A 97 3.918 -10.697 -6.770 1.00 0.00 C ATOM 1508 O THR A 97 3.474 -10.110 -5.782 1.00 0.00 O ATOM 1509 CB THR A 97 6.169 -9.917 -7.653 1.00 0.00 C ATOM 1510 OG1 THR A 97 7.505 -10.309 -7.880 1.00 0.00 O ATOM 1511 CG2 THR A 97 6.144 -8.571 -6.933 1.00 0.00 C ATOM 0 H THR A 97 6.268 -12.183 -8.367 1.00 0.00 H new ATOM 0 HA THR A 97 5.785 -11.056 -5.836 1.00 0.00 H new ATOM 0 HB THR A 97 5.652 -9.795 -8.605 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.573 -10.747 -8.754 1.00 0.00 H new ATOM 0 HG21 THR A 97 6.681 -7.831 -7.526 1.00 0.00 H new ATOM 0 HG22 THR A 97 5.111 -8.249 -6.799 1.00 0.00 H new ATOM 0 HG23 THR A 97 6.622 -8.671 -5.958 1.00 0.00 H new ATOM 1519 N GLY A 98 3.103 -11.110 -7.746 1.00 0.00 N ATOM 1520 CA GLY A 98 1.655 -10.906 -7.701 1.00 0.00 C ATOM 1521 C GLY A 98 0.990 -11.704 -6.578 1.00 0.00 C ATOM 1522 O GLY A 98 -0.041 -11.288 -6.034 1.00 0.00 O ATOM 0 H GLY A 98 3.428 -11.592 -8.584 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.444 -9.845 -7.564 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.220 -11.197 -8.657 1.00 0.00 H new ATOM 1526 N THR A 99 1.621 -12.803 -6.184 1.00 0.00 N ATOM 1527 CA THR A 99 1.156 -13.758 -5.192 1.00 0.00 C ATOM 1528 C THR A 99 1.928 -13.624 -3.872 1.00 0.00 C ATOM 1529 O THR A 99 1.431 -14.022 -2.820 1.00 0.00 O ATOM 1530 CB THR A 99 1.357 -15.150 -5.813 1.00 0.00 C ATOM 1531 OG1 THR A 99 0.765 -15.193 -7.098 1.00 0.00 O ATOM 1532 CG2 THR A 99 0.756 -16.261 -4.957 1.00 0.00 C ATOM 0 H THR A 99 2.526 -13.065 -6.574 1.00 0.00 H new ATOM 0 HA THR A 99 0.110 -13.581 -4.943 1.00 0.00 H new ATOM 0 HB THR A 99 2.432 -15.318 -5.878 1.00 0.00 H new ATOM 0 HG1 THR A 99 0.898 -16.081 -7.490 1.00 0.00 H new ATOM 0 HG21 THR A 99 0.925 -17.224 -5.439 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.229 -16.260 -3.975 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.315 -16.094 -4.844 1.00 0.00 H new ATOM 1540 N ASP A 100 3.079 -12.958 -3.898 1.00 0.00 N ATOM 1541 CA ASP A 100 4.004 -12.803 -2.787 1.00 0.00 C ATOM 1542 C ASP A 100 3.923 -11.423 -2.167 1.00 0.00 C ATOM 1543 O ASP A 100 4.173 -11.304 -0.974 1.00 0.00 O ATOM 1544 CB ASP A 100 5.437 -13.049 -3.276 1.00 0.00 C ATOM 1545 CG ASP A 100 5.765 -14.528 -3.547 1.00 0.00 C ATOM 1546 OD1 ASP A 100 4.898 -15.419 -3.378 1.00 0.00 O ATOM 1547 OD2 ASP A 100 6.920 -14.821 -3.914 1.00 0.00 O ATOM 0 H ASP A 100 3.406 -12.488 -4.742 1.00 0.00 H new ATOM 0 HA ASP A 100 3.727 -13.531 -2.025 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.600 -12.479 -4.190 1.00 0.00 H new ATOM 0 HB3 ASP A 100 6.134 -12.664 -2.532 1.00 0.00 H new ATOM 1552 N LYS A 101 3.505 -10.376 -2.892 1.00 0.00 N ATOM 1553 CA LYS A 101 3.346 -9.067 -2.250 1.00 0.00 C ATOM 1554 C LYS A 101 2.397 -9.118 -1.061 1.00 0.00 C ATOM 1555 O LYS A 101 2.562 -8.323 -0.151 1.00 0.00 O ATOM 1556 CB LYS A 101 2.924 -7.961 -3.218 1.00 0.00 C ATOM 1557 CG LYS A 101 4.125 -7.405 -3.994 1.00 0.00 C ATOM 1558 CD LYS A 101 3.698 -6.251 -4.904 1.00 0.00 C ATOM 1559 CE LYS A 101 2.878 -6.756 -6.099 1.00 0.00 C ATOM 1560 NZ LYS A 101 1.823 -5.804 -6.484 1.00 0.00 N ATOM 0 H LYS A 101 3.279 -10.406 -3.886 1.00 0.00 H new ATOM 0 HA LYS A 101 4.341 -8.812 -1.886 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.186 -8.351 -3.919 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.443 -7.155 -2.664 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.887 -7.060 -3.295 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.576 -8.197 -4.591 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.108 -5.534 -4.333 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.581 -5.723 -5.264 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.541 -6.926 -6.948 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.427 -7.716 -5.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 1.747 -5.770 -7.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.915 -6.110 -6.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.061 -4.858 -6.123 1.00 0.00 H new ATOM 1574 N THR A 102 1.447 -10.054 -1.033 1.00 0.00 N ATOM 1575 CA THR A 102 0.546 -10.227 0.094 1.00 0.00 C ATOM 1576 C THR A 102 1.351 -10.602 1.355 1.00 0.00 C ATOM 1577 O THR A 102 1.051 -10.110 2.435 1.00 0.00 O ATOM 1578 CB THR A 102 -0.516 -11.270 -0.305 1.00 0.00 C ATOM 1579 OG1 THR A 102 -1.687 -11.172 0.481 1.00 0.00 O ATOM 1580 CG2 THR A 102 0.029 -12.698 -0.243 1.00 0.00 C ATOM 0 H THR A 102 1.285 -10.712 -1.796 1.00 0.00 H new ATOM 0 HA THR A 102 0.024 -9.303 0.344 1.00 0.00 H new ATOM 0 HB THR A 102 -0.778 -11.044 -1.338 1.00 0.00 H new ATOM 0 HG1 THR A 102 -2.333 -11.850 0.192 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.754 -13.399 -0.532 