USER MOD reduce.3.24.130724 H: found=0, std=0, add=1003, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1005 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 42 THR OG1 : rot -142:sc= 1.15 USER MOD Set 1.2: B 67 SER OG : rot -12:sc= 2.11 USER MOD Single : A 8 SER OG : rot -80:sc= 1.26 USER MOD Single : A 9 ASN : amide:sc= -0.0644 X(o=-0.064,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.0298 K(o=-0.03,f=-0.57) USER MOD Single : A 25 LYS NZ :NH3+ -167:sc= 1.09 (180deg=0.919) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.00449 USER MOD Single : A 35 MET CE :methyl 164:sc= -0.0804 (180deg=-0.516) USER MOD Single : A 36 CYS SG : rot 78:sc= -0.294 USER MOD Single : A 39 ASN : amide:sc= 1.2 K(o=1.2,f=-0.0018) USER MOD Single : A 43 ASN : amide:sc=-0.00874 X(o=-0.0087,f=0) USER MOD Single : A 47 GLN : amide:sc= 0.475 K(o=0.47,f=-0.47) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0278) USER MOD Single : A 59 ASN : amide:sc= -0.0904 K(o=-0.09,f=-1.2!) USER MOD Single : A 61 THR OG1 : rot -81:sc= 1.18 USER MOD Single : A 62 LYS NZ :NH3+ -162:sc= -0.0394 (180deg=-0.295) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 GLN : amide:sc= -1.93! K(o=-1.9!,f=-0.66) USER MOD Single : A 67 SER OG : rot 74:sc= 0.807 USER MOD Single : B 8 SER OG : rot -19:sc= 0.317 USER MOD Single : B 9 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 14 LYS NZ :NH3+ 161:sc= 1.26 (180deg=1.11) USER MOD Single : B 17 GLN : amide:sc= 0.393 X(o=0.39,f=-0.1) USER MOD Single : B 25 LYS NZ :NH3+ -170:sc= 1.84 (180deg=1.64) USER MOD Single : B 29 THR OG1 : rot 180:sc= -2.21! USER MOD Single : B 35 MET CE :methyl 154:sc= -0.897 (180deg=-1.69) USER MOD Single : B 36 CYS SG : rot -85:sc= -1.03 USER MOD Single : B 39 ASN : amide:sc= -0.135 X(o=-0.14,f=-0.52) USER MOD Single : B 42 THR OG1 : rot 77:sc= 1.19 USER MOD Single : B 43 ASN : amide:sc= -0.685! X(o=-0.68!,f=-0.19) USER MOD Single : B 47 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 ASN : amide:sc= 1.16 K(o=1.2,f=-0.034) USER MOD Single : B 61 THR OG1 : rot -84:sc= 0.968 USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 LYS NZ :NH3+ -107:sc= -0.922 (180deg=-3.16!) USER MOD Single : B 66 GLN : amide:sc= -0.723 K(o=-0.72,f=0) USER MOD ----------------------------------------------------------------- ATOM 123 N SER A 8 -15.916 -10.380 0.432 1.00 0.00 N ATOM 124 CA SER A 8 -17.080 -9.596 0.057 1.00 0.00 C ATOM 125 C SER A 8 -16.695 -8.124 -0.080 1.00 0.00 C ATOM 126 O SER A 8 -15.690 -7.687 0.486 1.00 0.00 O ATOM 127 CB SER A 8 -18.190 -9.768 1.100 1.00 0.00 C ATOM 128 OG SER A 8 -19.456 -9.424 0.563 1.00 0.00 O ATOM 0 HA SER A 8 -17.453 -9.949 -0.905 1.00 0.00 H new ATOM 0 HB2 SER A 8 -18.208 -10.801 1.448 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.978 -9.143 1.967 1.00 0.00 H new ATOM 0 HG SER A 8 -19.557 -8.449 0.561 1.00 0.00 H new ATOM 134 N ASN A 9 -17.501 -7.366 -0.819 1.00 0.00 N ATOM 135 CA ASN A 9 -17.213 -5.958 -1.098 1.00 0.00 C ATOM 136 C ASN A 9 -17.152 -5.143 0.190 1.00 0.00 C ATOM 137 O ASN A 9 -16.240 -4.339 0.385 1.00 0.00 O ATOM 138 CB ASN A 9 -18.285 -5.374 -2.025 1.00 0.00 C ATOM 139 CG ASN A 9 -17.953 -3.972 -2.508 1.00 0.00 C ATOM 140 OD1 ASN A 9 -17.332 -3.796 -3.556 1.00 0.00 O ATOM 141 ND2 ASN A 9 -18.366 -2.964 -1.758 1.00 0.00 N ATOM 0 H ASN A 9 -18.366 -7.705 -1.239 1.00 0.00 H new ATOM 0 HA ASN A 9 -16.240 -5.905 -1.587 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -18.408 -6.030 -2.887 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -19.240 -5.355 -1.500 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -18.172 -2.004 -2.042 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -18.878 -3.147 -0.895 1.00 0.00 H new ATOM 148 N GLU A 10 -18.123 -5.372 1.069 1.00 0.00 N ATOM 149 CA GLU A 10 -18.219 -4.653 2.336 1.00 0.00 C ATOM 150 C GLU A 10 -16.980 -4.905 3.186 1.00 0.00 C ATOM 151 O GLU A 10 -16.527 -4.028 3.923 1.00 0.00 O ATOM 152 CB GLU A 10 -19.471 -5.082 3.114 1.00 0.00 C ATOM 153 CG GLU A 10 -20.737 -5.156 2.270 1.00 0.00 C ATOM 154 CD GLU A 10 -20.959 -6.528 1.667 1.00 0.00 C ATOM 155 OE1 GLU A 10 -20.162 -6.941 0.801 1.00 0.00 O ATOM 156 OE2 GLU A 10 -21.927 -7.206 2.066 1.00 0.00 O ATOM 0 H GLU A 10 -18.863 -6.059 0.924 1.00 0.00 H new ATOM 0 HA GLU A 10 -18.291 -3.589 2.112 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -19.289 -6.059 3.562 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -19.634 -4.381 3.933 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -21.596 -4.892 2.887 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -20.679 -4.417 1.471 1.00 0.00 H new ATOM 163 N ARG A 11 -16.435 -6.110 3.068 1.00 0.00 N ATOM 164 CA ARG A 11 -15.227 -6.478 3.785 1.00 0.00 C ATOM 165 C ARG A 11 -14.049 -5.677 3.254 1.00 0.00 C ATOM 166 O ARG A 11 -13.250 -5.152 4.022 1.00 0.00 O ATOM 167 CB ARG A 11 -14.966 -7.980 3.645 1.00 0.00 C ATOM 168 CG ARG A 11 -13.809 -8.483 4.487 1.00 0.00 C ATOM 169 CD ARG A 11 -13.790 -10.000 4.545 1.00 0.00 C ATOM 170 NE ARG A 11 -12.819 -10.499 5.516 1.00 0.00 N ATOM 171 CZ ARG A 11 -13.150 -11.044 6.687 1.00 0.00 C ATOM 172 NH1 ARG A 11 -14.428 -11.179 7.031 1.00 0.00 N ATOM 173 NH2 ARG A 11 -12.205 -11.459 7.516 1.00 0.00 N ATOM 0 H ARG A 11 -16.815 -6.850 2.478 1.00 0.00 H new ATOM 0 HA ARG A 11 -15.356 -6.251 4.843 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.869 -8.523 3.924 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.767 -8.208 2.598 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.869 -8.121 4.071 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -13.888 -8.079 5.496 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -14.783 -10.365 4.805 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -13.553 -10.398 3.558 1.00 0.00 H new ATOM 0 HE ARG A 11 -11.828 -10.426 5.284 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -15.163 -10.865 6.397 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -14.673 -11.597 7.929 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -11.223 -11.362 7.259 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -12.459 -11.876 8.412 1.00 0.00 H new ATOM 187 N VAL A 12 -13.969 -5.570 1.929 1.00 0.00 N ATOM 188 CA VAL A 12 -12.930 -4.779 1.283 1.00 0.00 C ATOM 189 C VAL A 12 -12.956 -3.344 1.802 1.00 0.00 C ATOM 190 O VAL A 12 -11.927 -2.808 2.221 1.00 0.00 O ATOM 191 CB VAL A 12 -13.105 -4.763 -0.251 1.00 0.00 C ATOM 192 CG1 VAL A 12 -11.978 -3.990 -0.922 1.00 0.00 C ATOM 193 CG2 VAL A 12 -13.185 -6.178 -0.800 1.00 0.00 C ATOM 0 H VAL A 12 -14.615 -6.024 1.282 1.00 0.00 H new ATOM 0 HA VAL A 12 -11.972 -5.242 1.521 1.00 0.00 H new ATOM 0 HB VAL A 12 -14.043 -4.255 -0.475 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -12.126 -3.995 -2.002 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -11.976 -2.962 -0.560 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -11.023 -4.459 -0.685 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -13.308 -6.142 -1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -12.268 -6.715 -0.557 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -14.036 -6.693 -0.355 1.00 0.00 H new ATOM 203 N GLU A 13 -14.148 -2.743 1.788 1.00 0.00 N ATOM 204 CA GLU A 13 -14.341 -1.374 2.262 1.00 0.00 C ATOM 205 C GLU A 13 -13.889 -1.224 3.714 1.00 0.00 C ATOM 206 O GLU A 13 -13.186 -0.274 4.062 1.00 0.00 O ATOM 207 CB GLU A 13 -15.816 -0.972 2.144 1.00 0.00 C ATOM 208 CG GLU A 13 -16.366 -1.038 0.728 1.00 0.00 C ATOM 209 CD GLU A 13 -17.804 -0.561 0.636 1.00 0.00 C ATOM 210 OE1 GLU A 13 -18.022 0.664 0.529 1.00 0.00 O ATOM 211 OE2 GLU A 13 -18.726 -1.406 0.669 1.00 0.00 O ATOM 0 H GLU A 13 -15.000 -3.190 1.450 1.00 0.00 H new ATOM 0 HA GLU A 13 -13.734 -0.719 1.638 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -16.411 -1.623 2.784 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -15.936 0.043 2.522 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -15.743 -0.430 0.072 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -16.304 -2.064 0.366 1.00 0.00 H new ATOM 218 N LYS A 14 -14.289 -2.178 4.547 1.00 0.00 N ATOM 219 CA LYS A 14 -13.969 -2.149 5.969 1.00 0.00 C ATOM 220 C LYS A 14 -12.461 -2.131 6.194 1.00 0.00 C ATOM 221 O LYS A 14 -11.947 -1.306 6.949 1.00 0.00 O ATOM 222 CB LYS A 14 -14.580 -3.360 6.675 1.00 0.00 C ATOM 223 CG LYS A 14 -14.337 -3.378 8.174 1.00 0.00 C ATOM 224 CD LYS A 14 -14.856 -4.656 8.807 1.00 0.00 C ATOM 225 CE LYS A 14 -14.677 -4.636 10.313 1.00 0.00 C ATOM 226 NZ LYS A 14 -15.098 -5.914 10.942 1.00 0.00 N ATOM 0 H LYS A 14 -14.840 -2.987 4.259 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.391 -1.235 6.387 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -15.654 -3.374 6.490 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -14.169 -4.270 6.238 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -13.270 -3.280 8.372 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -14.826 -2.519 8.633 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -15.911 -4.782 8.566 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -14.329 -5.513 8.387 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -13.631 -4.443 10.551 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -15.257 -3.816 10.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.959 -5.857 11.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -16.103 -6.087 10.