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.873 -12.795 -0.925 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.356 -12.919 0.773 1.00 0.00 H new ATOM 1588 N LEU A 103 2.394 -11.428 1.217 1.00 0.00 N ATOM 1589 CA LEU A 103 3.220 -11.945 2.297 1.00 0.00 C ATOM 1590 C LEU A 103 4.033 -10.825 2.891 1.00 0.00 C ATOM 1591 O LEU A 103 3.896 -10.513 4.066 1.00 0.00 O ATOM 1592 CB LEU A 103 4.190 -12.987 1.772 1.00 0.00 C ATOM 1593 CG LEU A 103 3.555 -14.323 1.423 1.00 0.00 C ATOM 1594 CD1 LEU A 103 4.719 -15.189 0.974 1.00 0.00 C ATOM 1595 CD2 LEU A 103 2.828 -14.974 2.608 1.00 0.00 C ATOM 0 H LEU A 103 2.694 -11.766 0.303 1.00 0.00 H new ATOM 0 HA LEU A 103 2.562 -12.389 3.044 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.683 -12.591 0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.965 -13.152 2.520 1.00 0.00 H new ATOM 0 HG LEU A 103 2.787 -14.198 0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.352 -16.178 0.701 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.202 -14.730 0.111 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.439 -15.281 1.787 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.397 -15.924 2.293 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.536 -15.148 3.418 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.034 -14.313 2.955 1.00 0.00 H new ATOM 1607 N VAL A 104 4.890 -10.210 2.079 1.00 0.00 N ATOM 1608 CA VAL A 104 5.654 -9.067 2.541 1.00 0.00 C ATOM 1609 C VAL A 104 4.673 -8.001 3.060 1.00 0.00 C ATOM 1610 O VAL A 104 4.998 -7.350 4.047 1.00 0.00 O ATOM 1611 CB VAL A 104 6.727 -8.668 1.504 1.00 0.00 C ATOM 1612 CG1 VAL A 104 6.242 -8.695 0.048 1.00 0.00 C ATOM 1613 CG2 VAL A 104 7.397 -7.332 1.838 1.00 0.00 C ATOM 0 H VAL A 104 5.067 -10.483 1.112 1.00 0.00 H new ATOM 0 HA VAL A 104 6.278 -9.284 3.408 1.00 0.00 H new ATOM 0 HB VAL A 104 7.480 -9.452 1.582 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.058 -8.402 -0.613 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.913 -9.702 -0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.411 -8.000 -0.072 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.143 -7.099 1.078 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.645 -6.544 1.862 1.00 0.00 H new ATOM 0 HG23 VAL A 104 7.881 -7.401 2.812 1.00 0.00 H new ATOM 1623 N LYS A 105 3.443 -7.883 2.526 1.00 0.00 N ATOM 1624 CA LYS A 105 2.447 -6.952 3.060 1.00 0.00 C ATOM 1625 C LYS A 105 2.083 -7.354 4.489 1.00 0.00 C ATOM 1626 O LYS A 105 1.940 -6.460 5.309 1.00 0.00 O ATOM 1627 CB LYS A 105 1.232 -6.840 2.114 1.00 0.00 C ATOM 1628 CG LYS A 105 -0.071 -6.261 2.688 1.00 0.00 C ATOM 1629 CD LYS A 105 -0.955 -7.330 3.367 1.00 0.00 C ATOM 1630 CE LYS A 105 -2.357 -6.827 3.724 1.00 0.00 C ATOM 1631 NZ LYS A 105 -3.138 -6.450 2.533 1.00 0.00 N ATOM 0 H LYS A 105 3.120 -8.424 1.724 1.00 0.00 H new ATOM 0 HA LYS A 105 2.866 -5.947 3.112 1.00 0.00 H new ATOM 0 HB2 LYS A 105 1.525 -6.225 1.263 1.00 0.00 H new ATOM 0 HB3 LYS A 105 1.015 -7.836 1.728 1.00 0.00 H new ATOM 0 HG2 LYS A 105 0.171 -5.483 3.412 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -0.636 -5.785 1.886 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -1.044 -8.191 2.704 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -0.460 -7.676 4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -2.890 -7.603 4.274 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -2.273 -5.966 4.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -4.134 -6.312 2.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -2.760 -5.566 2.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -3.072 -7.205 1.821 1.00 0.00 H new ATOM 1645 N GLU A 106 1.954 -8.640 4.843 1.00 0.00 N ATOM 1646 CA GLU A 106 1.687 -9.064 6.219 1.00 0.00 C ATOM 1647 C GLU A 106 2.729 -8.504 7.198 1.00 0.00 C ATOM 1648 O GLU A 106 2.408 -8.310 8.371 1.00 0.00 O ATOM 1649 CB GLU A 106 1.616 -10.596 6.367 1.00 0.00 C ATOM 1650 CG GLU A 106 0.446 -11.237 5.612 1.00 0.00 C ATOM 1651 CD GLU A 106 0.329 -12.748 5.850 1.00 0.00 C ATOM 1652 OE1 GLU A 106 0.513 -13.223 6.997 1.00 0.00 O ATOM 1653 OE2 GLU A 106 0.072 -13.498 4.881 1.00 0.00 O ATOM 0 H GLU A 106 2.032 -9.413 4.182 1.00 0.00 H new ATOM 0 HA GLU A 106 0.707 -8.655 6.467 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.549 -11.030 6.008 1.00 0.00 H new ATOM 0 HB3 GLU A 106 1.534 -10.846 7.425 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -0.483 -10.755 5.917 1.00 0.00 H new ATOM 0 HG3 GLU A 106 0.566 -11.052 4.545 1.00 0.00 H new ATOM 1660 N VAL A 107 3.966 -8.260 6.764 1.00 0.00 N ATOM 1661 CA VAL A 107 5.006 -7.642 7.583 1.00 0.00 C ATOM 1662 C VAL A 107 4.885 -6.115 7.486 1.00 0.00 C ATOM 1663 O VAL A 107 4.821 -5.423 8.500 1.00 0.00 O ATOM 1664 CB VAL A 107 6.396 -8.125 7.102 1.00 0.00 C ATOM 1665 CG1 VAL A 107 7.569 -7.396 7.776 1.00 0.00 C ATOM 1666 CG2 VAL A 107 6.562 -9.634 7.336 1.00 0.00 C ATOM 0 H VAL A 107 4.277 -8.490 5.820 1.00 0.00 H new ATOM 0 HA VAL A 107 4.886 -7.932 8.627 1.00 0.00 H new ATOM 0 HB VAL A 107 6.427 -7.894 6.037 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.510 -7.787 7.390 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.505 -6.329 7.563 1.00 0.00 H new ATOM 0 HG13 VAL A 107 7.525 -7.555 8.854 1.00 0.00 H new ATOM 0 HG21 VAL A 107 7.546 -9.950 6.990 1.00 0.00 H new ATOM 0 HG22 VAL A 107 6.465 -9.850 8.400 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.793 -10.175 6.784 1.00 0.00 H new ATOM 1676 N VAL A 108 4.854 -5.607 6.260 1.00 0.00 N ATOM 1677 CA VAL A 108 4.843 -4.217 5.837 1.00 0.00 C ATOM 1678 C VAL A 108 3.471 -3.514 5.931 1.00 0.00 C ATOM 1679 O VAL A 108 3.351 -2.423 5.391 1.00 0.00 O ATOM 1680 CB VAL A 108 5.527 -4.217 4.430 1.00 0.00 C ATOM 1681 CG1 VAL A 108 5.631 -2.885 3.681 1.00 0.00 C ATOM 1682 CG2 VAL A 108 6.981 -4.736 4.540 1.00 0.00 C ATOM 0 H VAL A 108 4.834 -6.229 5.452 1.00 0.00 H new ATOM 0 HA VAL A 108 5.402 -3.585 6.527 1.00 0.00 H new ATOM 0 HB VAL A 108 4.850 -4.852 3.858 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.127 -3.044 2.724 1.00 0.00 H new ATOM 0 HG12 VAL A 108 4.632 -2.485 3.510 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.208 -2.177 4.276 1.00 0.00 H new ATOM 0 HG21 VAL A 108 7.445 -4.731 3.554 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.548 -4.091 5.211 1.00 0.00 H new ATOM 0 HG23 VAL A 108 6.976 -5.753 4.933 1.00 0.00 H new ATOM 1692 N GLN A 109 2.444 -4.029 6.631 1.00 0.00 N ATOM 1693 CA GLN A 109 1.118 -3.376 6.630 1.00 0.00 C ATOM 1694 C GLN A 109 1.176 -1.904 7.075 1.00 0.00 C ATOM 1695 O GLN A 109 0.335 -1.111 6.642 1.00 0.00 O ATOM 1696 CB GLN A 109 0.058 -4.133 7.461 1.00 0.00 C ATOM 1697 CG GLN A 109 -0.474 -5.408 6.795 1.00 0.00 C ATOM 1698 CD GLN A 109 -1.902 -5.737 7.222 1.00 0.00 C ATOM 1699 OE1 GLN A 109 -2.869 -5.384 6.553 1.00 0.00 O ATOM 1700 NE2 GLN A 109 -2.086 -6.447 8.320 1.00 0.00 N ATOM 0 H GLN A 109 2.501 -4.877 7.194 1.00 0.00 H new ATOM 0 HA GLN A 109 0.804 -3.407 5.587 1.00 0.00 H new ATOM 0 HB2 GLN A 109 0.490 -4.395 8.427 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -0.779 -3.463 7.657 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -0.440 -5.290 5.712 1.00 0.00 H new ATOM 0 HG3 GLN A 109 0.179 -6.244 7.045 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -1.284 -6.741 8.877 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -3.030 -6.701 8.611 1.00 0.00 H new ATOM 1709 N ASN A 110 2.161 -1.500 7.880 1.00 0.00 N ATOM 1710 CA ASN A 110 2.365 -0.112 8.278 1.00 0.00 C ATOM 1711 C ASN A 110 3.188 0.553 7.165 1.00 0.00 C ATOM 1712 O ASN A 110 4.336 0.950 7.374 1.00 0.00 O ATOM 1713 CB ASN A 110 3.041 -0.028 9.655 1.00 0.00 C ATOM 1714 CG ASN A 110 3.024 1.389 10.219 1.00 0.00 C ATOM 1715 OD1 ASN A 110 2.215 1.711 11.083 1.00 0.00 O ATOM 1716 ND2 ASN A 110 3.898 2.266 9.762 1.00 0.00 N ATOM 0 H ASN A 110 2.848 -2.140 8.278 1.00 0.00 H new ATOM 0 HA ASN A 110 1.417 0.414 8.393 1.00 0.00 H new ATOM 0 HB2 ASN A 110 2.534 -0.699 10.348 1.00 0.00 H new ATOM 0 HB3 ASN A 110 4.072 -0.373 9.574 1.00 0.00 H new ATOM 0 HD21 ASN A 110 3.904 3.218 10.127 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.568 1.991 9.044 1.00 0.00 H new ATOM 1723 N PHE A 111 2.625 0.638 5.959 1.00 0.00 N ATOM 1724 CA PHE A 111 3.243 1.311 4.825 1.00 0.00 C ATOM 1725 C PHE A 111 2.198 2.129 4.090 1.00 0.00 C ATOM 1726 O PHE A 111 1.024 2.135 4.478 1.00 0.00 O ATOM 1727 CB PHE A 111 3.969 0.362 3.855 1.00 0.00 C ATOM 1728 CG PHE A 111 3.122 -0.373 2.818 1.00 0.00 C ATOM 1729 CD1 PHE A 111 1.915 -1.020 3.152 1.00 0.00 C ATOM 1730 CD2 PHE A 111 3.543 -0.362 1.473 1.00 0.00 C ATOM 1731 CE1 PHE A 111 1.153 -1.655 2.157 1.00 0.00 C ATOM 1732 CE2 PHE A 111 2.772 -0.984 0.476 1.00 0.00 C ATOM 1733 CZ PHE A 111 1.579 -1.638 0.819 1.00 0.00 C ATOM 0 H PHE A 111 1.714 0.234 5.743 1.00 0.00 H new ATOM 0 HA PHE A 111 4.017 1.962 5.231 1.00 0.00 H new ATOM 0 HB2 PHE A 111 4.725 0.939 3.323 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.497 -0.385 4.448 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.575 -1.028 4.177 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.467 0.129 1.206 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.235 -2.159 2.422 1.00 0.00 H new ATOM 0 HE2 PHE A 111 3.098 -0.959 -0.553 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.990 -2.127 0.057 1.00 0.00 H new ATOM 1743 N ALA A 112 2.652 2.858 3.069 1.00 0.00 N ATOM 1744 