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.527 -6.694 10.558 1.00 0.00 H new ATOM 240 N ILE A 15 -11.760 -3.038 5.523 1.00 0.00 N ATOM 241 CA ILE A 15 -10.314 -3.151 5.665 1.00 0.00 C ATOM 242 C ILE A 15 -9.627 -1.847 5.271 1.00 0.00 C ATOM 243 O ILE A 15 -8.733 -1.370 5.968 1.00 0.00 O ATOM 244 CB ILE A 15 -9.759 -4.305 4.809 1.00 0.00 C ATOM 245 CG1 ILE A 15 -10.473 -5.609 5.162 1.00 0.00 C ATOM 246 CG2 ILE A 15 -8.256 -4.448 5.016 1.00 0.00 C ATOM 247 CD1 ILE A 15 -10.183 -6.739 4.202 1.00 0.00 C ATOM 0 H ILE A 15 -12.172 -3.708 4.873 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.105 -3.362 6.714 1.00 0.00 H new ATOM 0 HB ILE A 15 -9.940 -4.079 3.758 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -10.180 -5.913 6.167 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -11.548 -5.430 5.184 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.881 -5.268 4.404 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.759 -3.522 4.727 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.052 -4.656 6.066 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -10.724 -7.631 4.517 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -10.503 -6.456 3.199 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -9.113 -6.946 4.197 1.00 0.00 H new ATOM 259 N ILE A 16 -10.067 -1.267 4.160 1.00 0.00 N ATOM 260 CA ILE A 16 -9.515 -0.004 3.687 1.00 0.00 C ATOM 261 C ILE A 16 -9.704 1.089 4.735 1.00 0.00 C ATOM 262 O ILE A 16 -8.767 1.817 5.067 1.00 0.00 O ATOM 263 CB ILE A 16 -10.176 0.440 2.363 1.00 0.00 C ATOM 264 CG1 ILE A 16 -9.998 -0.636 1.291 1.00 0.00 C ATOM 265 CG2 ILE A 16 -9.584 1.760 1.888 1.00 0.00 C ATOM 266 CD1 ILE A 16 -10.778 -0.366 0.022 1.00 0.00 C ATOM 0 H ILE A 16 -10.805 -1.652 3.570 1.00 0.00 H new ATOM 0 HA ILE A 16 -8.451 -0.161 3.510 1.00 0.00 H new ATOM 0 HB ILE A 16 -11.242 0.582 2.541 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -8.939 -0.720 1.045 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -10.308 -1.598 1.699 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -10.061 2.058 0.954 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -9.754 2.528 2.643 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -8.513 1.641 1.726 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -10.602 -1.171 -0.691 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -11.842 -0.312 0.253 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -10.452 0.580 -0.411 1.00 0.00 H new ATOM 278 N GLN A 17 -10.917 1.178 5.269 1.00 0.00 N ATOM 279 CA GLN A 17 -11.243 2.188 6.266 1.00 0.00 C ATOM 280 C GLN A 17 -10.435 1.975 7.545 1.00 0.00 C ATOM 281 O GLN A 17 -9.972 2.933 8.159 1.00 0.00 O ATOM 282 CB GLN A 17 -12.740 2.159 6.587 1.00 0.00 C ATOM 283 CG GLN A 17 -13.173 3.228 7.580 1.00 0.00 C ATOM 284 CD GLN A 17 -13.004 4.638 7.044 1.00 0.00 C ATOM 285 OE1 GLN A 17 -13.122 4.882 5.843 1.00 0.00 O ATOM 286 NE2 GLN A 17 -12.722 5.577 7.933 1.00 0.00 N ATOM 0 H GLN A 17 -11.692 0.561 5.027 1.00 0.00 H new ATOM 0 HA GLN A 17 -10.986 3.163 5.852 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.303 2.285 5.662 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -12.998 1.178 6.987 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -14.218 3.069 7.844 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -12.593 3.121 8.496 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -12.632 5.335 8.920 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -12.594 6.543 7.631 1.00 0.00 H new ATOM 295 N ASP A 18 -10.260 0.715 7.934 1.00 0.00 N ATOM 296 CA ASP A 18 -9.532 0.385 9.158 1.00 0.00 C ATOM 297 C ASP A 18 -8.048 0.716 9.002 1.00 0.00 C ATOM 298 O ASP A 18 -7.396 1.144 9.956 1.00 0.00 O ATOM 299 CB ASP A 18 -9.719 -1.093 9.510 1.00 0.00 C ATOM 300 CG ASP A 18 -9.653 -1.349 11.006 1.00 0.00 C ATOM 301 OD1 ASP A 18 -10.606 -0.967 11.718 1.00 0.00 O ATOM 302 OD2 ASP A 18 -8.666 -1.953 11.475 1.00 0.00 O ATOM 0 H ASP A 18 -10.611 -0.094 7.421 1.00 0.00 H new ATOM 0 HA ASP A 18 -9.935 0.986 9.973 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -10.681 -1.435 9.129 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -8.950 -1.682 9.010 1.00 0.00 H new ATOM 307 N LEU A 19 -7.525 0.532 7.790 1.00 0.00 N ATOM 308 CA LEU A 19 -6.152 0.924 7.475 1.00 0.00 C ATOM 309 C LEU A 19 -6.012 2.443 7.533 1.00 0.00 C ATOM 310 O LEU A 19 -5.089 2.976 8.155 1.00 0.00 O ATOM 311 CB LEU A 19 -5.752 0.422 6.083 1.00 0.00 C ATOM 312 CG LEU A 19 -5.642 -1.097 5.936 1.00 0.00 C ATOM 313 CD1 LEU A 19 -5.426 -1.476 4.481 1.00 0.00 C ATOM 314 CD2 LEU A 19 -4.511 -1.635 6.799 1.00 0.00 C ATOM 0 H LEU A 19 -8.032 0.114 7.010 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.490 0.473 8.214 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.482 0.787 5.361 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.792 0.865 5.818 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.577 -1.544 6.274 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.350 -2.560 4.395 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.267 -1.123 3.884 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.506 -1.018 4.118 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.447 -2.717 6.682 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.570 -1.180 6.490 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.704 -1.394 7.844 1.00 0.00 H new ATOM 326 N LEU A 20 -6.948 3.137 6.889 1.00 0.00 N ATOM 327 CA LEU A 20 -6.974 4.595 6.906 1.00 0.00 C ATOM 328 C LEU A 20 -7.160 5.107 8.328 1.00 0.00 C ATOM 329 O LEU A 20 -6.714 6.202 8.674 1.00 0.00 O ATOM 330 CB LEU A 20 -8.100 5.123 6.013 1.00 0.00 C ATOM 331 CG LEU A 20 -7.948 4.826 4.520 1.00 0.00 C ATOM 332 CD1 LEU A 20 -9.156 5.340 3.754 1.00 0.00 C ATOM 333 CD2 LEU A 20 -6.669 5.445 3.981 1.00 0.00 C ATOM 0 H LEU A 20 -7.700 2.710 6.348 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.021 4.957 6.521 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -9.043 4.698 6.357 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -8.170 6.203 6.146 1.00 0.00 H new ATOM 0 HG LEU A 20 -7.888 3.746 4.385 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -9.034 5.122 2.693 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -10.057 4.850 4.124 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -9.245 6.417 3.895 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.578 5.223 2.918 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -6.698 6.525 4.125 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -5.812 5.031 4.513 1.00 0.00 H new ATOM 345 N ASP A 21 -7.823 4.303 9.150 1.00 0.00 N ATOM 346 CA ASP A 21 -8.032 4.642 10.548 1.00 0.00 C ATOM 347 C ASP A 21 -6.713 4.598 11.307 1.00 0.00 C ATOM 348 O ASP A 21 -6.463 5.431 12.169 1.00 0.00 O ATOM 349 CB ASP A 21 -9.038 3.698 11.195 1.00 0.00 C ATOM 350 CG ASP A 21 -9.489 4.190 12.553 1.00 0.00 C ATOM 351 OD1 ASP A 21 -8.776 3.950 13.543 1.00 0.00 O ATOM 352 OD2 ASP A 21 -10.567 4.817 12.635 1.00 0.00 O ATOM 0 H ASP A 21 -8.226 3.409 8.869 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.434 5.654 10.592 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -9.905 3.590 10.543 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.592 2.709 11.298 1.00 0.00 H new ATOM 357 N VAL A 22 -5.859 3.637 10.974 1.00 0.00 N ATOM 358 CA VAL A 22 -4.525 3.573 11.565 1.00 0.00 C ATOM 359 C VAL A 22 -3.754 4.845 11.227 1.00 0.00 C ATOM 360 O VAL A 22 -3.022 5.391 12.053 1.00 0.00 O ATOM 361 CB VAL A 22 -3.731 2.347 11.066 1.00 0.00 C ATOM 362 CG1 VAL A 22 -2.343 2.307 11.688 1.00 0.00 C ATOM 363 CG2 VAL A 22 -4.483 1.062 11.366 1.00 0.00 C ATOM 0 H VAL A 22 -6.063 2.896 10.303 1.00 0.00 H new ATOM 0 HA VAL A 22 -4.646 3.478 12.644 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.618 2.438 9.986 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.804 1.434 11.320 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -1.797 3.211 11.418 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.432 2.248 12.773 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.906 0.210 11.006 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.632 0.971 12.442 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.451 1.082 10.866 1.00 0.00 H new ATOM 373 N LEU A 23 -3.957 5.326 10.011 1.00 0.00 N ATOM 374 CA LEU A 23 -3.311 6.543 9.550 1.00 0.00 C ATOM 375 C LEU A 23 -3.873 7.772 10.263 1.00 0.00 C ATOM 376 O LEU A 23 -3.142 8.720 10.540 1.00 0.00 O ATOM 377 CB LEU A 23 -3.472 6.682 8.035 1.00 0.00 C ATOM 378 CG LEU A 23 -2.896 5.524 7.216 1.00 0.00 C ATOM 379 CD1 LEU A 23 -3.134 5.754 5.733 1.00 0.00 C ATOM 380 CD2 LEU A 23 -1.408 5.358 7.498 1.00 0.00 C ATOM 0 H LEU A 23 -4.568 4.888 9.322 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.250 6.476 9.789 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.533 6.778 7.804 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.991 7.607 7.717 1.00 0.00 H new ATOM 0 HG LEU A 23 -3.406 4.606 7.510 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.719 4.922 5.164 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.205 5.824 5.543 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.649 6.681 5.426 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.016 4.530 6.907 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.883 6.275 7.231 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.260 5.150 8.558 1.00 0.00 H new ATOM 392 N VAL A 24 -5.168 7.750 10.579 1.00 0.00 N ATOM 393 CA VAL A 24 -5.795 8.874 11.272 1.00 0.00 C ATOM 394 C VAL A 24 -5.544 8.777 12.779 1.00 0.00 C ATOM 395 O VAL A 24 -5.635 9.772 13.499 1.00 0.00 O ATOM 396 CB VAL A 24 -7.317 8.974 10.980 1.00 0.00 C ATOM 397 CG1 VAL A 24 -8.121 7.980 11.805 1.00 0.00 C ATOM 398 CG2 VAL A 24 -7.815 10.394 11.210 1.00 0.00 C ATOM 0 H VAL A 24 -5.797 6.975 10.369 1.00 0.00 H new ATOM 0 HA VAL A 24 -5.336 9.785 10.889 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.465 8.718 9.931 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -9.180 8.084 11.569 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -7.795 6.966 11.572 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -7.964 8.177 12.866 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.883 10.443 11.000 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -7.635 10.679 12.247 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -7.283 11.078 10.548 1.00 0.00 H new ATOM 408 N LYS A 25 -5.229 7.571 13.254 1.00 0.00 N ATOM 409 CA LYS A 25 -4.784 7.387 14.633 1.00 0.00 C ATOM 410 C LYS A 25 -3.544 8.234 14.896 1.00 0.00 C ATOM 411 O LYS A 25 -3.397 8.838 15.961 1.00 0.00 O ATOM 412 CB LYS A 25 -4.446 5.915 14.921 1.00 0.00 C ATOM 413 CG LYS A 25 -5.648 5.005 15.139 1.00 0.00 C ATOM 414 CD LYS A 25 -5.195 3.590 15.486 1.00 0.00 C ATOM 415 CE LYS A 25 -6.340 2.715 15.985 1.00 0.00 C ATOM 416 NZ LYS A 25 -7.301 2.347 14.908 1.00 0.00 N ATOM 0 H LYS A 25 -5.274 6.712 12.706 1.00 0.00 H new ATOM 0 HA LYS A 25 -5.600 7.696 15.287 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -3.860 5.524 14.089 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -3.812 5.871 15.806 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -6.270 5.401 15.942 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -6.264 4.985 14.240 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -4.747 3.129 14.605 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -4.419 3.638 16.250 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.930 1.806 16.426 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.874 3.241 16.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.162 1.947 15.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -7.548 3.195 14.