CA ALA A 112 1.799 3.699 2.263 1.00 0.00 C ATOM 1745 C ALA A 112 1.566 3.058 0.894 1.00 0.00 C ATOM 1746 O ALA A 112 0.436 2.664 0.604 1.00 0.00 O ATOM 1747 CB ALA A 112 2.459 5.076 2.177 1.00 0.00 C ATOM 0 H ALA A 112 3.632 2.874 2.785 1.00 0.00 H new ATOM 0 HA ALA A 112 0.811 3.814 2.709 1.00 0.00 H new ATOM 0 HB1 ALA A 112 1.840 5.739 1.573 1.00 0.00 H new ATOM 0 HB2 ALA A 112 2.566 5.491 3.179 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.443 4.980 1.717 1.00 0.00 H new ATOM 1753 N LYS A 113 2.597 2.930 0.055 1.00 0.00 N ATOM 1754 CA LYS A 113 2.530 2.407 -1.314 1.00 0.00 C ATOM 1755 C LYS A 113 3.832 1.698 -1.654 1.00 0.00 C ATOM 1756 O LYS A 113 4.762 1.654 -0.847 1.00 0.00 O ATOM 1757 CB LYS A 113 2.215 3.511 -2.353 1.00 0.00 C ATOM 1758 CG LYS A 113 0.726 3.860 -2.455 1.00 0.00 C ATOM 1759 CD LYS A 113 0.270 5.004 -1.541 1.00 0.00 C ATOM 1760 CE LYS A 113 -1.248 5.009 -1.358 1.00 0.00 C ATOM 1761 NZ LYS A 113 -1.766 3.777 -0.732 1.00 0.00 N ATOM 0 H LYS A 113 3.544 3.200 0.322 1.00 0.00 H new ATOM 0 HA LYS A 113 1.706 1.695 -1.360 1.00 0.00 H new ATOM 0 HB2 LYS A 113 2.772 4.411 -2.093 1.00 0.00 H new ATOM 0 HB3 LYS A 113 2.570 3.188 -3.331 1.00 0.00 H new ATOM 0 HG2 LYS A 113 0.499 4.126 -3.487 1.00 0.00 H new ATOM 0 HG3 LYS A 113 0.142 2.970 -2.220 1.00 0.00 H new ATOM 0 HD2 LYS A 113 0.754 4.908 -0.569 1.00 0.00 H new ATOM 0 HD3 LYS A 113 0.589 5.957 -1.963 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -1.530 5.865 -0.746 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -1.723 5.142 -2.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -2.604 4.004 -0.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -2.028 3.095 -1.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -1.032 3.362 -0.123 1.00 0.00 H new ATOM 1775 N GLU A 114 3.873 1.109 -2.841 1.00 0.00 N ATOM 1776 CA GLU A 114 4.992 0.339 -3.350 1.00 0.00 C ATOM 1777 C GLU A 114 5.523 0.922 -4.653 1.00 0.00 C ATOM 1778 O GLU A 114 4.911 1.833 -5.218 1.00 0.00 O ATOM 1779 CB GLU A 114 4.558 -1.126 -3.482 1.00 0.00 C ATOM 1780 CG GLU A 114 3.547 -1.344 -4.621 1.00 0.00 C ATOM 1781 CD GLU A 114 2.745 -2.639 -4.498 1.00 0.00 C ATOM 1782 OE1 GLU A 114 2.287 -2.977 -3.378 1.00 0.00 O ATOM 1783 OE2 GLU A 114 2.478 -3.264 -5.556 1.00 0.00 O ATOM 0 H GLU A 114 3.095 1.158 -3.499 1.00 0.00 H new ATOM 0 HA GLU A 114 5.827 0.388 -2.651 1.00 0.00 H new ATOM 0 HB2 GLU A 114 5.437 -1.747 -3.657 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.117 -1.456 -2.542 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.856 -0.501 -4.646 1.00 0.00 H new ATOM 0 HG3 GLU A 114 4.081 -1.348 -5.571 1.00 0.00 H new ATOM 1790 N PHE A 115 6.651 0.400 -5.128 1.00 0.00 N ATOM 1791 CA PHE A 115 7.277 0.836 -6.365 1.00 0.00 C ATOM 1792 C PHE A 115 7.890 -0.453 -6.938 1.00 0.00 C ATOM 1793 O PHE A 115 8.315 -1.323 -6.168 1.00 0.00 O ATOM 1794 CB PHE A 115 8.374 1.858 -6.003 1.00 0.00 C ATOM 1795 CG PHE A 115 8.798 2.834 -7.093 1.00 0.00 C ATOM 1796 CD1 PHE A 115 9.262 2.434 -8.362 1.00 0.00 C ATOM 1797 CD2 PHE A 115 8.676 4.210 -6.820 1.00 0.00 C ATOM 1798 CE1 PHE A 115 9.610 3.395 -9.330 1.00 0.00 C ATOM 1799 CE2 PHE A 115 9.019 5.172 -7.782 1.00 0.00 C ATOM 1800 CZ PHE A 115 9.495 4.764 -9.036 1.00 0.00 C ATOM 0 H PHE A 115 7.160 -0.347 -4.655 1.00 0.00 H new ATOM 0 HA PHE A 115 6.600 1.310 -7.076 1.00 0.00 H new ATOM 0 HB2 PHE A 115 8.028 2.437 -5.146 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.257 1.307 -5.680 1.00 0.00 H new ATOM 0 HD1 PHE A 115 9.351 1.383 -8.594 1.00 0.00 H new ATOM 0 HD2 PHE A 115 8.313 4.530 -5.855 1.00 0.00 H new ATOM 0 HE1 PHE A 115 9.966 3.080 -10.300 1.00 0.00 H new ATOM 0 HE2 PHE A 115 8.917 6.223 -7.557 1.00 0.00 H new ATOM 0 HZ PHE A 115 9.773 5.501 -9.775 1.00 0.00 H new ATOM 1810 N VAL A 116 7.967 -0.606 -8.259 1.00 0.00 N ATOM 1811 CA VAL A 116 8.611 -1.754 -8.890 1.00 0.00 C ATOM 1812 C VAL A 116 9.639 -1.182 -9.865 1.00 0.00 C ATOM 1813 O VAL A 116 9.291 -0.358 -10.711 1.00 0.00 O ATOM 1814 CB VAL A 116 7.572 -2.691 -9.530 1.00 0.00 C ATOM 1815 CG1 VAL A 116 8.245 -3.993 -9.968 1.00 0.00 C ATOM 1816 CG2 VAL A 116 6.433 -3.064 -8.565 1.00 0.00 C ATOM 0 H VAL A 116 7.583 0.066 -8.923 1.00 0.00 H new ATOM 0 HA VAL A 116 9.124 -2.392 -8.171 1.00 0.00 H new ATOM 0 HB VAL A 116 7.152 -2.149 -10.377 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.504 -4.652 -10.420 1.00 0.00 H new ATOM 0 HG12 VAL A 116 9.026 -3.772 -10.696 1.00 0.00 H new ATOM 0 HG13 VAL A 116 8.686 -4.484 -9.101 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.730 -3.726 -9.070 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.846 -3.571 -7.693 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.915 -2.159 -8.247 1.00 0.00 H new ATOM 1826 N ILE A 117 10.894 -1.602 -9.743 1.00 0.00 N ATOM 1827 CA ILE A 117 12.038 -1.114 -10.503 1.00 0.00 C ATOM 1828 C ILE A 117 12.683 -2.282 -11.246 1.00 0.00 C ATOM 1829 O ILE A 117 12.755 -3.390 -10.715 1.00 0.00 O ATOM 1830 CB ILE A 117 12.958 -0.419 -9.478 1.00 0.00 C ATOM 1831 CG1 ILE A 117 12.365 0.937 -9.032 1.00 0.00 C ATOM 1832 CG2 ILE A 117 14.362 -0.162 -10.002 1.00 0.00 C ATOM 1833 CD1 ILE A 117 12.128 1.007 -7.527 1.00 0.00 C ATOM 0 H ILE A 117 11.153 -2.330 -9.077 1.00 0.00 H new ATOM 0 HA ILE A 117 11.779 -0.394 -11.279 1.00 0.00 H new ATOM 0 HB ILE A 117 13.024 -1.112 -8.640 1.00 0.00 H new ATOM 0 HG12 ILE A 117 13.041 1.740 -9.327 1.00 0.00 H new ATOM 0 HG13 ILE A 117 11.422 1.106 -9.553 1.00 0.00 H new ATOM 0 HG21 ILE A 117 14.954 0.329 -9.230 1.00 0.00 H new ATOM 0 HG22 ILE A 117 14.829 -1.109 -10.271 1.00 0.00 H new ATOM 0 HG23 ILE A 117 14.310 0.479 -10.882 1.00 0.00 H new ATOM 0 HD11 ILE A 117 11.711 1.981 -7.269 1.00 0.00 H new ATOM 0 HD12 ILE A 117 11.430 0.224 -7.232 1.00 0.00 H new ATOM 0 HD13 ILE A 117 13.073 0.867 -7.003 1.00 0.00 H new ATOM 1845 N SER A 118 13.175 -2.010 -12.458 1.00 0.00 N ATOM 1846 CA SER A 118 13.748 -3.008 -13.355 1.00 0.00 C ATOM 1847 C SER A 118 15.029 -2.561 -14.061 1.00 0.00 C ATOM 1848 O SER A 118 15.583 -3.308 -14.875 1.00 0.00 O ATOM 1849 CB SER A 118 12.660 -3.386 -14.362 1.00 0.00 C ATOM 1850 OG SER A 118 12.091 -2.260 -15.028 1.00 0.00 O ATOM 0 H SER A 118 13.185 -1.068 -12.848 1.00 0.00 H new ATOM 0 HA SER A 118 14.061 -3.866 -12.761 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.082 -4.064 -15.104 1.00 0.00 H new ATOM 0 HB3 SER A 118 11.870 -3.931 -13.845 1.00 0.00 H new ATOM 0 HG SER A 118 11.405 -2.565 -15.658 1.00 0.00 H new ATOM 1856 N ASP A 119 15.503 -1.348 -13.776 1.00 0.00 N ATOM 1857 CA ASP A 119 16.681 -0.773 -14.422 1.00 0.00 C ATOM 1858 C ASP A 119 17.467 0.033 -13.395 1.00 0.00 C ATOM 1859 O ASP A 119 16.874 0.530 -12.437 1.00 0.00 O ATOM 1860 CB ASP A 119 16.224 0.120 -15.583 1.00 0.00 C ATOM 1861 CG ASP A 119 17.382 0.516 -16.488 1.00 0.00 C ATOM 1862 OD1 ASP A 119 18.194 1.367 -16.089 1.00 0.00 O ATOM 1863 OD2 ASP A 119 17.485 -0.054 -17.598 1.00 0.00 O ATOM 0 H ASP A 119 15.076 -0.732 -13.084 1.00 0.00 H new ATOM 0 HA ASP A 119 17.325 -1.559 -14.816 1.00 0.00 H new ATOM 0 HB2 ASP A 119 15.469 -0.405 -16.169 1.00 0.00 H new ATOM 0 HB3 ASP A 119 15.751 1.018 -15.185 1.00 0.00 H new ATOM 1868 N ARG A 120 18.782 0.190 -13.572 1.00 0.00 N ATOM 1869 CA ARG A 120 19.586 1.021 -12.679 1.00 0.00 C ATOM 1870 C ARG A 120 19.116 2.474 -12.743 1.00 0.00 C ATOM 1871 O ARG A 120 19.069 3.131 -11.708 1.00 0.00 O ATOM 1872 CB ARG A 120 21.074 0.875 -13.028 1.00 0.00 C ATOM 1873 CG ARG A 120 21.959 1.750 -12.132 1.00 0.00 C ATOM 1874 CD ARG A 120 23.441 1.529 -12.435 1.00 0.00 C ATOM 1875 NE ARG A 120 24.239 2.605 -11.834 1.00 0.00 N ATOM 1876 CZ ARG A 120 25.215 2.523 -10.928 1.00 0.00 C ATOM 1877 NH1 ARG A 120 25.602 1.370 -10.398 1.00 0.00 N ATOM 1878 NH2 ARG A 120 25.802 3.644 -10.537 1.00 0.00 N ATOM 0 H ARG A 120 19.310 -0.249 -14.326 1.00 0.00 H new ATOM 0 HA ARG A 120 19.456 0.686 -11.650 1.00 0.00 H new ATOM 0 HB2 ARG A 120 21.371 -0.169 -12.924 1.00 0.00 H new ATOM 0 HB3 ARG A 120 21.231 1.148 -14.071 1.00 0.00 H new ATOM 0 HG2 ARG A 120 21.707 2.800 -12.281 1.00 0.00 H new ATOM 0 HG3 ARG A 120 21.761 1.520 -11.085 1.00 0.00 H new ATOM 0 HD2 ARG A 120 23.762 0.564 -12.043 1.00 0.00 H new ATOM 0 HD3 ARG A 120 23.601 1.504 -13.513 1.00 0.00 H new ATOM 0 HE ARG A 120 24.016 3.547 -12.154 1.00 0.00 H new ATOM 0 HH11 ARG A 120 25.149 0.501 -10.681 1.00 0.00 H new ATOM 0 HH12 ARG A 120 26.353 1.352 -9.708 1.00 0.00 H new ATOM 0 HH21 ARG A 120 25.505 4.538 -10.927 1.00 0.00 H new ATOM 0 HH22 ARG A 120 26.551 3.613 -9.846 1.00 0.00 H new ATOM 1892 N LYS A 121 18.750 2.987 -13.921 1.00 0.00 N ATOM 1893 CA LYS A 121 18.211 4.330 -14.047 1.00 0.00 C ATOM 1894 C LYS A 121 16.921 4.429 -13.248 1.00 0.00 C ATOM 1895 O LYS A 121 16.728 5.411 -12.538 1.00 0.00 O ATOM 1896 CB LYS A 121 17.925 4.692 -15.509 1.00 0.00 C ATOM 1897 CG LYS A 121 19.176 4.735 -16.397 1.00 0.00 C ATOM 1898 CD LYS A 121 18.793 5.371 -17.734 1.00 0.00 C ATOM 1899 CE LYS A 121 19.976 5.442 -18.702 1.00 0.00 C ATOM 1900 NZ LYS A 121 19.814 6.579 -19.628 1.00 0.00 N ATOM 0 H LYS A 121 18.821 2.482 -14.804 1.00 0.00 H new ATOM 0 HA LYS A 121 18.955 5.029 -13.664 1.00 0.00 H new ATOM 0 HB2 LYS A 121 17.224 3.967 -15.922 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.434 5.665 -15.543 1.00 0.00 H new ATOM 0 HG2 LYS A 121 19.965 5.312 -15.914 1.00 0.00 H new ATOM 0 HG3 LYS A 121 19.566 3.729 -16.553 1.00 0.00 H new ATOM 0 HD2 LYS A 121 17.987 4.796 -18.190 1.00 0.00 H new ATOM 0 HD3 LYS A 121 18.408 6.376 -17.559 1.00 0.00 H new ATOM 0 HE2 LYS A 121 20.906 5.549 -18.143 1.00 0.00 H new ATOM 0 HE3 LYS A 121 20.049 4.512 -19.