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -6.865 1.642 14.280 1.00 0.00 H new ATOM 430 N GLU A 26 -2.661 8.273 13.908 1.00 0.00 N ATOM 431 CA GLU A 26 -1.398 8.983 14.029 1.00 0.00 C ATOM 432 C GLU A 26 -1.475 10.384 13.430 1.00 0.00 C ATOM 433 O GLU A 26 -0.728 11.275 13.837 1.00 0.00 O ATOM 434 CB GLU A 26 -0.293 8.197 13.326 1.00 0.00 C ATOM 435 CG GLU A 26 -0.022 6.839 13.946 1.00 0.00 C ATOM 436 CD GLU A 26 0.544 6.957 15.342 1.00 0.00 C ATOM 437 OE1 GLU A 26 1.776 7.090 15.473 1.00 0.00 O ATOM 438 OE2 GLU A 26 -0.239 6.938 16.310 1.00 0.00 O ATOM 0 H GLU A 26 -2.799 7.816 13.006 1.00 0.00 H new ATOM 0 HA GLU A 26 -1.176 9.079 15.092 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.565 8.061 12.279 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.625 8.784 13.343 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -0.947 6.264 13.977 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.676 6.286 13.317 1.00 0.00 H new ATOM 445 N GLU A 27 -2.384 10.569 12.475 1.00 0.00 N ATOM 446 CA GLU A 27 -2.438 11.789 11.673 1.00 0.00 C ATOM 447 C GLU A 27 -1.119 11.976 10.934 1.00 0.00 C ATOM 448 O GLU A 27 -0.407 12.965 11.124 1.00 0.00 O ATOM 449 CB GLU A 27 -2.763 13.023 12.522 1.00 0.00 C ATOM 450 CG GLU A 27 -4.199 13.068 13.017 1.00 0.00 C ATOM 451 CD GLU A 27 -4.518 14.355 13.747 1.00 0.00 C ATOM 452 OE1 GLU A 27 -3.868 15.384 13.462 1.00 0.00 O ATOM 453 OE2 GLU A 27 -5.414 14.348 14.615 1.00 0.00 O ATOM 0 H GLU A 27 -3.099 9.882 12.236 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.246 11.680 10.950 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -2.092 13.048 13.381 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -2.563 13.919 11.935 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -4.876 12.957 12.170 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -4.378 12.223 13.681 1.00 0.00 H new ATOM 460 N VAL A 28 -0.794 10.992 10.111 1.00 0.00 N ATOM 461 CA VAL A 28 0.463 10.978 9.380 1.00 0.00 C ATOM 462 C VAL A 28 0.411 11.886 8.159 1.00 0.00 C ATOM 463 O VAL A 28 -0.660 12.153 7.611 1.00 0.00 O ATOM 464 CB VAL A 28 0.831 9.550 8.926 1.00 0.00 C ATOM 465 CG1 VAL A 28 1.044 8.646 10.127 1.00 0.00 C ATOM 466 CG2 VAL A 28 -0.244 8.975 8.016 1.00 0.00 C ATOM 0 H VAL A 28 -1.391 10.184 9.931 1.00 0.00 H new ATOM 0 HA VAL A 28 1.226 11.347 10.066 1.00 0.00 H new ATOM 0 HB VAL A 28 1.762 9.605 8.362 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.303 7.643 9.786 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.854 9.041 10.741 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.129 8.604 10.717 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.039 7.968 7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -1.193 8.938 8.552 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.350 9.606 7.134 1.00 0.00 H new ATOM 476 N THR A 29 1.574 12.365 7.748 1.00 0.00 N ATOM 477 CA THR A 29 1.694 13.146 6.530 1.00 0.00 C ATOM 478 C THR A 29 1.696 12.217 5.322 1.00 0.00 C ATOM 479 O THR A 29 2.002 11.034 5.459 1.00 0.00 O ATOM 480 CB THR A 29 2.992 13.983 6.538 1.00 0.00 C ATOM 481 OG1 THR A 29 4.113 13.143 6.854 1.00 0.00 O ATOM 482 CG2 THR A 29 2.904 15.117 7.549 1.00 0.00 C ATOM 0 H THR A 29 2.454 12.225 8.245 1.00 0.00 H new ATOM 0 HA THR A 29 0.843 13.825 6.472 1.00 0.00 H new ATOM 0 HB THR A 29 3.125 14.414 5.546 1.00 0.00 H new ATOM 0 HG1 THR A 29 4.933 13.679 6.856 1.00 0.00 H new ATOM 0 HG21 THR A 29 3.831 15.690 7.534 1.00 0.00 H new ATOM 0 HG22 THR A 29 2.069 15.769 7.292 1.00 0.00 H new ATOM 0 HG23 THR A 29 2.749 14.704 8.546 1.00 0.00 H new ATOM 490 N PRO A 30 1.347 12.724 4.127 1.00 0.00 N ATOM 491 CA PRO A 30 1.368 11.925 2.895 1.00 0.00 C ATOM 492 C PRO A 30 2.707 11.217 2.697 1.00 0.00 C ATOM 493 O PRO A 30 2.755 10.044 2.323 1.00 0.00 O ATOM 494 CB PRO A 30 1.143 12.963 1.795 1.00 0.00 C ATOM 495 CG PRO A 30 0.400 14.070 2.461 1.00 0.00 C ATOM 496 CD PRO A 30 0.886 14.105 3.884 1.00 0.00 C ATOM 0 HA PRO A 30 0.621 11.131 2.906 1.00 0.00 H new ATOM 0 HB2 PRO A 30 2.089 13.314 1.383 1.00 0.00 H new ATOM 0 HB3 PRO A 30 0.570 12.544 0.967 1.00 0.00 H new ATOM 0 HG2 PRO A 30 0.588 15.021 1.962 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -0.675 13.896 2.421 1.00 0.00 H new ATOM 0 HD2 PRO A 30 1.693 14.826 4.014 1.00 0.00 H new ATOM 0 HD3 PRO A 30 0.090 14.389 4.573 1.00 0.00 H new ATOM 504 N ASP A 31 3.787 11.942 2.971 1.00 0.00 N ATOM 505 CA ASP A 31 5.139 11.401 2.869 1.00 0.00 C ATOM 506 C ASP A 31 5.316 10.197 3.789 1.00 0.00 C ATOM 507 O ASP A 31 5.742 9.125 3.355 1.00 0.00 O ATOM 508 CB ASP A 31 6.155 12.492 3.226 1.00 0.00 C ATOM 509 CG ASP A 31 7.592 12.023 3.134 1.00 0.00 C ATOM 510 OD1 ASP A 31 8.170 12.081 2.027 1.00 0.00 O ATOM 511 OD2 ASP A 31 8.157 11.619 4.170 1.00 0.00 O ATOM 0 H ASP A 31 3.751 12.917 3.269 1.00 0.00 H new ATOM 0 HA ASP A 31 5.306 11.069 1.844 1.00 0.00 H new ATOM 0 HB2 ASP A 31 6.014 13.343 2.559 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.959 12.845 4.239 1.00 0.00 H new ATOM 516 N LEU A 32 4.959 10.375 5.056 1.00 0.00 N ATOM 517 CA LEU A 32 5.093 9.317 6.049 1.00 0.00 C ATOM 518 C LEU A 32 4.156 8.156 5.729 1.00 0.00 C ATOM 519 O LEU A 32 4.540 6.989 5.825 1.00 0.00 O ATOM 520 CB LEU A 32 4.797 9.871 7.448 1.00 0.00 C ATOM 521 CG LEU A 32 4.948 8.873 8.603 1.00 0.00 C ATOM 522 CD1 LEU A 32 6.362 8.314 8.652 1.00 0.00 C ATOM 523 CD2 LEU A 32 4.599 9.540 9.924 1.00 0.00 C ATOM 0 H LEU A 32 4.573 11.246 5.420 1.00 0.00 H new ATOM 0 HA LEU A 32 6.117 8.945 6.025 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.461 10.716 7.632 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.778 10.258 7.457 1.00 0.00 H new ATOM 0 HG LEU A 32 4.259 8.046 8.433 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.446 7.609 9.479 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.584 7.803 7.715 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.071 9.129 8.797 1.00 0.00 H new ATOM 0 HD21 LEU A 32 4.710 8.821 10.735 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.268 10.384 10.093 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.569 9.894 9.892 1.00 0.00 H new ATOM 535 N ALA A 33 2.935 8.491 5.329 1.00 0.00 N ATOM 536 CA ALA A 33 1.922 7.493 5.008 1.00 0.00 C ATOM 537 C ALA A 33 2.397 6.557 3.905 1.00 0.00 C ATOM 538 O ALA A 33 2.411 5.341 4.084 1.00 0.00 O ATOM 539 CB ALA A 33 0.624 8.170 4.594 1.00 0.00 C ATOM 0 H ALA A 33 2.621 9.455 5.219 1.00 0.00 H new ATOM 0 HA ALA A 33 1.745 6.899 5.904 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -0.122 7.412 4.357 1.00 0.00 H new ATOM 0 HB2 ALA A 33 0.262 8.793 5.412 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.801 8.791 3.716 1.00 0.00 H new ATOM 545 N LEU A 34 2.801 7.127 2.776 1.00 0.00 N ATOM 546 CA LEU A 34 3.222 6.333 1.625 1.00 0.00 C ATOM 547 C LEU A 34 4.437 5.473 1.959 1.00 0.00 C ATOM 548 O LEU A 34 4.556 4.343 1.483 1.00 0.00 O ATOM 549 CB LEU A 34 3.533 7.239 0.431 1.00 0.00 C ATOM 550 CG LEU A 34 2.351 8.058 -0.091 1.00 0.00 C ATOM 551 CD1 LEU A 34 2.778 8.912 -1.274 1.00 0.00 C ATOM 552 CD2 LEU A 34 1.198 7.147 -0.480 1.00 0.00 C ATOM 0 H LEU A 34 2.846 8.136 2.632 1.00 0.00 H new ATOM 0 HA LEU A 34 2.398 5.670 1.362 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.332 7.924 0.714 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.915 6.622 -0.383 1.00 0.00 H new ATOM 0 HG LEU A 34 2.011 8.718 0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.925 9.488 -1.633 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.571 9.592 -0.964 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.144 8.268 -2.074 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.367 7.749 -0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.524 6.461 -1.262 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.875 6.577 0.391 1.00 0.00 H new ATOM 564 N MET A 35 5.328 6.004 2.788 1.00 0.00 N ATOM 565 CA MET A 35 6.529 5.277 3.179 1.00 0.00 C ATOM 566 C MET A 35 6.173 4.053 4.021 1.00 0.00 C ATOM 567 O MET A 35 6.716 2.966 3.812 1.00 0.00 O ATOM 568 CB MET A 35 7.486 6.197 3.945 1.00 0.00 C ATOM 569 CG MET A 35 8.797 5.533 4.329 1.00 0.00 C ATOM 570 SD MET A 35 9.988 6.694 5.026 1.00 0.00 S ATOM 571 CE MET A 35 9.102 7.273 6.470 1.00 0.00 C ATOM 0 H MET A 35 5.242 6.933 3.201 1.00 0.00 H new ATOM 0 HA MET A 35 7.029 4.932 2.274 1.00 0.00 H new ATOM 0 HB2 MET A 35 7.699 7.074 3.334 1.00 0.00 H new ATOM 0 HB3 MET A 35 6.990 6.551 4.849 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.600 4.742 5.053 1.00 0.00 H new ATOM 0 HG3 MET A 35 9.231 5.059 3.449 1.00 0.00 H new ATOM 0 HE1 MET A 35 9.797 7.767 7.149 1.00 0.00 H new ATOM 0 HE2 MET A 35 8.330 7.979 6.164 1.00 0.00 H new ATOM 0 HE3 MET A 35 8.639 6.426 6.977 1.00 0.00 H new ATOM 581 N CYS A 36 5.254 4.227 4.962 1.00 0.00 N ATOM 582 CA CYS A 36 4.817 3.123 5.807 1.00 0.00 C ATOM 583 C CYS A 36 3.956 2.138 5.015 1.00 0.00 C ATOM 584 O CYS A 36 4.123 0.921 5.134 1.00 0.00 O ATOM 585 CB CYS A 36 4.049 3.652 7.021 1.00 0.00 C ATOM 586 SG CYS A 36 5.048 4.677 8.125 1.00 0.00 S ATOM 0 H CYS A 36 4.798 5.118 5.159 1.00 0.00 H new ATOM 0 HA CYS A 36 5.701 2.592 6.159 1.00 0.00 H new ATOM 0 HB2 CYS A 36 3.195 4.234 6.674 1.00 0.00 H new ATOM 0 HB3 CYS A 36 3.652 2.808 7.584 1.00 0.00 H new ATOM 0 HG CYS A 36 5.177 5.866 7.615 1.00 0.00 H new ATOM 592 N LEU A 37 3.056 2.669 4.192 1.00 0.00 N ATOM 593 CA LEU A 37 2.176 1.839 3.375 1.00 0.00 C ATOM 594 C LEU A 37 2.980 0.970 2.414 1.00 0.00 C ATOM 595 O LEU A 37 2.704 -0.219 2.267 1.00 0.00 O ATOM 596 CB LEU A 37 1.193 2.708 2.584 1.00 0.00 C ATOM 597 CG LEU A 37 0.136 3.436 3.422 1.00 0.00 C ATOM 598 CD1 LEU A 37 -0.683 4.371 2.545 1.00 0.00 C ATOM 599 CD2 LEU A 37 -0.771 2.438 4.128 1.00 0.00 C ATOM 0 H LEU A 37 2.917 3.672 4.073 1.00 0.00 H new ATOM 0 HA LEU A 37 1.616 1.190 4.048 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.761 3.450 2.023 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.683 2.078 1.855 1.00 0.00 H new ATOM 0 HG LEU A 37 0.647 4.029 4.180 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.429 4.881 3.154 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.025 5.108 2.085 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.183 3.795 1.766 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.514 2.975 4.717 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.275 1.817 3.387 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.174 1.806 4.786 1.00 0.00 H new ATOM 611 N GLY A 38 3.977 1.569 1.776 1.00 0.00 N ATOM 612 CA GLY A 38 4.808 0.841 0.834 1.00 0.00 C ATOM 613 C GLY A 38 5.468 -0.375 1.457 1.00 0.00 C ATOM 614 O GLY A 38 5.479 -1.453 0.865 1.00 0.00 O ATOM 0 H GLY A 38 4.227 2.551 1.894 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.199 0.525 -0.013 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.577 1.507 0.443 1.00 0.00 H new ATOM 618 N ASN A 39 5.996 -0.205 2.667 1.00 0.00 N ATOM 619 CA ASN A 39 6.645 -1.301 3.382 1.00 0.00 C ATOM 620 C ASN