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 20.624 6.615 -20.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 18.937 6.460 -20.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 19.767 7.465 -19.085 1.00 0.00 H new ATOM 1914 N GLU A 122 16.047 3.429 -13.378 1.00 0.00 N ATOM 1915 CA GLU A 122 14.758 3.355 -12.697 1.00 0.00 C ATOM 1916 C GLU A 122 14.943 3.302 -11.169 1.00 0.00 C ATOM 1917 O GLU A 122 14.035 3.664 -10.433 1.00 0.00 O ATOM 1918 CB GLU A 122 13.987 2.134 -13.236 1.00 0.00 C ATOM 1919 CG GLU A 122 12.492 2.033 -12.884 1.00 0.00 C ATOM 1920 CD GLU A 122 11.577 2.746 -13.885 1.00 0.00 C ATOM 1921 OE1 GLU A 122 11.950 3.813 -14.424 1.00 0.00 O ATOM 1922 OE2 GLU A 122 10.483 2.207 -14.189 1.00 0.00 O ATOM 0 H GLU A 122 16.225 2.625 -13.979 1.00 0.00 H new ATOM 0 HA GLU A 122 14.176 4.254 -12.901 1.00 0.00 H new ATOM 0 HB2 GLU A 122 14.079 2.129 -14.322 1.00 0.00 H new ATOM 0 HB3 GLU A 122 14.481 1.234 -12.870 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.210 0.981 -12.832 1.00 0.00 H new ATOM 0 HG3 GLU A 122 12.331 2.456 -11.892 1.00 0.00 H new ATOM 1929 N LEU A 123 16.105 2.847 -10.691 1.00 0.00 N ATOM 1930 CA LEU A 123 16.438 2.651 -9.282 1.00 0.00 C ATOM 1931 C LEU A 123 16.919 3.932 -8.597 1.00 0.00 C ATOM 1932 O LEU A 123 16.852 4.021 -7.370 1.00 0.00 O ATOM 1933 CB LEU A 123 17.494 1.523 -9.227 1.00 0.00 C ATOM 1934 CG LEU A 123 17.898 0.883 -7.891 1.00 0.00 C ATOM 1935 CD1 LEU A 123 18.995 1.647 -7.153 1.00 0.00 C ATOM 1936 CD2 LEU A 123 16.706 0.546 -6.993 1.00 0.00 C ATOM 0 H LEU A 123 16.876 2.594 -11.309 1.00 0.00 H new ATOM 0 HA LEU A 123 15.545 2.370 -8.724 1.00 0.00 H new ATOM 0 HB2 LEU A 123 17.137 0.719 -9.871 1.00 0.00 H new ATOM 0 HB3 LEU A 123 18.404 1.915 -9.681 1.00 0.00 H new ATOM 0 HG LEU A 123 18.342 -0.074 -8.166 1.00 0.00 H new ATOM 0 HD11 LEU A 123 19.228 1.137 -6.219 1.00 0.00 H new ATOM 0 HD12 LEU A 123 19.889 1.692 -7.775 1.00 0.00 H new ATOM 0 HD13 LEU A 123 18.652 2.659 -6.938 1.00 0.00 H new ATOM 0 HD21 LEU A 123 17.064 0.097 -6.066 1.00 0.00 H new ATOM 0 HD22 LEU A 123 16.153 1.457 -6.765 1.00 0.00 H new ATOM 0 HD23 LEU A 123 16.050 -0.157 -7.507 1.00 0.00 H new ATOM 1948 N GLU A 124 17.444 4.901 -9.346 1.00 0.00 N ATOM 1949 CA GLU A 124 18.010 6.116 -8.773 1.00 0.00 C ATOM 1950 C GLU A 124 16.962 6.940 -8.016 1.00 0.00 C ATOM 1951 O GLU A 124 15.957 7.371 -8.583 1.00 0.00 O ATOM 1952 CB GLU A 124 18.692 6.954 -9.861 1.00 0.00 C ATOM 1953 CG GLU A 124 19.940 6.238 -10.418 1.00 0.00 C ATOM 1954 CD GLU A 124 21.100 7.178 -10.753 1.00 0.00 C ATOM 1955 OE1 GLU A 124 21.289 8.217 -10.078 1.00 0.00 O ATOM 1956 OE2 GLU A 124 21.869 6.895 -11.700 1.00 0.00 O ATOM 0 H GLU A 124 17.488 4.864 -10.364 1.00 0.00 H new ATOM 0 HA GLU A 124 18.762 5.816 -8.043 1.00 0.00 H new ATOM 0 HB2 GLU A 124 17.988 7.146 -10.671 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.978 7.923 -9.451 1.00 0.00 H new ATOM 0 HG2 GLU A 124 20.280 5.503 -9.688 1.00 0.00 H new ATOM 0 HG3 GLU A 124 19.660 5.689 -11.317 1.00 0.00 H new ATOM 1963 N GLU A 125 17.231 7.227 -6.739 1.00 0.00 N ATOM 1964 CA GLU A 125 16.298 7.940 -5.873 1.00 0.00 C ATOM 1965 C GLU A 125 15.959 9.341 -6.377 1.00 0.00 C ATOM 1966 O GLU A 125 14.871 9.837 -6.087 1.00 0.00 O ATOM 1967 CB GLU A 125 16.851 8.047 -4.441 1.00 0.00 C ATOM 1968 CG GLU A 125 16.622 6.773 -3.621 1.00 0.00 C ATOM 1969 CD GLU A 125 15.322 6.812 -2.812 1.00 0.00 C ATOM 1970 OE1 GLU A 125 15.356 7.332 -1.671 1.00 0.00 O ATOM 1971 OE2 GLU A 125 14.301 6.279 -3.298 1.00 0.00 O ATOM 0 H GLU A 125 18.104 6.969 -6.279 1.00 0.00 H new ATOM 0 HA GLU A 125 15.381 7.351 -5.881 1.00 0.00 H new ATOM 0 HB2 GLU A 125 17.919 8.259 -4.484 1.00 0.00 H new ATOM 0 HB3 GLU A 125 16.378 8.889 -3.936 1.00 0.00 H new ATOM 0 HG2 GLU A 125 16.601 5.914 -4.292 1.00 0.00 H new ATOM 0 HG3 GLU A 125 17.462 6.628 -2.942 1.00 0.00 H new ATOM 1978 N ASP A 126 16.838 9.986 -7.151 1.00 0.00 N ATOM 1979 CA ASP A 126 16.596 11.361 -7.567 1.00 0.00 C ATOM 1980 C ASP A 126 15.284 11.589 -8.311 1.00 0.00 C ATOM 1981 O ASP A 126 14.579 12.557 -7.995 1.00 0.00 O ATOM 1982 CB ASP A 126 17.752 11.978 -8.353 1.00 0.00 C ATOM 1983 CG ASP A 126 17.510 13.489 -8.432 1.00 0.00 C ATOM 1984 OD1 ASP A 126 17.165 14.093 -7.390 1.00 0.00 O ATOM 1985 OD2 ASP A 126 17.628 14.087 -9.526 1.00 0.00 O ATOM 0 H ASP A 126 17.709 9.581 -7.495 1.00 0.00 H new ATOM 0 HA ASP A 126 16.513 11.881 -6.613 1.00 0.00 H new ATOM 0 HB2 