A 39 5.661 -2.429 3.672 1.00 0.00 C ATOM 621 O ASN A 39 6.006 -3.606 3.571 1.00 0.00 O ATOM 622 CB ASN A 39 7.265 -0.810 4.691 1.00 0.00 C ATOM 623 CG ASN A 39 8.649 -0.217 4.498 1.00 0.00 C ATOM 624 OD1 ASN A 39 9.653 -0.921 4.594 1.00 0.00 O ATOM 625 ND2 ASN A 39 8.716 1.079 4.237 1.00 0.00 N ATOM 0 H ASN A 39 5.987 0.681 3.173 1.00 0.00 H new ATOM 0 HA ASN A 39 7.437 -1.685 2.738 1.00 0.00 H new ATOM 0 HB2 ASN A 39 6.612 -0.060 5.139 1.00 0.00 H new ATOM 0 HB3 ASN A 39 7.325 -1.641 5.394 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.623 1.527 4.108 1.00 0.00 H new ATOM 0 HD22 ASN A 39 7.860 1.630 4.165 1.00 0.00 H new ATOM 632 N ALA A 40 4.432 -2.063 4.018 1.00 0.00 N ATOM 633 CA ALA A 40 3.395 -3.048 4.298 1.00 0.00 C ATOM 634 C ALA A 40 3.052 -3.839 3.040 1.00 0.00 C ATOM 635 O ALA A 40 2.822 -5.048 3.094 1.00 0.00 O ATOM 636 CB ALA A 40 2.152 -2.371 4.857 1.00 0.00 C ATOM 0 H ALA A 40 4.130 -1.093 4.111 1.00 0.00 H new ATOM 0 HA ALA A 40 3.776 -3.742 5.047 1.00 0.00 H new ATOM 0 HB1 ALA A 40 1.389 -3.122 5.060 1.00 0.00 H new ATOM 0 HB2 ALA A 40 2.405 -1.852 5.781 1.00 0.00 H new ATOM 0 HB3 ALA A 40 1.771 -1.653 4.131 1.00 0.00 H new ATOM 642 N VAL A 41 3.031 -3.146 1.905 1.00 0.00 N ATOM 643 CA VAL A 41 2.740 -3.779 0.625 1.00 0.00 C ATOM 644 C VAL A 41 3.854 -4.744 0.232 1.00 0.00 C ATOM 645 O VAL A 41 3.595 -5.901 -0.105 1.00 0.00 O ATOM 646 CB VAL A 41 2.546 -2.735 -0.500 1.00 0.00 C ATOM 647 CG1 VAL A 41 2.233 -3.416 -1.823 1.00 0.00 C ATOM 648 CG2 VAL A 41 1.439 -1.757 -0.142 1.00 0.00 C ATOM 0 H VAL A 41 3.213 -2.144 1.847 1.00 0.00 H new ATOM 0 HA VAL A 41 1.808 -4.331 0.748 1.00 0.00 H new ATOM 0 HB VAL A 41 3.479 -2.182 -0.607 1.00 0.00 H new ATOM 0 HG11 VAL A 41 2.101 -2.661 -2.598 1.00 0.00 H new ATOM 0 HG12 VAL A 41 3.056 -4.076 -2.096 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.317 -3.999 -1.724 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.320 -1.032 -0.947 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.505 -2.300 -0.002 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.698 -1.236 0.780 1.00 0.00 H new ATOM 658 N THR A 42 5.096 -4.273 0.301 1.00 0.00 N ATOM 659 CA THR A 42 6.243 -5.092 -0.063 1.00 0.00 C ATOM 660 C THR A 42 6.344 -6.327 0.836 1.00 0.00 C ATOM 661 O THR A 42 6.760 -7.398 0.391 1.00 0.00 O ATOM 662 CB THR A 42 7.549 -4.277 0.016 1.00 0.00 C ATOM 663 OG1 THR A 42 7.424 -3.093 -0.780 1.00 0.00 O ATOM 664 CG2 THR A 42 8.740 -5.092 -0.473 1.00 0.00 C ATOM 0 H THR A 42 5.331 -3.329 0.606 1.00 0.00 H new ATOM 0 HA THR A 42 6.098 -5.422 -1.092 1.00 0.00 H new ATOM 0 HB THR A 42 7.721 -4.011 1.059 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.277 -2.907 -1.226 1.00 0.00 H new ATOM 0 HG21 THR A 42 9.646 -4.489 -0.405 1.00 0.00 H new ATOM 0 HG22 THR A 42 8.850 -5.983 0.145 1.00 0.00 H new ATOM 0 HG23 THR A 42 8.578 -5.387 -1.510 1.00 0.00 H new ATOM 672 N ASN A 43 5.938 -6.177 2.093 1.00 0.00 N ATOM 673 CA ASN A 43 5.948 -7.286 3.045 1.00 0.00 C ATOM 674 C ASN A 43 5.002 -8.398 2.594 1.00 0.00 C ATOM 675 O ASN A 43 5.228 -9.576 2.873 1.00 0.00 O ATOM 676 CB ASN A 43 5.559 -6.787 4.442 1.00 0.00 C ATOM 677 CG ASN A 43 5.563 -7.890 5.486 1.00 0.00 C ATOM 678 OD1 ASN A 43 6.594 -8.196 6.080 1.00 0.00 O ATOM 679 ND2 ASN A 43 4.402 -8.479 5.732 1.00 0.00 N ATOM 0 H ASN A 43 5.597 -5.296 2.478 1.00 0.00 H new ATOM 0 HA ASN A 43 6.958 -7.695 3.086 1.00 0.00 H new ATOM 0 HB2 ASN A 43 6.251 -6.002 4.748 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.567 -6.338 4.399 1.00 0.00 H new ATOM 0 HD21 ASN A 43 4.342 -9.215 6.436 1.00 0.00 H new ATOM 0 HD22 ASN A 43 3.568 -8.197 5.217 1.00 0.00 H new ATOM 686 N ILE A 44 3.945 -8.018 1.890 1.00 0.00 N ATOM 687 CA ILE A 44 2.989 -8.984 1.369 1.00 0.00 C ATOM 688 C ILE A 44 3.501 -9.584 0.061 1.00 0.00 C ATOM 689 O ILE A 44 3.426 -10.795 -0.151 1.00 0.00 O ATOM 690 CB ILE A 44 1.602 -8.337 1.141 1.00 0.00 C ATOM 691 CG1 ILE A 44 1.064 -7.744 2.450 1.00 0.00 C ATOM 692 CG2 ILE A 44 0.619 -9.353 0.571 1.00 0.00 C ATOM 693 CD1 ILE A 44 0.901 -8.760 3.561 1.00 0.00 C ATOM 0 H ILE A 44 3.728 -7.047 1.667 1.00 0.00 H new ATOM 0 HA ILE A 44 2.879 -9.775 2.111 1.00 0.00 H new ATOM 0 HB ILE A 44 1.717 -7.530 0.417 1.00 0.00 H new ATOM 0 HG12 ILE A 44 1.740 -6.957 2.786 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.100 -7.274 2.256 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.349 -8.876 0.419 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.994 -9.727 -0.382 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.509 -10.184 1.268 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.517 -8.265 4.453 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.202 -9.535 3.246 1.00 0.00 H new ATOM 0 HD13 ILE A 44 1.867 -9.213 3.785 1.00 0.00 H new ATOM 705 N ILE A 45 4.051 -8.730 -0.796 1.00 0.00 N ATOM 706 CA ILE A 45 4.556 -9.152 -2.100 1.00 0.00 C ATOM 707 C ILE A 45 5.738 -10.113 -1.954 1.00 0.00 C ATOM 708 O ILE A 45 5.909 -11.033 -2.752 1.00 0.00 O ATOM 709 CB ILE A 45 4.978 -7.932 -2.952 1.00 0.00 C ATOM 710 CG1 ILE A 45 3.800 -6.968 -3.116 1.00 0.00 C ATOM 711 CG2 ILE A 45 5.487 -8.376 -4.315 1.00 0.00 C ATOM 712 CD1 ILE A 45 4.158 -5.698 -3.858 1.00 0.00 C ATOM 0 H ILE A 45 4.159 -7.733 -0.610 1.00 0.00 H new ATOM 0 HA ILE A 45 3.745 -9.674 -2.607 1.00 0.00 H new ATOM 0 HB ILE A 45 5.787 -7.416 -2.435 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.996 -7.476 -3.649 1.00 0.00 H new ATOM 0 HG13 ILE A 45 3.414 -6.707 -2.130 1.00 0.00 H new ATOM 0 HG21 ILE A 45 5.778 -7.502 -4.897 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.350 -9.030 -4.186 1.00 0.00 H new ATOM 0 HG23 ILE A 45 4.698 -8.915 -4.840 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.276 -5.062 -3.937 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.940 -5.168 -3.315 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.516 -5.949 -4.857 1.00 0.00 H new ATOM 724 N ALA A 46 6.530 -9.918 -0.906 1.00 0.00 N ATOM 725 CA ALA A 46 7.702 -10.753 -0.658 1.00 0.00 C ATOM 726 C ALA A 46 7.313 -12.194 -0.318 1.00 0.00 C ATOM 727 O ALA A 46 8.168 -13.080 -0.282 1.00 0.00 O ATOM 728 CB ALA A 46 8.546 -10.157 0.462 1.00 0.00 C ATOM 0 H ALA A 46 6.382 -9.186 -0.211 1.00 0.00 H new ATOM 0 HA ALA A 46 8.289 -10.778 -1.576 1.00 0.00 H new ATOM 0 HB1 ALA A 46 9.417 -10.789 0.637 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.874 -9.157 0.178 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.951 -10.098 1.374 1.00 0.00 H new ATOM 734 N GLN A 47 6.028 -12.426 -0.078 1.00 0.00 N ATOM 735 CA GLN A 47 5.540 -13.757 0.265 1.00 0.00 C ATOM 736 C GLN A 47 5.124 -14.519 -0.990 1.00 0.00 C ATOM 737 O GLN A 47 4.775 -15.700 -0.929 1.00 0.00 O ATOM 738 CB GLN A 47 4.356 -13.652 1.223 1.00 0.00 C ATOM 739 CG GLN A 47 4.662 -12.839 2.467 1.00 0.00 C ATOM 740 CD GLN A 47 3.454 -12.675 3.365 1.00 0.00 C ATOM 741 OE1 GLN A 47 2.592 -13.553 3.435 1.00 0.00 O ATOM 742 NE2 GLN A 47 3.369 -11.540 4.042 1.00 0.00 N ATOM 0 H GLN A 47 5.304 -11.709 -0.115 1.00 0.00 H new ATOM 0 HA GLN A 47 6.348 -14.303 0.752 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.513 -13.200 0.700 1.00 0.00 H new ATOM 0 HB3 GLN A 47 4.047 -14.654 1.519 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.463 -13.323 3.026 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.028 -11.855 2.173 1.00 0.00 H new ATOM 0 HE21 GLN A 47 4.105 -10.839 3.956 1.00 0.00 H new ATOM 0 HE22 GLN A 47 2.568 -11.367 4.649 1.00 0.00 H new ATOM 751 N VAL A 48 5.158 -13.832 -2.124 1.00 0.00 N ATOM 752 CA VAL A 48 4.801 -14.428 -3.404 1.00 0.00 C ATOM 753 C VAL A 48 6.045 -15.025 -4.058 1.00 0.00 C ATOM 754 O VAL A 48 7.124 -14.448 -3.961 1.00 0.00 O ATOM 755 CB VAL A 48 4.184 -13.370 -4.352 1.00 0.00 C ATOM 756 CG1 VAL A 48 3.591 -14.020 -5.593 1.00 0.00 C ATOM 757 CG2 VAL A 48 3.130 -12.546 -3.624 1.00 0.00 C ATOM 0 H VAL A 48 5.432 -12.851 -2.183 1.00 0.00 H new ATOM 0 HA VAL A 48 4.063 -15.210 -3.224 1.00 0.00 H new ATOM 0 HB VAL A 48 4.984 -12.703 -4.673 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.166 -13.251 -6.238 1.00 0.00 H new ATOM 0 HG12 VAL A 48 4.373 -14.555 -6.132 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.809 -14.720 -5.299 1.00 0.00 H new ATOM 0 HG21 VAL A 48 2.709 -11.809 -4.307 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.338 -13.203 -3.266 1.00 0.00 H new ATOM 0 HG23 VAL A 48 3.588 -12.036 -2.777 1.00 0.00 H new ATOM 767 N PRO A 49 5.932 -16.204 -4.692 1.00 0.00 N ATOM 768 CA PRO A 49 7.049 -16.804 -5.426 1.00 0.00 C ATOM 769 C PRO A 49 7.467 -15.965 -6.628 1.00 0.00 C ATOM 770 O PRO A 49 6.635 -15.323 -7.275 1.00 0.00 O ATOM 771 CB PRO A 49 6.512 -18.170 -5.874 1.00 0.00 C ATOM 772 CG PRO A 49 5.299 -18.412 -5.039 1.00 0.00 C ATOM 773 CD PRO A 49 4.736 -17.057 -4.721 1.00 0.00 C ATOM 0 HA PRO A 49 7.943 -16.879 -4.808 1.00 0.00 H new ATOM 0 HB2 PRO A 49 6.264 -18.166 -6.935 1.00 0.00 H new ATOM 0 HB3 PRO A 49 7.255 -18.953 -5.723 1.00 0.00 H new ATOM 0 HG2 PRO A 49 4.571 -19.020 -5.576 1.00 0.00 H new ATOM 0 HG3 PRO A 49 5.555 -18.952 -4.127 1.00 0.00 H new ATOM 0 HD2 PRO A 49 4.023 -16.728 -5.477 1.00 0.00 H new ATOM 0 HD3 PRO A 49 4.212 -17.051 -3.765 1.00 0.00 H new ATOM 781 N GLU A 50 8.758 -16.017 -6.934 1.00 0.00 N ATOM 782 CA GLU A 50 9.378 -15.132 -7.918 1.00 0.00 C ATOM 783 C GLU A 50 8.761 -15.267 -9.310 1.00 0.00 C ATOM 784 O GLU A 50 8.906 -14.374 -10.143 1.00 0.00 O ATOM 785 CB GLU A 50 10.878 -15.415 -8.003 1.00 0.00 C ATOM 786 CG GLU A 50 11.687 -14.224 -8.489 1.00 0.00 C ATOM 787 CD GLU A 50 11.643 -13.070 -7.510 1.00 0.00 C ATOM 788 OE1 GLU A 50 10.608 -12.378 -7.442 1.00 0.00 O ATOM 789 OE2 GLU A 50 12.643 -12.863 -6.790 1.00 0.00 O ATOM 0 H GLU A 50 9.408 -16.676 -6.506 1.00 0.00 H new ATOM 0 HA GLU A 50 9.200 -14.112 -7.578 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.241 -15.715 -7.020 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.044 -16.257 -8.675 1.00 0.00 H new ATOM 0 HG2 GLU A 50 12.722 -14.528 -8.644 1.00 0.00 H new ATOM 0 HG3 GLU A 50 11.303 -13.895 -9.455 1.00 0.00 H new ATOM 796 N SER A 51 8.070 -16.372 -9.560 1.00 0.00 N ATOM 797 CA SER A 51 7.483 -16.620 -10.870 1.00 0.00 C ATOM 798 C SER A 51 6.425 -15.568 -11.202 1.00 0.00 C ATOM 799 O SER A 51 6.252 -15.193 -12.362 1.00 0.00 O ATOM 800 CB SER A 51 6.875 -18.026 -10.921 1.00 0.00 C ATOM 801 OG SER A 51 6.412 -18.346 -12.223 1.00 0.00 O ATOM 0 H SER A 51 7.903 -17.109 -8.875 1.00 0.00 H new ATOM 0 HA SER A 51 8.273 -16.552 -11.618 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.621 -18.757 -10.609 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.048 -18.092 -10.214 1.00 0.00 H new ATOM 0 HG SER A 51 6.032 -19.249 -12.222 1.00 0.00 H new ATOM 807 N LYS A 52 5.730 -15.073 -10.185 1.00 0.00 N ATOM 808 CA LYS A 52 4.698 -14.069 -10.412 1.00 0.00 C ATOM 809 C LYS A 52 4.798 -12.929 -9.404 1.00 0.00 C ATOM 810 O LYS A 52 3.937 -12.051 -9.362 1.00 0.00 O ATOM 811 CB LYS A 52 3.292 -14.693 -10.381 1.00 0.00 C ATOM 812 CG LYS A 52 2.910 -15.375 -9.068 1.00 0.00 C ATOM 813 CD LYS A 52 3.516 -16.768 -8.929 1.00 0.00 C ATOM 814 CE LYS A 52 3.179 -17.666 -10.114 1.00 0.00 C ATOM 815 NZ LYS A 52 1.713 -17.808 -10.326 1.00 0.00 N ATOM 0 H LYS A 52 5.859 -15.345 -9.210 1.00 0.00 H new ATOM 0 HA LYS A 52 4.865 -13.657 -11.407 1.00 0.00 H new ATOM 0 HB2 LYS A 52 2.561 -13.912 -10.592 1.00 0.00 H new ATOM 0 HB3 LYS A 52 3.219 -15.424 -11.186 1.00 0.00 H new ATOM 0 HG2 LYS A 52 3.238 -14.756 -8.233 1.00 0.00 H new ATOM 0 HG3 LYS A 52 1.824 -15.448 -9.004 1.00 0.00 H new ATOM 0 HD2 LYS A 52 4.599 -16.683 -8.836 1.00 0.00 H new ATOM 0 HD3 LYS A 52 3.153 -17.230 -8.011 1.00 0.00 H new ATOM 0 HE2 LYS A 52 3.635 -17.257 -11.016 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.616 -18.652 -9.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.536 -18.518 -11.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.262 -18.111 -9.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.315 -16.894 -10.622 1.00 0.00 H new ATOM 829 N ARG A 53 5.862 -12.932 -8.610 1.00 0.00 N ATOM 830 CA ARG A 53 6.078 -11.888 -7.611 1.00 0.00 C ATOM 831 C ARG A 53 6.341 -10.545 -8.283 1.00 0.00 C ATOM 832 O ARG A 53 5.869 -9.503 -7.825 1.00 0.00 O ATOM 833 CB ARG A 53 7.239 -12.271 -6.687 1.00 0.00 C ATOM 834 CG ARG A 53 7.604 -11.201 -5.671 1.00 0.00 C ATOM 835 CD ARG A 53 8.357 -11.787 -4.491 1.00 0.00 C ATOM 836 NE ARG A 53 9.534 -12.547 -4.900 1.00 0.00 N ATOM 837 CZ ARG A 53 10.227 -13.335 -4.080 1.00 0.00 C ATOM 838 NH1 ARG A 53 9.778 -13.588 -2.859 1.00 0.00 N ATOM 839 NH2 ARG A 53 11.353 -13.899 -4.492 1.00 0.00 N ATOM 0 H ARG A 53 6.590 -13.646 -8.637 1.00 0.00 H new ATOM 0 HA ARG A 53 5.175 -11.791 -7.009 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.980 -13.187 -6.156 1.00 0.00 H new ATOM 0 HB3 ARG A 53 8.116 -12.493 -7.296 1.00 0.00 H new ATOM 0 HG2 ARG A 53 8.215 -10.436 -6.150 1.00 0.00 H new ATOM 0 HG3 ARG A 53 6.698 -10.709 -5.318 1.00 0.00 H new ATOM 0 HD2 ARG A 53 8.663 -10.982 -3.823 1.00 0.00 H new ATOM 0 HD3 ARG A 53 7.689 -12.435 -3.924 1.00 0.00 H new ATOM 0 HE ARG A 53 9.843 -12.470 -5.869 1.00 0.00 H new ATOM 0 HH11 ARG A 53 8.898 -13.179 -2.544 1.00 0.00 H new ATOM 0 HH12 ARG A 53 10.312 -14.192 -2.234 1.00 0.00 H new ATOM 0 HH21 ARG A 53 11.691 -13.730 -5.439 1.00 0.00 H new ATOM 0 HH22 ARG A 53 11.882 -14.502 -3.862 1.00 0.00 H new ATOM 853 N VAL A 54 7.070 -10.577 -9.385 1.00 0.00 N ATOM 854 CA VAL A 54 7.337 -9.369 -10.150 1.00 0.00 C ATOM 855 C VAL A 54 6.077 -8.934 -10.898 1.00 0.00 C ATOM 856 O VAL A 54 5.836 -7.747 -11.102 1.00 0.00 O ATOM 857 CB VAL A 54 8.496 -9.582 -11.150 1.00 0.00 C ATOM 858 CG1 VAL A 54 8.806 -8.303 -11.912 1.00 0.00 C ATOM 859 CG2 VAL A 54 9.735 -10.080 -10.423 1.00 0.00 C ATOM 0 H VAL A 54 7.487 -11.424 -9.770 1.00 0.00 H new ATOM 0 HA VAL A 54 7.632 -8.586 -9.451 1.00 0.00 H new ATOM 0 HB VAL A 54 8.185 -10.336 -11.873 1.00 0.00 H new ATOM 0 HG11 VAL A 54 9.625 -8.484 -12.608 1.00 0.00 H new ATOM 0 HG12 VAL A 54 7.922 -7.986 -12.466 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.093 -7.521 -11.209 1.00 0.00 H new ATOM 0 HG21 VAL A 54 10.543 -10.226 -11.140 1.00 0.00 H new ATOM 0 HG22 VAL A 54 10.039 -9.346 -9.677 1.00 0.00 H new ATOM 0 HG23 VAL A 54 9.512 -11.026 -9.930 1.00 0.00 H new ATOM 869 N ALA A 55 5.265 -9.912 -11.278 1.00 0.00 N ATOM 870 CA ALA A 55 4.032 -9.647 -12.008 1.00 0.00 C ATOM 871 C ALA A 55 2.997 -8.952 -11.127 1.00 0.00 C ATOM 872 O ALA A 55 2.361 -7.989 -11.554 1.00 0.00 O ATOM 873 CB ALA A 55 3.464 -10.939 -12.573 1.00 0.00 C ATOM 0 H ALA A 55 5.439 -10.900 -11.092 1.00 0.00 H new ATOM 0 HA ALA A 55 4.272 -8.975 -12.832 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.543 -10.725 -13.116 1.00 0.00 H new ATOM 0 HB2 ALA A 55 4.189 -11.389 -13.251 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.252 -11.631 -11.758 1.00 0.00 H new ATOM 879 N VAL A 56 2.839 -9.431 -9.895 1.00 0.00 N ATOM 880 CA VAL A 56 1.822 -8.887 -8.998 1.00 0.00 C ATOM 881 C VAL A 56 2.139 -7.450 -8.586 1.00 0.00 C ATOM 882 O VAL A 56 1.236 -6.622 -8.491 1.00 0.00 O ATOM 883 CB VAL A 56 1.603 -9.761 -7.740 1.00 0.00 C ATOM 884 CG1 VAL A 56 1.061 -11.128 -8.131 1.00 0.00 C ATOM 885 CG2 VAL A 56 2.882 -9.901 -6.926 1.00 0.00 C ATOM 0 H VAL A 56 3.396 -10.187 -9.498 1.00 0.00 H new ATOM 0 HA VAL A 56 0.894 -8.891 -9.569 1.00 0.00 H new ATOM 0 HB VAL A 56 0.867 -9.260 -7.110 1.00 0.00 H new ATOM 0 HG11 VAL A 56 0.913 -11.730 -7.235 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.110 -11.008 -8.649 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.772 -11.627 -8.790 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.690 -10.521 -6.050 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.654 -10.367 -7.538 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.219 -8.915 -6.606 1.00 0.00 H new ATOM 895 N VAL A 57 3.415 -7.138 -8.362 1.00 0.00 N ATOM 896 CA VAL A 57 3.801 -5.773 -8.015 1.00 0.00 C ATOM 897 C VAL A 57 3.725 -4.868 -9.244 1.00 0.00 C ATOM 898 O VAL A 57 3.457 -3.670 -9.132 1.00 0.00 O ATOM 899 CB VAL A 57 5.216 -5.697 -7.386 1.00 0.00 C ATOM 900 CG1 VAL A 57 6.273 -6.252 -8.327 1.00 0.00 C ATOM 901 CG2 VAL A 57 5.554 -4.266 -6.992 1.00 0.00 C ATOM 0 H VAL A 57 4.188 -7.802 -8.414 1.00 0.00 H new ATOM 0 HA VAL A 57 3.093 -5.426 -7.263 1.00 0.00 H new ATOM 0 HB VAL A 57 5.210 -6.314 -6.487 1.00 0.00 H new ATOM 0 HG11 VAL A 57 7.253 -6.183 -7.855 1.00 0.00 H new ATOM 0 HG12 VAL A 57 6.050 -7.295 -8.550 1.00 0.00 H new ATOM 0 HG13 VAL A 57 6.275 -5.676 -9.252 1.00 0.00 H new ATOM 0 HG21 VAL A 57 6.551 -4.235 -6.553 1.00 0.00 H new ATOM 0 HG22 VAL A 57 5.527 -3.629 -7.876 1.00 0.00 H new ATOM 0 HG23 VAL A 57 4.826 -3.907 -6.264 1.00 0.00 H new ATOM 911 N ASP A 58 3.937 -5.451 -10.419 1.00 0.00 N ATOM 912 CA ASP A 58 3.838 -4.706 -11.668 1.00 0.00 C ATOM 913 C ASP A 58 2.393 -4.315 -11.916 1.00 0.00 C ATOM 914 O ASP A 58 2.088 -3.150 -12.133 1.00 0.00 O ATOM 915 CB ASP A 58 4.348 -5.538 -12.840 1.00 0.00 C ATOM 916 CG ASP A 58 4.511 -4.724 -14.107 1.00 0.00 C ATOM 917 OD1 ASP A 58 5.608 -4.169 -14.320 1.00 0.00 O ATOM 918 OD2 ASP A 58 3.555 -4.654 -14.908 1.00 0.00 O ATOM 0 H ASP A 58 4.178 -6.436 -10.532 1.00 0.00 H new ATOM 0 HA ASP A 58 4.454 -3.811 -11.584 1.00 0.00 H new ATOM 0 HB2 ASP A 58 5.306 -5.984 -12.574 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.655 -6.358 -13.027 1.00 0.00 H new ATOM 923 N ASN A 59 1.501 -5.301 -11.856 1.00 0.00 N ATOM 924 CA ASN A 59 0.069 -5.057 -12.011 1.00 0.00 C ATOM 925 C ASN A 59 -0.432 -4.116 -10.925 1.00 0.00 C ATOM 926 O ASN A 59 -1.277 -3.255 -11.177 1.00 0.00 O ATOM 927 CB ASN A 59 -0.710 -6.373 -11.968 1.00 0.00 C ATOM 928 CG ASN A 59 -0.628 -7.133 -13.277 1.00 0.00 C ATOM 929 OD1 ASN A 59 -0.566 -6.536 -14.352 1.00 0.00 O ATOM 930 ND2 ASN A 59 -0.625 -8.454 -13.202 1.00 0.00 N ATOM 0 H ASN A 59 1.746 -6.279 -11.701 1.00 0.00 H new ATOM 0 HA ASN A 59 -0.093 -4.589 -12.982 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.321 -6.997 -11.163 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.755 -6.167 -11.735 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.570 -9.013 -14.053 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.678 -8.913 -12.293 1.00 0.00 H new ATOM 937 N PHE A 60 0.106 -4.281 -9.722 1.00 0.00 N ATOM 938 CA PHE A 60 -0.215 -3.406 -8.601 1.00 0.00 C ATOM 939 C PHE A 60 0.103 -1.962 -8.951 1.00 0.00 C ATOM 940 O PHE A 60 -0.777 -1.105 -8.968 1.00 0.00 O ATOM 941 CB PHE A 60 0.589 -3.815 -7.367 1.00 0.00 C ATOM 942 CG PHE A 60 0.189 -3.100 -6.108 1.00 0.00 C ATOM 943 CD1 PHE A 60 -0.966 -3.449 -5.435 1.00 0.00 C ATOM 944 CD2 PHE A 60 0.976 -2.082 -5.599 1.00 0.00 C ATOM 945 CE1 PHE A 60 -1.330 -2.797 -4.274 1.00 0.00 C ATOM 946 CE2 PHE A 60 0.617 -1.425 -4.440 1.00 0.00 C ATOM 947 CZ PHE A 60 -0.538 -1.782 -3.777 1.00 0.00 C ATOM 0 H PHE A 60 0.772 -5.020 -9.497 1.00 0.00 H new ATOM 0 HA PHE A 60 -1.280 -3.498 -8.387 1.00 0.00 H new ATOM 0 HB2 PHE A 60 0.477 -4.888 -7.213 1.00 0.00 H new ATOM 0 HB3 PHE A 60 1.646 -3.629 -7.557 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -1.591 -4.241 -5.821 1.00 0.00 H new ATOM 0 HD2 PHE A 60 1.882 -1.798 -6.115 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.234 -3.081 -3.755 1.00 0.00 H new ATOM 0 HE2 PHE A 60 1.240 -0.632 -4.053 1.00 0.00 H new ATOM 0 HZ PHE A 60 -0.822 -1.268 -2.871 1.00 0.00 H new ATOM 957 N THR A 61 1.368 -1.711 -9.252 1.00 0.00 N ATOM 958 CA THR A 61 1.839 -0.367 -9.528 1.00 0.00 C ATOM 959 C THR A 61 1.222 0.187 -10.810 1.00 0.00 C ATOM 960 O THR A 61 0.905 1.376 -10.895 1.00 0.00 O ATOM 961 CB THR A 61 3.377 -0.331 -9.625 1.00 0.00 C ATOM 962 OG1 THR A 61 3.850 -1.355 -10.509 1.00 0.00 O ATOM 963 CG2 THR A 61 4.004 -0.509 -8.252 1.00 0.00 C ATOM 0 H THR A 61 2.090 -2.429 -9.311 1.00 0.00 H new ATOM 0 HA THR A 61 1.525 0.264 -8.696 1.00 0.00 H new ATOM 0 HB THR A 61 3.667 0.642 -10.023 1.00 0.00 H new ATOM 0 HG1 THR A 61 3.878 -2.211 -10.033 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.090 -0.481 -8.341 1.00 0.00 H new ATOM 0 HG22 THR A 61 3.673 0.294 -7.594 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.699 -1.469 -7.834 1.00 0.00 H new ATOM 971 N LYS A 62 1.046 -0.684 -11.796 1.00 0.00 N ATOM 972 CA LYS A 62 0.436 -0.303 -13.062 1.00 0.00 C ATOM 973 C LYS A 62 -0.987 0.213 -12.850 1.00 0.00 C ATOM 974 O LYS A 62 -1.307 1.339 -13.226 1.00 0.00 O ATOM 975 CB LYS A 62 0.423 -1.503 -14.013 1.00 0.00 C ATOM 976 CG LYS A 62 0.299 -1.135 -15.483 1.00 0.00 C ATOM 977 CD LYS A 62 1.433 -0.221 -15.913 1.00 0.00 C ATOM 978 CE LYS A 62 1.543 -0.129 -17.426 1.00 0.00 C ATOM 979 NZ LYS A 62 1.989 -1.416 -18.025 1.00 0.00 N ATOM 0 H LYS A 62 1.319 -1.665 -11.741 1.00 0.00 H new ATOM 0 HA LYS A 62 1.027 0.501 -13.501 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.340 -2.075 -13.870 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -0.406 -2.157 -13.743 1.00 0.00 H new ATOM 0 HG2 LYS A 62 0.307 -2.040 -16.090 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -0.657 -0.642 -15.659 1.00 0.00 H new ATOM 0 HD2 LYS A 62 1.274 0.775 -15.499 1.00 0.00 H new ATOM 0 HD3 LYS A 62 2.373 -0.590 -15.502 1.00 0.00 H new ATOM 0 HE2 LYS A 62 0.577 0.152 -17.845 1.00 0.00 H new ATOM 0 HE3 LYS A 62 2.247 0.660 -17.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 2.343 -1.246 -18.