ASP A 126 18.703 11.768 -7.862 1.00 0.00 H new ATOM 0 HB3 ASP A 126 17.807 11.547 -9.353 1.00 0.00 H new ATOM 1990 N PHE A 127 14.935 10.727 -9.277 1.00 0.00 N ATOM 1991 CA PHE A 127 13.662 10.913 -9.973 1.00 0.00 C ATOM 1992 C PHE A 127 12.564 10.150 -9.223 1.00 0.00 C ATOM 1993 O PHE A 127 11.407 10.550 -9.332 1.00 0.00 O ATOM 1994 CB PHE A 127 13.673 10.512 -11.454 1.00 0.00 C ATOM 1995 CG PHE A 127 13.499 9.033 -11.712 1.00 0.00 C ATOM 1996 CD1 PHE A 127 14.379 8.091 -11.164 1.00 0.00 C ATOM 1997 CD2 PHE A 127 12.328 8.599 -12.366 1.00 0.00 C ATOM 1998 CE1 PHE A 127 14.071 6.727 -11.235 1.00 0.00 C ATOM 1999 CE2 PHE A 127 12.014 7.234 -12.430 1.00 0.00 C ATOM 2000 CZ PHE A 127 12.879 6.298 -11.847 1.00 0.00 C ATOM 0 H PHE A 127 15.491 9.928 -9.582 1.00 0.00 H new ATOM 0 HA PHE A 127 13.467 11.985 -9.973 1.00 0.00 H new ATOM 0 HB2 PHE A 127 12.878 11.052 -11.968 1.00 0.00 H new ATOM 0 HB3 PHE A 127 14.615 10.835 -11.896 1.00 0.00 H new ATOM 0 HD1 PHE A 127 15.292 8.416 -10.688 1.00 0.00 H new ATOM 0 HD2 PHE A 127 11.668 9.323 -12.821 1.00 0.00 H new ATOM 0 HE1 PHE A 127 14.752 6.000 -10.818 1.00 0.00 H new ATOM 0 HE2 PHE A 127 11.112 6.906 -12.925 1.00 0.00 H new ATOM 0 HZ PHE A 127 12.631 5.247 -11.868 1.00 0.00 H new ATOM 2010 N ILE A 128 12.903 9.103 -8.453 1.00 0.00 N ATOM 2011 CA ILE A 128 11.945 8.365 -7.619 1.00 0.00 C ATOM 2012 C ILE A 128 11.296 9.387 -6.690 1.00 0.00 C ATOM 2013 O ILE A 128 10.087 9.348 -6.505 1.00 0.00 O ATOM 2014 CB ILE A 128 12.596 7.204 -6.835 1.00 0.00 C ATOM 2015 CG1 ILE A 128 12.845 6.002 -7.770 1.00 0.00 C ATOM 2016 CG2 ILE A 128 11.770 6.770 -5.607 1.00 0.00 C ATOM 2017 CD1 ILE A 128 13.522 4.814 -7.075 1.00 0.00 C ATOM 0 H ILE A 128 13.856 8.744 -8.393 1.00 0.00 H new ATOM 0 HA ILE A 128 11.199 7.881 -8.250 1.00 0.00 H new ATOM 0 HB ILE A 128 13.548 7.574 -6.455 1.00 0.00 H new ATOM 0 HG12 ILE A 128 11.893 5.674 -8.188 1.00 0.00 H new ATOM 0 HG13 ILE A 128 13.465 6.325 -8.606 1.00 0.00 H new ATOM 0 HG21 ILE A 128 12.278 5.951 -5.097 1.00 0.00 H new ATOM 0 HG22 ILE A 128 11.664 7.613 -4.924 1.00 0.00 H new ATOM 0 HG23 ILE A 128 10.783 6.439 -5.931 1.00 0.00 H new ATOM 0 HD11 ILE A 128 13.666 4.006 -7.793 1.00 0.00 H new ATOM 0 HD12 ILE A 128 14.489 5.126 -6.681 1.00 0.00 H new ATOM 0 HD13 ILE A 128 12.893 4.465 -6.256 1.00 0.00 H new ATOM 2029 N LYS A 129 12.065 10.333 -6.143 1.00 0.00 N ATOM 2030 CA LYS A 129 11.536 11.409 -5.317 1.00 0.00 C ATOM 2031 C LYS A 129 10.427 12.141 -6.055 1.00 0.00 C ATOM 2032 O LYS A 129 9.339 12.273 -5.511 1.00 0.00 O ATOM 2033 CB LYS A 129 12.664 12.376 -4.930 1.00 0.00 C ATOM 2034 CG LYS A 129 13.613 11.868 -3.834 1.00 0.00 C ATOM 2035 CD LYS A 129 15.058 12.388 -3.926 1.00 0.00 C ATOM 2036 CE LYS A 129 15.248 13.906 -4.068 1.00 0.00 C ATOM 2037 NZ LYS A 129 15.119 14.403 -5.459 1.00 0.00 N ATOM 0 H LYS A 129 13.077 10.369 -6.265 1.00 0.00 H new ATOM 0 HA LYS A 129 11.116 10.985 -4.405 1.00 0.00 H new ATOM 0 HB2 LYS A 129 13.251 12.600 -5.821 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.219 13.314 -4.597 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.204 12.148 -2.863 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.633 10.779 -3.869 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.592 12.062 -3.033 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.537 11.906 -4.778 1.00 0.00 H new ATOM 0 HE2 LYS A 129 14.514 14.414 -3.442 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.233 14.176 -3.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 15.578 15.333 -5.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.576 13.734 -6.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.112 14.492 -5.704 1.00 0.00 H new ATOM 2051 N SER A 130 10.672 12.595 -7.280 1.00 0.00 N ATOM 2052 CA SER A 130 9.701 13.336 -8.070 1.00 0.00 C ATOM 2053 C SER A 130 8.494 12.454 -8.434 1.00 0.00 C ATOM 2054 O SER A 130 7.357 12.931 -8.410 1.00 0.00 O ATOM 2055 CB SER A 130 10.433 13.879 -9.296 1.00 0.00 C ATOM 2056 OG SER A 130 9.714 14.857 -10.016 1.00 0.00 O ATOM 0 H SER A 130 11.563 12.456 -7.756 1.00 0.00 H new ATOM 0 HA SER A 130 9.286 14.169 -7.502 1.00 0.00 H new ATOM 0 HB2 SER A 130 11.384 14.305 -8.977 1.00 0.00 H new ATOM 0 HB3 SER A 130 10.664 13.049 -9.964 1.00 0.00 H new ATOM 0 HG SER A 130 10.246 15.156 -10.783 1.00 0.00 H new ATOM 2062 N GLU A 131 8.723 11.175 -8.733 1.00 0.00 N ATOM 2063 CA GLU A 131 7.707 10.176 -9.050 1.00 0.00 C ATOM 2064 C GLU A 131 6.778 10.010 -7.841 1.00 0.00 C ATOM 2065 O GLU A 131 5.559 10.190 -7.933 1.00 0.00 O ATOM 2066 CB GLU A 131 8.444 8.878 -9.462 1.00 0.00 C ATOM 2067 CG GLU A 131 7.579 7.736 -10.004 1.00 0.00 C ATOM 2068 CD GLU A 131 6.620 8.208 -11.094 1.00 0.00 C ATOM 2069 OE1 GLU A 131 7.091 8.767 -12.114 1.00 0.00 O ATOM 2070 OE2 GLU A 131 5.390 8.067 -10.917 1.00 0.00 O ATOM 0 H GLU A 131 9.668 10.791 -8.762 1.00 0.00 H new ATOM 0 HA GLU A 131 7.069 10.471 -9.883 1.00 0.00 H new ATOM 0 HB2 GLU A 131 9.184 9.133 -10.221 1.00 0.00 H new ATOM 0 HB3 GLU A 131 8.991 8.508 -8.595 1.00 0.00 H new ATOM 0 HG2 GLU A 131 8.223 6.952 -10.403 1.00 0.00 H new ATOM 0 HG3 GLU A 131 7.009 7.295 -9.187 1.00 0.00 H new ATOM 2077 N LEU A 132 7.369 9.735 -6.676 1.00 0.00 N ATOM 2078 CA LEU A 132 6.687 9.622 -5.401 1.00 0.00 C ATOM 2079 C LEU A 132 6.031 10.946 -5.040 1.00 0.00 C ATOM 2080 O LEU A 132 4.961 10.901 -4.457 1.00 0.00 O ATOM 2081 CB LEU A 132 7.646 9.163 -4.287 1.00 0.00 C ATOM 2082 CG LEU A 132 8.071 7.683 -4.390 1.00 0.00 C ATOM 2083 CD1 LEU A 132 9.120 7.360 -3.327 1.00 0.00 C ATOM 2084 CD2 LEU A 132 6.885 6.733 -4.181 1.00 0.00 C ATOM 0 H LEU A 132 8.374 9.580 -6.601 1.00 0.00 H new ATOM 0 HA LEU A 132 5.913 8.861 -5.497 1.00 0.00 H new ATOM 0 HB2 LEU A 132 8.538 9.788 -4.310 1.00 0.00 H new ATOM 0 HB3 LEU A 132 7.168 9.326 -3.321 1.00 0.00 H new ATOM 0 HG LEU A 132 8.475 7.540 -5.392 1.00 0.00 H new ATOM 0 HD11 LEU A 132 9.412 6.313 -3.410 1.00 0.00 H new ATOM 0 HD12 LEU A 132 9.995 7.993 -3.475 1.00 0.00 H new ATOM 0 HD13 LEU A 132 8.703 7.543 -2.337 1.00 0.00 H new ATOM 0 HD21 LEU A 132 7.227 5.701 -4.261 1.00 0.00 H new ATOM 0 HD22 LEU A 132 6.457 6.897 -3.192 1.00 0.00 H new ATOM 0 HD23 LEU A 132 6.127 6.924 -4.941 1.00 0.00 H new ATOM 2096 N LYS A 133 6.607 12.104 -5.384 1.00 0.00 N ATOM 2097 CA LYS A 133 6.005 13.416 -5.157 1.00 0.00 C ATOM 2098 C LYS A 133 4.685 13.537 -5.904 1.00 0.00 C ATOM 2099 O LYS A 133 3.703 13.919 -5.273 1.00 0.00 O ATOM 2100 CB LYS A 133 6.962 14.573 -5.509 1.00 0.00 C ATOM 2101 CG LYS A 133 7.990 14.916 -4.411 1.00 0.00 C ATOM 2102 CD LYS A 133 8.059 16.421 -4.109 1.00 0.00 C ATOM 2103 CE LYS A 133 6.742 16.931 -3.506 1.00 0.00 C ATOM 2104 NZ LYS A 133 6.028 17.871 -4.397 1.00 0.00 N ATOM 0 H LYS A 133 7.520 12.153 -5.836 1.00 0.00 H new ATOM 0 HA LYS A 133 5.804 13.499 -4.089 1.00 0.00 H new ATOM 0 HB2 LYS A 133 7.498 14.318 -6.423 1.00 0.00 H new ATOM 0 HB3 LYS A 133 6.371 15.463 -5.725 1.00 0.00 H new ATOM 0 HG2 LYS A 133 7.733 14.378 -3.498 1.00 0.00 H new ATOM 0 HG3 LYS A 133 8.975 14.567 -4.720 1.00 0.00 H new ATOM 0 HD2 LYS A 133 8.878 16.618 -3.417 1.00 0.00 H new ATOM 0 HD3 LYS A 133 8.277 16.968 -5.026 1.00 0.00 H new ATOM 0 HE2 LYS A 133 6.095 16.081 -3.288 1.00 0.00 H new ATOM 0 HE3 LYS A 133 6.950 17.425 -2.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 5.012 17.856 -4.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.399 18.832 -4.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.170 17.586 -5.387 1.00 0.00 H new ATOM 2118 N LYS A 134 4.612 13.224 -7.204 1.00 0.00 N ATOM 2119 CA LYS A 134 3.338 13.323 -7.930 1.00 0.00 C ATOM 2120 C LYS A 134 2.333 12.362 -7.306 1.00 0.00 C ATOM 2121 O LYS A 134 1.222 12.761 -6.962 1.00 0.00 O ATOM 2122 CB LYS A 134 3.502 13.069 -9.438 1.00 0.00 C ATOM 2123 CG LYS A 134 4.478 14.073 -10.066 1.00 0.00 C ATOM 2124 CD LYS A 134 4.497 14.053 -11.596 1.00 0.00 C ATOM 2125 CE LYS A 134 3.485 15.034 -12.193 1.00 0.00 C ATOM 2126 NZ LYS A 134 3.762 15.289 -13.619 1.00 0.00 N ATOM 0 H LYS A 134 5.402 12.906 -7.766 1.00 0.00 H new ATOM 0 HA LYS A 134 2.967 14.344 -7.839 1.00 0.00 H new ATOM 0 HB2 LYS A 134 3.865 12.054 -9.601 1.00 0.00 H new ATOM 0 HB3 LYS A 134 2.532 13.144 -9.930 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.217 15.076 -9.730 1.00 0.00 H new ATOM 0 HG3 LYS A 134 5.483 13.865 -9.698 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.497 14.303 -11.950 1.00 0.00 H new ATOM 0 HD3 LYS A 134 4.277 13.045 -11.949 1.00 0.00 H new ATOM 0 HE2 LYS A 134 2.478 14.633 -12.082 1.00 0.00 H new ATOM 0 HE3 LYS A 134 3.517 15.973 -11.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 3.059 15.957 -13.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 4.714 15.694 -13.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 3.708 14.395 -14.148 1.00 0.00 H new ATOM 2140 N ALA A 135 2.732 11.106 -7.112 1.00 0.00 N ATOM 2141 CA ALA A 135 1.931 10.084 -6.447 1.00 0.00 C ATOM 2142 C ALA A 135 1.911 10.272 -4.911 1.00 0.00 C ATOM 2143 O ALA A 135 1.536 9.352 -4.175 1.00 0.00 O ATOM 2144 CB ALA A 135 2.507 8.720 -6.847 1.00 0.00 C ATOM 0 H ALA A 135 3.642 10.765 -7.421 1.00 0.00 H new ATOM 0 HA ALA A 135 0.890 10.161 -6.762 1.00 0.00 H new ATOM 0 HB1 ALA A 135 1.932 7.928 -6.368 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.451 8.605 -7.929 1.00 0.00 H new ATOM 0 HB3 ALA A 135 3.548 8.657 -6.529 1.00 0.00 H new