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 2.748 -1.825 -17.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 1.188 -2.078 -18.062 1.00 0.00 H new ATOM 993 N ALA A 63 -1.823 -0.606 -12.222 1.00 0.00 N ATOM 994 CA ALA A 63 -3.230 -0.265 -12.028 1.00 0.00 C ATOM 995 C ALA A 63 -3.400 0.851 -11.005 1.00 0.00 C ATOM 996 O ALA A 63 -4.341 1.644 -11.091 1.00 0.00 O ATOM 997 CB ALA A 63 -4.018 -1.496 -11.607 1.00 0.00 C ATOM 0 H ALA A 63 -1.552 -1.511 -11.838 1.00 0.00 H new ATOM 0 HA ALA A 63 -3.619 0.097 -12.980 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.065 -1.227 -11.466 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -3.941 -2.260 -12.381 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -3.614 -1.884 -10.672 1.00 0.00 H new ATOM 1003 N LEU A 64 -2.489 0.916 -10.043 1.00 0.00 N ATOM 1004 CA LEU A 64 -2.538 1.946 -9.013 1.00 0.00 C ATOM 1005 C LEU A 64 -2.391 3.325 -9.650 1.00 0.00 C ATOM 1006 O LEU A 64 -3.176 4.232 -9.376 1.00 0.00 O ATOM 1007 CB LEU A 64 -1.441 1.697 -7.965 1.00 0.00 C ATOM 1008 CG LEU A 64 -1.640 2.371 -6.597 1.00 0.00 C ATOM 1009 CD1 LEU A 64 -0.954 1.559 -5.510 1.00 0.00 C ATOM 1010 CD2 LEU A 64 -1.090 3.788 -6.597 1.00 0.00 C ATOM 0 H LEU A 64 -1.707 0.267 -9.954 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.503 1.906 -8.507 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.356 0.622 -7.808 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.490 2.035 -8.378 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.711 2.417 -6.399 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -1.101 2.045 -4.545 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.381 0.557 -5.480 1.00 0.00 H new ATOM 0 HD13 LEU A 64 0.113 1.493 -5.724 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.245 4.239 -5.617 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.023 3.764 -6.821 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.606 4.379 -7.354 1.00 0.00 H new ATOM 1022 N LYS A 65 -1.410 3.470 -10.536 1.00 0.00 N ATOM 1023 CA LYS A 65 -1.197 4.743 -11.215 1.00 0.00 C ATOM 1024 C LYS A 65 -2.358 5.066 -12.150 1.00 0.00 C ATOM 1025 O LYS A 65 -2.725 6.227 -12.305 1.00 0.00 O ATOM 1026 CB LYS A 65 0.123 4.758 -11.986 1.00 0.00 C ATOM 1027 CG LYS A 65 1.345 4.694 -11.087 1.00 0.00 C ATOM 1028 CD LYS A 65 2.614 5.092 -11.825 1.00 0.00 C ATOM 1029 CE LYS A 65 2.960 4.116 -12.937 1.00 0.00 C ATOM 1030 NZ LYS A 65 4.172 4.546 -13.680 1.00 0.00 N ATOM 0 H LYS A 65 -0.757 2.731 -10.798 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.145 5.513 -10.445 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.143 3.914 -12.675 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.172 5.664 -12.590 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.201 5.353 -10.231 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.455 3.683 -10.695 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.490 6.090 -12.245 1.00 0.00 H new ATOM 0 HD3 LYS A 65 3.442 5.144 -11.118 1.00 0.00 H new ATOM 0 HE2 LYS A 65 3.123 3.124 -12.515 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.119 4.035 -13.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.381 3.858 -14.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.006 5.482 -14.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.979 4.600 -13.026 1.00 0.00 H new ATOM 1044 N GLN A 66 -2.951 4.039 -12.754 1.00 0.00 N ATOM 1045 CA GLN A 66 -4.112 4.235 -13.623 1.00 0.00 C ATOM 1046 C GLN A 66 -5.284 4.806 -12.827 1.00 0.00 C ATOM 1047 O GLN A 66 -6.120 5.532 -13.366 1.00 0.00 O ATOM 1048 CB GLN A 66 -4.532 2.917 -14.284 1.00 0.00 C ATOM 1049 CG GLN A 66 -3.472 2.311 -15.186 1.00 0.00 C ATOM 1050 CD GLN A 66 -3.933 1.023 -15.842 1.00 0.00 C ATOM 1051 OE1 GLN A 66 -5.116 0.849 -16.138 1.00 0.00 O ATOM 1052 NE2 GLN A 66 -3.007 0.104 -16.060 1.00 0.00 N ATOM 0 H GLN A 66 -2.651 3.069 -12.660 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.829 4.942 -14.403 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.786 2.197 -13.506 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -5.436 3.088 -14.868 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -3.202 3.031 -15.958 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -2.572 2.116 -14.603 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -2.037 0.286 -15.801 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -3.263 -0.786 -16.487 1.00 0.00 H new ATOM 1061 N SER A 67 -5.326 4.480 -11.542 1.00 0.00 N ATOM 1062 CA SER A 67 -6.399 4.932 -10.670 1.00 0.00 C ATOM 1063 C SER A 67 -6.080 6.299 -10.061 1.00 0.00 C ATOM 1064 O SER A 67 -6.976 7.014 -9.617 1.00 0.00 O ATOM 1065 CB SER A 67 -6.639 3.904 -9.562 1.00 0.00 C ATOM 1066 OG SER A 67 -6.874 2.612 -10.106 1.00 0.00 O ATOM 0 H SER A 67 -4.625 3.901 -11.080 1.00 0.00 H new ATOM 0 HA SER A 67 -7.304 5.034 -11.269 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.775 3.871 -8.899 1.00 0.00 H new ATOM 0 HB3 SER A 67 -7.493 4.209 -8.958 1.00 0.00 H new ATOM 0 HG SER A 67 -6.031 2.240 -10.441 1.00 0.00 H new ATOM 1072 N VAL A 68 -4.801 6.655 -10.042 1.00 0.00 N ATOM 1073 CA VAL A 68 -4.372 7.920 -9.449 1.00 0.00 C ATOM 1074 C VAL A 68 -4.279 9.033 -10.494 1.00 0.00 C ATOM 1075 O VAL A 68 -4.686 10.167 -10.234 1.00 0.00 O ATOM 1076 CB VAL A 68 -3.012 7.774 -8.732 1.00 0.00 C ATOM 1077 CG1 VAL A 68 -2.504 9.124 -8.248 1.00 0.00 C ATOM 1078 CG2 VAL A 68 -3.130 6.806 -7.565 1.00 0.00 C ATOM 0 H VAL A 68 -4.045 6.090 -10.428 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.132 8.193 -8.716 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.293 7.376 -9.448 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.545 8.993 -7.747 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.380 9.793 -9.100 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.222 9.554 -7.550 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.163 6.714 -7.070 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.867 7.180 -6.855 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.444 5.829 -7.933 1.00 0.00 H new ATOM 1088 N LEU A 69 -3.746 8.709 -11.667 1.00 0.00 N ATOM 1089 CA LEU A 69 -3.547 9.703 -12.722 1.00 0.00 C ATOM 1090 C LEU A 69 -4.868 10.310 -13.185 1.00 0.00 C ATOM 1091 O LEU A 69 -4.931 11.495 -13.514 1.00 0.00 O ATOM 1092 CB LEU A 69 -2.802 9.092 -13.914 1.00 0.00 C ATOM 1093 CG LEU A 69 -1.277 9.268 -13.898 1.00 0.00 C ATOM 1094 CD1 LEU A 69 -0.663 8.641 -12.657 1.00 0.00 C ATOM 1095 CD2 LEU A 69 -0.666 8.674 -15.156 1.00 0.00 C ATOM 0 H LEU A 69 -3.443 7.767 -11.914 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.940 10.503 -12.298 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.027 8.026 -13.954 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -3.192 9.535 -14.830 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.059 10.336 -13.873 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.418 8.782 -12.675 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.076 9.116 -11.767 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.889 7.575 -12.638 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.416 8.805 -15.132 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.901 7.611 -15.208 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.074 9.179 -16.032 1.00 0.00 H new ATOM 1354 N SER B 8 10.421 9.930 13.626 1.00 0.00 N ATOM 1355 CA SER B 8 10.942 9.076 14.671 1.00 0.00 C ATOM 1356 C SER B 8 10.851 7.620 14.229 1.00 0.00 C ATOM 1357 O SER B 8 9.772 7.146 13.864 1.00 0.00 O ATOM 1358 CB SER B 8 10.152 9.307 15.960 1.00 0.00 C ATOM 1359 OG SER B 8 8.762 9.384 15.692 1.00 0.00 O ATOM 0 HA SER B 8 11.988 9.315 14.860 1.00 0.00 H new ATOM 0 HB2 SER B 8 10.347 8.496 16.662 1.00 0.00 H new ATOM 0 HB3 SER B 8 10.487 10.228 16.437 1.00 0.00 H new ATOM 0 HG SER B 8 8.622 9.573 14.741 1.00 0.00 H new ATOM 1365 N ASN B 9 11.982 6.918 14.251 1.00 0.00 N ATOM 1366 CA ASN B 9 12.033 5.530 13.789 1.00 0.00 C ATOM 1367 C ASN B 9 11.054 4.662 14.572 1.00 0.00 C ATOM 1368 O ASN B 9 10.405 3.784 14.010 1.00 0.00 O ATOM 1369 CB ASN B 9 13.451 4.955 13.911 1.00 0.00 C ATOM 1370 CG ASN B 9 14.435 5.578 12.936 1.00 0.00 C ATOM 1371 OD1 ASN B 9 14.568 5.130 11.795 1.00 0.00 O ATOM 1372 ND2 ASN B 9 15.151 6.598 13.382 1.00 0.00 N ATOM 0 H ASN B 9 12.874 7.285 14.583 1.00 0.00 H new ATOM 0 HA ASN B 9 11.747 5.525 12.737 1.00 0.00 H new ATOM 0 HB2 ASN B 9 13.812 5.107 14.928 1.00 0.00 H new ATOM 0 HB3 ASN B 9 13.415 3.879 13.743 1.00 0.00 H new ATOM 0 HD21 ASN B 9 15.841 7.041 12.775 1.00 0.00 H new ATOM 0 HD22 ASN B 9 15.013 6.941 14.333 1.00 0.00 H new ATOM 1379 N GLU B 10 10.949 4.933 15.867 1.00 0.00 N ATOM 1380 CA GLU B 10 10.041 4.204 16.751 1.00 0.00 C ATOM 1381 C GLU B 10 8.600 4.307 16.257 1.00 0.00 C ATOM 1382 O GLU B 10 7.851 3.328 16.280 1.00 0.00 O ATOM 1383 CB GLU B 10 10.117 4.749 18.186 1.00 0.00 C ATOM 1384 CG GLU B 10 11.520 4.792 18.781 1.00 0.00 C ATOM 1385 CD GLU B 10 12.360 5.928 18.230 1.00 0.00 C ATOM 1386 OE1 GLU B 10 12.194 7.074 18.698 1.00 0.00 O ATOM 1387 OE2 GLU B 10 13.169 5.681 17.314 1.00 0.00 O ATOM 0 H GLU B 10 11.488 5.661 16.335 1.00 0.00 H new ATOM 0 HA GLU B 10 10.351 3.159 16.745 1.00 0.00 H new ATOM 0 HB2 GLU B 10 9.701 5.756 18.199 1.00 0.00 H new ATOM 0 HB3 GLU B 10 9.485 4.135 18.827 1.00 0.00 H new ATOM 0 HG2 GLU B 10 11.447 4.893 19.864 1.00 0.00 H new ATOM 0 HG3 GLU B 10 12.023 3.846 18.582 1.00 0.00 H new ATOM 1394 N ARG B 11 8.221 5.495 15.807 1.00 0.00 N ATOM 1395 CA ARG B 11 6.855 5.740 15.372 1.00 0.00 C ATOM 1396 C ARG B 11 6.597 5.092 14.019 1.00 0.00 C ATOM 1397 O ARG B 11 5.570 4.440 13.822 1.00 0.00 O ATOM 1398 CB ARG B 11 6.574 7.242 15.305 1.00 0.00 C ATOM 1399 CG ARG B 11 5.114 7.564 15.056 1.00 0.00 C ATOM 1400 CD ARG B 11 4.793 9.021 15.331 1.00 0.00 C ATOM 1401 NE ARG B 11 3.359 9.219 15.502 1.00 0.00 N ATOM 1402 CZ ARG B 11 2.792 10.376 15.830 1.00 0.00 C ATOM 1403 NH1 ARG B 11 3.532 11.467 15.999 1.00 0.00 N ATOM 1404 NH2 ARG B 11 1.481 10.438 16.010 1.00 0.00 N ATOM 0 H ARG B 11 8.840 6.303 15.734 1.00 0.00 H new ATOM 0 HA ARG B 11 6.180 5.293 16.102 1.00 0.00 H new ATOM 0 HB2 ARG B 11 6.888 7.706 16.240 1.00 0.00 H new ATOM 0 HB3 ARG B 11 7.177 7.683 14.512 1.00 0.00 H new ATOM 0 HG2 ARG B 11 4.863 7.327 14.022 1.00 0.00 H new ATOM 0 HG3 ARG B 11 4.491 6.931 15.688 1.00 0.00 H new ATOM 0 HD2 ARG B 11 5.318 9.349 16.228 1.00 0.00 H new ATOM 0 HD3 ARG B 11 5.153 9.638 14.507 1.00 0.00 H new ATOM 0 HE ARG B 11 2.748 8.414 15.360 1.00 0.00 H new ATOM 0 HH11 ARG B 11 4.544 11.421 15.877 1.00 0.00 H new ATOM 0 HH12 ARG B 11 3.088 12.350 16.251 1.00 0.00 H new ATOM 0 HH21 ARG B 11 0.911 9.600 15.897 1.00 0.00 H new ATOM 0 HH22 ARG B 11 1.042 11.324 16.262 1.00 0.00 H new ATOM 1418 N VAL B 12 7.539 5.265 13.097 1.00 0.00 N ATOM 1419 CA VAL B 12 7.442 4.663 11.770 1.00 0.00 C ATOM 1420 C VAL B 12 7.319 3.147 11.888 1.00 0.00 C ATOM 1421 O VAL B 12 6.506 2.521 11.205 1.00 0.00 O ATOM 1422 CB VAL B 12 8.676 5.008 10.904 1.00 0.00 C ATOM 1423 CG1 VAL B 12 8.558 4.395 9.516 1.00 0.00 C ATOM 1424 CG2 VAL B 12 8.862 6.517 10.810 1.00 0.00 C ATOM 0 H VAL B 12 8.382 5.820 13.245 1.00 0.00 H new ATOM 0 HA VAL B 12 6.553 5.069 11.287 1.00 0.00 H new ATOM 0 HB VAL B 12 9.555 4.582 11.387 1.00 0.00 H new ATOM 0 HG11 VAL B 12 9.439 4.653 8.928 1.00 0.00 H new ATOM 0 HG12 VAL B 12 8.484 3.311 9.602 1.00 0.00 H new ATOM 0 HG13 VAL B 12 7.666 4.781 9.022 1.00 0.00 H new ATOM 0 HG21 VAL B 12 9.735 6.738 10.197 1.00 0.00 H new ATOM 0 HG22 VAL B 12 7.978 6.965 10.357 1.00 0.00 H new ATOM 0 HG23 VAL B 12 9.006 6.929 11.809 1.00 0.00 H new ATOM 1434 N GLU B 13 8.122 2.580 12.780 1.00 0.00 N ATOM 1435 CA GLU B 13 8.114 1.150 13.046 1.00 0.00 C ATOM 1436 C GLU B 13 6.722 0.682 13.460 1.00 0.00 C ATOM 1437 O GLU B 13 6.183 -0.271 12.894 1.00 0.00 O ATOM 1438 CB GLU B 13 9.124 0.839 14.148 1.00 0.00 C ATOM 1439 CG GLU B 13 9.223 -0.630 14.507 1.00 0.00 C ATOM 1440 CD GLU B 13 10.171 -0.864 15.659 1.00 0.00 C ATOM 1441 OE1 GLU B 13 11.390 -0.990 15.417 1.00 0.00 O ATOM 1442 OE2 GLU B 13 9.708 -0.905 16.816 1.00 0.00 O ATOM 0 H GLU B 13 8.797 3.101 13.339 1.00 0.00 H new ATOM 0 HA GLU B 13 8.390 0.619 12.135 1.00 0.00 H new ATOM 0 HB2 GLU B 13 10.107 1.191 13.834 1.00 0.00 H new ATOM 0 HB3 GLU B 13 8.854 1.402 15.041 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.234 -1.008 14.768 1.00 0.00 H new ATOM 0 HG3 GLU B 13 9.561 -1.194 13.638 1.00 0.00 H new ATOM 1449 N LYS B 14 6.142 1.369 14.440 1.00 0.00 N ATOM 1450 CA LYS B 14 4.814 1.026 14.931 1.00 0.00 C ATOM 1451 C LYS B 14 3.776 1.102 13.818 1.00 0.00 C ATOM 1452 O LYS B 14 2.946 0.210 13.684 1.00 0.00 O ATOM 1453 CB LYS B 14 4.399 1.941 16.088 1.00 0.00 C ATOM 1454 CG LYS B 14 2.925 1.815 16.444 1.00 0.00 C ATOM 1455 CD LYS B 14 2.539 2.690 17.622 1.00 0.00 C ATOM 1456 CE LYS B 14 1.025 2.769 17.767 1.00 0.00 C ATOM 1457 NZ LYS B 14 0.399 1.420 17.826 1.00 0.00 N ATOM 0 H LYS B 14 6.572 2.166 14.909 1.00 0.00 H new ATOM 0 HA LYS B 14 4.861 -0.001 15.294 1.00 0.00 H new ATOM 0 HB2 LYS B 14 5.001 1.704 16.965 1.00 0.00 H new ATOM 0 HB3 LYS B 14 4.616 2.976 15.822 1.00 0.00 H new ATOM 0 HG2 LYS B 14 2.320 2.087 15.579 1.00 0.00 H new ATOM 0 HG3 LYS B 14 2.698 0.775 16.677 1.00 0.00 H new ATOM 0 HD2 LYS B 14 2.976 2.289 18.537 1.00 0.00 H new ATOM 0 HD3 LYS B 14 2.948 3.691 17.486 1.00 0.00 H new ATOM 0 HE2 LYS B 14 0.776 3.324 18.671 1.00 0.00 H new ATOM 0 HE3 LYS B 14 0.609 3.325 16.927 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -0.553 1.497 18.238 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 0.330 1.027 16.866 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 0.982 0.792 18.416 1.00 0.00 H new ATOM 1471 N ILE B 15 3.832 2.159 13.015 1.00 0.00 N ATOM 1472 CA ILE B 15 2.848 2.358 11.955 1.00 0.00 C ATOM 1473 C ILE B 15 2.862 1.187 10.976 1.00 0.00 C ATOM 1474 O ILE B 15 1.812 0.647 10.627 1.00 0.00 O ATOM 1475 CB ILE B 15 3.089 3.677 11.187 1.00 0.00 C ATOM 1476 CG1 ILE B 15 3.050 4.867 12.151 1.00 0.00 C ATOM 1477 CG2 ILE B 15 2.047 3.851 10.088 1.00 0.00 C ATOM 1478 CD1 ILE B 15 3.383 6.190 11.494 1.00 0.00 C ATOM 0 H ILE B 15 4.543 2.888 13.076 1.00 0.00 H new ATOM 0 HA ILE B 15 1.871 2.416 12.435 1.00 0.00 H new ATOM 0 HB ILE B 15 4.075 3.634 10.725 1.00 0.00 H new ATOM 0 HG12 ILE B 15 2.057 4.931 12.596 1.00 0.00 H new ATOM 0 HG13 ILE B 15 3.753 4.688 12.965 1.00 0.00 H new ATOM 0 HG21 ILE B 15 2.231 4.785 9.557 1.00 0.00 H new ATOM 0 HG22 ILE B 15 2.112 3.017 9.389 1.00 0.00 H new ATOM 0 HG23 ILE B 15 1.051 3.876 10.531 1.00 0.00 H new ATOM 0 HD11 ILE B 15 3.336 6.987 12.236 1.00 0.00 H new ATOM 0 HD12 ILE B 15 4.388 6.145 11.074 1.00 0.00 H new ATOM 0 HD13 ILE B 15 2.666 6.392 10.699 1.00 0.00 H new ATOM 1490 N ILE B 16 4.057 0.787 10.553 1.00 0.00 N ATOM 1491 CA ILE B 16 4.203 -0.343 9.644 1.00 0.00 C ATOM 1492 C ILE B 16 3.662 -1.620 10.284 1.00 0.00 C ATOM 1493 O ILE B 16 2.935 -2.386 9.650 1.00 0.00 O ATOM 1494 CB ILE B 16 5.680 -0.561 9.240 1.00 0.00 C ATOM 1495 CG1 ILE B 16 6.249 0.701 8.581 1.00 0.00 C ATOM 1496 CG2 ILE B 16 5.804 -1.755 8.300 1.00 0.00 C ATOM 1497 CD1 ILE B 16 7.724 0.601 8.247 1.00 0.00 C ATOM 0 H ILE B 16 4.936 1.228 10.825 1.00 0.00 H new ATOM 0 HA ILE B 16 3.628 -0.111 8.747 1.00 0.00 H new ATOM 0 HB ILE B 16 6.257 -0.769 10.141 1.00 0.00 H new ATOM 0 HG12 ILE B 16 5.692 0.906 7.667 1.00 0.00 H new ATOM 0 HG13 ILE B 16 6.093 1.550 9.247 1.00 0.00 H new ATOM 0 HG21 ILE B 16 6.850 -1.895 8.025 1.00 0.00 H new ATOM 0 HG22 ILE B 16 5.437 -2.651 8.800 1.00 0.00 H new ATOM 0 HG23 ILE B 16 5.214 -1.574 7.402 1.00 0.00 H new ATOM 0 HD11 ILE B 16 8.056 1.530 7.784 1.00 0.00 H new ATOM 0 HD12 ILE B 16 8.293 0.427 9.160 1.00 0.00 H new ATOM 0 HD13 ILE B 16 7.885 -0.227 7.556 1.00 0.00 H new ATOM 1509 N GLN B 17 4.010 -1.827 11.549 1.00 0.00 N ATOM 1510 CA GLN B 17 3.566 -3.003 12.285 1.00 0.00 C ATOM 1511 C GLN B 17 2.043 -3.015 12.420 1.00 0.00 C ATOM 1512 O GLN B 17 1.401 -4.026 12.140 1.00 0.00 O ATOM 1513 CB GLN B 17 4.232 -3.036 13.663 1.00 0.00 C ATOM 1514 CG GLN B 17 3.871 -4.249 14.510 1.00 0.00 C ATOM 1515 CD GLN B 17 4.137 -5.566 13.807 1.00 0.00 C ATOM 1516 OE1 GLN B 17 5.240 -6.109 13.870 1.00 0.00 O ATOM 1517 NE2 GLN B 17 3.117 -6.103 13.159 1.00 0.00 N ATOM 0 H GLN B 17 4.600 -1.193 12.087 1.00 0.00 H new ATOM 0 HA GLN B 17 3.860 -3.895 11.731 1.00 0.00 H new ATOM 0 HB2 GLN B 17 5.314 -3.010 13.530 1.00 0.00 H new ATOM 0 HB3 GLN B 17 3.956 -2.133 14.208 1.00 0.00 H new ATOM 0 HG2 GLN B 17 4.440 -4.218 15.439 1.00 0.00 H new ATOM 0 HG3 GLN B 17 2.816 -4.195 14.781 1.00 0.00 H new ATOM 0 HE21 GLN B 17 2.219 -5.620 13.131 1.00 0.00 H new ATOM 0 HE22 GLN B 17 3.228 -7.000 12.687 1.00 0.00 H new ATOM 1526 N ASP B 18 1.478 -1.882 12.824 1.00 0.00 N ATOM 1527 CA ASP B 18 0.029 -1.740 12.978 1.00 0.00 C ATOM 1528 C ASP B 18 -0.702 -2.088 11.687 1.00 0.00 C ATOM 1529 O ASP B 18 -1.720 -2.781 11.710 1.00 0.00 O ATOM 1530 CB ASP B 18 -0.333 -0.314 13.401 1.00 0.00 C ATOM 1531 CG ASP B 18 -0.550 -0.173 14.896 1.00 0.00 C ATOM 1532 OD1 ASP B 18 0.439 -0.194 15.657 1.00 0.00 O ATOM 1533 OD2 ASP B 18 -1.715 -0.014 15.319 1.00 0.00 O ATOM 0 H ASP B 18 2.005 -1.039 13.053 1.00 0.00 H new ATOM 0 HA ASP B 18 -0.285 -2.437 13.755 1.00 0.00 H new ATOM 0 HB2 ASP B 18 0.462 0.364 13.090 1.00 0.00 H new ATOM 0 HB3 ASP B 18 -1.238 -0.005 12.878 1.00 0.00 H new ATOM 1538 N LEU B 19 -0.172 -1.615 10.564 1.00 0.00 N ATOM 1539 CA LEU B 19 -0.760 -1.902 9.260 1.00 0.00 C ATOM 1540 C LEU B 19 -0.768 -3.403 8.995 1.00 0.00 C ATOM 1541 O LEU B 19 -1.764 -3.958 8.530 1.00 0.00 O ATOM 1542 CB LEU B 19 0.009 -1.177 8.150 1.00 0.00 C ATOM 1543 CG LEU B 19 -0.053 0.351 8.209 1.00 0.00 C ATOM 1544 CD1 LEU B 19 0.824 0.960 7.127 1.00 0.00 C ATOM 1545 CD2 LEU B 19 -1.488 0.835 8.069 1.00 0.00 C ATOM 0 H LEU B 19 0.664 -1.031 10.530 1.00 0.00 H new ATOM 0 HA LEU B 19 -1.789 -1.542 9.265 1.00 0.00 H new ATOM 0 HB2 LEU B 19 1.054 -1.485 8.192 1.00 0.00 H new ATOM 0 HB3 LEU B 19 -0.381 -1.504 7.186 1.00 0.00 H new ATOM 0 HG LEU B 19 0.323 0.673 9.180 1.00 0.00 H new ATOM 0 HD11 LEU B 19 0.769 2.047 7.183 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.856 0.641 7.273 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.477 0.629 6.148 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -1.511 1.924 8.113 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -1.893 0.502 7.113 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -2.091 0.426 8.880 1.00 0.00 H new ATOM 1557 N LEU B 20 0.341 -4.057 9.319 1.00 0.00 N ATOM 1558 CA LEU B 20 0.461 -5.497 9.136 1.00 0.00 C ATOM 1559 C LEU B 20 -0.473 -6.239 10.083 1.00 0.00 C ATOM 1560 O LEU B 20 -1.037 -7.276 9.729 1.00 0.00 O ATOM 1561 CB LEU B 20 1.908 -5.948 9.360 1.00 0.00 C ATOM 1562 CG LEU B 20 2.933 -5.356 8.389 1.00 0.00 C ATOM 1563 CD1 LEU B 20 4.337 -5.831 8.738 1.00 0.00 C ATOM 1564 CD2 LEU B 20 2.584 -5.727 6.954 1.00 0.00 C ATOM 0 H LEU B 20 1.171 -3.612 9.710 1.00 0.00 H new ATOM 0 HA LEU B 20 0.176 -5.735 8.111 1.00 0.00 H new ATOM 0 HB2 LEU B 20 2.200 -5.685 10.377 1.00 0.00 H new ATOM 0 HB3 LEU B 20 1.948 -7.035 9.288 1.00 0.00 H new ATOM 0 HG LEU B 20 2.906 -4.270 8.480 1.00 0.00 H new ATOM 0 HD11 LEU B 20 5.052 -5.400 8.037 1.00 0.00 H new ATOM 0 HD12 LEU B 20 4.587 -5.515 9.751 1.00 0.00 H new ATOM 0 HD13 LEU B 20 4.379 -6.918 8.676 1.00 0.00 H new ATOM 0 HD21 LEU B 20 3.323 -5.298 6.277 1.00 0.00 H new ATOM 0 HD22 LEU B 20 2.582 -6.812 6.849 1.00 0.00 H new ATOM 0 HD23 LEU B 20 1.596 -5.337 6.707 1.00 0.00 H new ATOM 1576 N ASP B 21 -0.637 -5.699 11.287 1.00 0.00 N ATOM 1577 CA ASP B 21 -1.541 -6.283 12.270 1.00 0.00 C ATOM 1578 C ASP B 21 -2.978 -6.233 11.774 1.00 0.00 C ATOM 1579 O ASP B 21 -3.700 -7.218 11.869 1.00 0.00 O ATOM 1580 CB ASP B 21 -1.434 -5.576 13.624 1.00 0.00 C ATOM 1581 CG ASP B 21 -0.198 -5.977 14.402 1.00 0.00 C ATOM 1582 OD1 ASP B 21 -0.086 -7.166 14.780 1.00 0.00 O ATOM 1583 OD2 ASP B 21 0.656 -5.106 14.667 1.00 0.00 O ATOM 0 H ASP B 21 -0.155 -4.858 11.605 1.00 0.00 H new ATOM 0 HA ASP B 21 -1.245 -7.323 12.405 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -1.423 -4.498 13.465 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -2.320 -5.802 14.217 1.00 0.00 H new ATOM 1588 N VAL B 22 -3.388 -5.090 11.233 1.00 0.00 N ATOM 1589 CA VAL B 22 -4.738 -4.946 10.690 1.00 0.00 C ATOM 1590 C VAL B 22 -4.980 -5.950 9.563 1.00 0.00 C ATOM 1591 O VAL B 22 -6.055 -6.542 9.467 1.00 0.00 O ATOM 1592 CB VAL B 22 -5.005 -3.514 10.171 1.00 0.00 C ATOM 1593 CG1 VAL B 22 -6.363 -3.423 9.483 1.00 0.00 C ATOM 1594 CG2 VAL B 22 -4.924 -2.509 11.310 1.00 0.00 C ATOM 0 H VAL B 22 -2.810 -4.253 11.158 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.429 -5.145 11.509 1.00 0.00 H new ATOM 0 HB VAL B 22 -4.235 -3.276 9.437 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -6.524 -2.405 9.128 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -6.389 -4.110 8.637 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.148 -3.689 10.191 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -5.115 -1.507 10.925 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -5.669 -2.755 12.066 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -3.930 -2.543 11.756 1.00 0.00 H new ATOM 1604 N LEU B 23 -3.965 -6.158 8.733 1.00 0.00 N ATOM 1605 CA LEU B 23 -4.067 -7.089 7.614 1.00 0.00 C ATOM 1606 C LEU B 23 -4.385 -8.504 8.097 1.00 0.00 C ATOM 1607 O LEU B 23 -5.323 -9.139 7.609 1.00 0.00 O ATOM 1608 CB LEU B 23 -2.772 -7.088 6.798 1.00 0.00 C ATOM 1609 CG LEU B 23 -2.449 -5.769 6.095 1.00 0.00 C ATOM 1610 CD1 LEU B 23 -1.118 -5.863 5.363 1.00 0.00 C ATOM 1611 CD2 LEU B 23 -3.563 -5.393 5.127 1.00 0.00 C ATOM 0 H LEU B 23 -3.060 -5.694 8.813 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.887 -6.757 6.977 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -1.944 -7.341 7.460 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -2.833 -7.876 6.048 1.00 0.00 H new ATOM 0 HG LEU B 23 -2.370 -4.988 6.852 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -0.906 -4.914 4.869 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.325 -6.085 6.077 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -1.168 -6.657 4.618 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -3.316 -4.452 4.636 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -3.673 -6.176 4.377 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -4.499 -5.282 5.675 1.00 0.00 H new ATOM 1623 N VAL B 24 -3.623 -8.989 9.071 1.00 0.00 N ATOM 1624 CA VAL B 24 -3.834 -10.333 9.596 1.00 0.00 C ATOM 1625 C VAL B 24 -5.065 -10.365 10.506 1.00 0.00 C ATOM 1626 O VAL B 24 -5.709 -11.404 10.672 1.00 0.00 O ATOM 1627 CB VAL B 24 -2.586 -10.859 10.348 1.00 0.00 C ATOM 1628 CG1 VAL B 24 -2.289 -10.024 11.583 1.00 0.00 C ATOM 1629 CG2 VAL B 24 -2.749 -12.331 10.709 1.00 0.00 C ATOM 0 H VAL B 24 -2.859 -8.476 9.510 1.00 0.00 H new ATOM 0 HA VAL B 24 -4.007 -10.995 8.747 1.00 0.00 H new ATOM 0 HB VAL B 24 -1.732 -10.768 9.677 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -1.407 -10.420 12.087 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -2.105 -8.991 11.288 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -3.142 -10.061 12.261 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -1.860 -12.677 11.236 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -3.622 -12.454 11.350 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -2.882 -12.916 9.799 1.00 0.00 H new ATOM 1639 N LYS B 25 -5.397 -9.213 11.071 1.00 0.00 N ATOM 1640 CA LYS B 25 -6.594 -9.054 11.888 1.00 0.00 C ATOM 1641 C LYS B 25 -7.855 -9.209 11.033 1.00 0.00 C ATOM 1642 O LYS B 25 -8.853 -9.777 11.480 1.00 0.00 O ATOM 1643 CB LYS B 25 -6.545 -7.691 12.593 1.00 0.00 C ATOM 1644 CG LYS B 25 -7.871 -7.175 13.120 1.00 0.00 C ATOM 1645 CD LYS B 25 -8.365 -6.014 12.274 1.00 0.00 C ATOM 1646 CE LYS B 25 -9.545 -5.310 12.914 1.00 0.00 C ATOM 1647 NZ LYS B 25 -10.066 -4.221 12.048 1.00 0.00 N ATOM 0 H LYS B 25 -4.844 -8.361 10.976 1.00 0.00 H new ATOM 0 HA LYS B 25 -6.628 -9.835 12.648 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -5.845 -7.758 13.426 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -6.141 -6.956 11.896 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -8.609 -7.977 13.113 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -7.758 -6.855 14.156 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -7.554 -5.301 12.126 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -8.652 -6.379 11.288 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -10.338 -6.032 13.109 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -9.245 -4.898 13.877 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -10.756 -3.654 12.581 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -9.279 -3.613 11.744 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -10.528 -4.633 11.212 1.00 0.00 H new ATOM 1661 N GLU B 26 -7.798 -8.717 9.800 1.00 0.00 N ATOM 1662 CA GLU B 26 -8.891 -8.905 8.849 1.00 0.00 C ATOM 1663 C GLU B 26 -8.733 -10.228 8.106 1.00 0.00 C ATOM 1664 O GLU B 26 -9.603 -10.622 7.328 1.00 0.00 O ATOM 1665 CB GLU B 26 -8.931 -7.756 7.841 1.00 0.00 C ATOM 1666 CG GLU B 26 -9.307 -6.415 8.448 1.00 0.00 C ATOM 1667 CD GLU B 26 -10.717 -6.398 9.014 1.00 0.00 C ATOM 1668 OE1 GLU B 26 -11.616 -7.020 8.412 1.00 0.00 O ATOM 1669 OE2 GLU B 26 -10.930 -5.776 10.077 1.00 0.00 O ATOM 0 H GLU B 26 -7.008 -8.185 9.435 1.00 0.00 H new ATOM 0 HA GLU B 26 -9.826 -8.920 9.410 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -7.953 -7.668 7.367 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -9.645 -8.001 7.055 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -8.600 -6.169 9.240 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -9.216 -5.639 7.688 1.00 0.00 H new ATOM 1676 N GLU B 27 -7.605 -10.896 8.346 1.00 0.00 N ATOM 1677 CA GLU B 27 -7.302 -12.187 7.729 1.00 0.00 C ATOM 1678 C GLU B 27 -7.272 -12.063 6.207 1.00 0.00 C ATOM 1679 O GLU B 27 -7.771 -12.931 5.489 1.00 0.00 O ATOM 1680 CB GLU B 27 -8.333 -13.237 8.152 1.00 0.00 C ATOM 1681 CG GLU B 27 -8.527 -13.332 9.658 1.00 0.00 C ATOM 1682 CD GLU B 27 -9.531 -14.394 10.045 1.00 0.00 C ATOM 1683 OE1 GLU B 27 -10.743 -14.178 9.840 1.00 0.00 O ATOM 1684 OE2 GLU B 27 -9.112 -15.457 10.555 1.00 0.00 O ATOM 0 H GLU B 27 -6.876 -10.557 8.974 1.00 0.00 H new ATOM 0 HA GLU B 27 -6.317 -12.505 8.070 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -9.290 -13.002 7.685 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -8.024 -14.211 7.772 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -7.570 -13.551 10.132 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -8.858 -12.366 10.040 1.00 0.00 H new ATOM 1691 N VAL B 28 -6.683 -10.976 5.725 1.00 0.00 N ATOM 1692 CA VAL B 28 -6.628 -10.701 4.290 1.00 0.00 C ATOM 1693 C VAL B 28 -5.800 -11.736 3.525 1.00 0.00 C ATOM 1694 O VAL B 28 -4.841 -12.302 4.051 1.00 0.00 O ATOM 1695 CB VAL B 28 -6.050 -9.299 4.002 1.00 0.00 C ATOM 1696 CG1 VAL B 28 -6.895 -8.229 4.668 1.00 0.00 C ATOM 1697 CG2 VAL B 28 -4.602 -9.202 4.459 1.00 0.00 C ATOM 0 H VAL B 28 -6.235 -10.267 6.306 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.660 -10.753 3.943 1.00 0.00 H new ATOM 0 HB VAL B 28 -6.074 -9.137 2.924 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.473 -7.247 4.455 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.914 -8.278 4.283 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -6.906 -8.393 5.746 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -4.219 -8.204 4.245 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -4.546 -9.390 5.531 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -4.003 -9.942 3.929 1.00 0.00 H new ATOM 1707 N THR B 29 -6.201 -11.981 2.286 1.00 0.00 N ATOM 1708 CA THR B 29 -5.440 -12.810 1.363 1.00 0.00 C ATOM 1709 C THR B 29 -4.639 -11.887 0.439 1.00 0.00 C ATOM 1710 O THR B 29 -5.047 -10.745 0.248 1.00 0.00 O ATOM 1711 CB THR B 29 -6.392 -13.724 0.540 1.00 0.00 C ATOM 1712 OG1 THR B 29 -5.652 -14.640 -0.275 1.00 0.00 O ATOM 1713 CG2 THR B 29 -7.322 -12.903 -0.340 1.00 0.00 C ATOM 0 H THR B 29 -7.065 -11.610 1.892 1.00 0.00 H new ATOM 0 HA THR B 29 -4.761 -13.459 1.916 1.00 0.00 H new ATOM 0 HB THR B 29 -6.990 -14.288 1.255 1.00 0.00 H new ATOM 0 HG1 THR B 29 -6.274 -15.204 -0.781 1.00 0.00 H new ATOM 0 HG21 THR B 29 -7.975 -13.571 -0.902 1.00 0.00 H new ATOM 0 HG22 THR B 29 -7.927 -12.245 0.284 1.00 0.00 H new ATOM 0 HG23 THR B 29 -6.732 -12.304 -1.033 1.00 0.00 H new ATOM 1721 N PRO B 30 -3.484 -12.341 -0.106 1.00 0.00 N ATOM 1722 CA PRO B 30 -2.630 -11.541 -0.998 1.00 0.00 C ATOM 1723 C PRO B 30 -3.396 -10.576 -1.911 1.00 0.00 C ATOM 1724 O PRO B 30 -3.097 -9.381 -1.941 1.00 0.00 O ATOM 1725 CB PRO B 30 -1.926 -12.615 -1.821 1.00 0.00 C ATOM 1726 CG PRO B 30 -1.765 -13.765 -0.885 1.00 0.00 C ATOM 1727 CD PRO B 30 -2.888 -13.674 0.128 1.00 0.00 C ATOM 0 HA PRO B 30 -1.971 -10.881 -0.434 1.00 0.00 H new ATOM 0 HB2 PRO B 30 -2.516 -12.895 -2.694 1.00 0.00 H new ATOM 0 HB3 PRO B 30 -0.961 -12.264 -2.187 1.00 0.00 H new ATOM 0 HG2 PRO B 30 -1.809 -14.711 -1.425 1.00 0.00 H new ATOM 0 HG3 PRO B 30 -0.795 -13.726 -0.390 1.00 0.00 H new ATOM 0 HD2 PRO B 30 -3.620 -14.468 -0.017 1.00 0.00 H new ATOM 0 HD3 PRO B 30 -2.513 -13.769 1.147 1.00 0.00 H new ATOM 1735 N ASP B 31 -4.388 -11.094 -2.633 1.00 0.00 N ATOM 1736 CA ASP B 31 -5.188 -10.271 -3.550 1.00 0.00 C ATOM 1737 C ASP B 31 -5.911 -9.167 -2.782 1.00 0.00 C ATOM 1738 O ASP B 31 -5.732 -7.979 -3.055 1.00 0.00 O ATOM 1739 CB ASP B 31 -6.210 -11.142 -4.292 1.00 0.00 C ATOM 1740 CG ASP B 31 -7.061 -10.355 -5.278 1.00 0.00 C ATOM 1741 OD1 ASP B 31 -7.998 -9.651 -4.838 1.00 0.00 O ATOM 1742 OD2 ASP B 31 -6.813 -10.459 -6.495 1.00 0.00 O ATOM 0 H ASP B 31 -4.660 -12.077 -2.604 1.00 0.00 H new ATOM 0 HA ASP B 31 -4.516 -9.814 -4.276 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -5.684 -11.933 -4.826 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -6.862 -11.627 -3.565 1.00 0.00 H new ATOM 1747 N LEU B 32 -6.701 -9.582 -1.798 1.00 0.00 N ATOM 1748 CA LEU B 32 -7.476 -8.663 -0.970 1.00 0.00 C ATOM 1749 C LEU B 32 -6.570 -7.651 -0.274 1.00 0.00 C ATOM 1750 O LEU B 32 -6.901 -6.470 -0.181 1.00 0.00 O ATOM 1751 CB LEU B 32 -8.270 -9.464 0.067 1.00 0.00 C ATOM 1752 CG LEU B 32 -9.122 -8.648 1.037 1.00 0.00 C ATOM 1753 CD1 LEU B 32 -10.201 -7.877 0.295 1.00 0.00 C ATOM 1754 CD2 LEU B 32 -9.742 -9.563 2.079 1.00 0.00 C ATOM 0 H LEU B 32 -6.823 -10.564 -1.551 1.00 0.00 H new ATOM 0 HA LEU B 32 -8.162 -8.109 -1.610 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -8.922 -10.159 -0.462 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -7.569 -10.064 0.647 1.00 0.00 H new ATOM 0 HG LEU B 32 -8.479 -7.926 1.539 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.794 -7.304 1.008 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -9.736 -7.198 -0.420 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -10.847 -8.576 -0.236 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.348 -8.973 2.767 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -10.371 -10.304 1.585 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -8.953 -10.070 2.634 1.00 0.00 H new ATOM 1766 N ALA B 33 -5.427 -8.124 0.205 1.00 0.00 N ATOM 1767 CA ALA B 33 -4.462 -7.274 0.881 1.00 0.00 C ATOM 1768 C ALA B 33 -3.997 -6.153 -0.034 1.00 0.00 C ATOM 1769 O ALA B 33 -4.097 -4.979 0.313 1.00 0.00 O ATOM 1770 CB ALA B 33 -3.276 -8.100 1.351 1.00 0.00 C ATOM 0 H ALA B 33 -5.146 -9.102 0.136 1.00 0.00 H new ATOM 0 HA ALA B 33 -4.945 -6.826 1.749 1.00 0.00 H new ATOM 0 HB1 ALA B 33 -2.559 -7.453 1.856 1.00 0.00 H new ATOM 0 HB2 ALA B 33 -3.620 -8.870 2.042 1.00 0.00 H new ATOM 0 HB3 ALA B 33 -2.797 -8.571 0.492 1.00 0.00 H new ATOM 1776 N LEU B 34 -3.515 -6.524 -1.212 1.00 0.00 N ATOM 1777 CA LEU B 34 -3.014 -5.553 -2.174 1.00 0.00 C ATOM 1778 C LEU B 34 -4.125 -4.607 -2.620 1.00 0.00 C ATOM 1779 O LEU B 34 -3.914 -3.401 -2.736 1.00 0.00 O ATOM 1780 CB LEU B 34 -2.409 -6.259 -3.388 1.00 0.00 C ATOM 1781 CG LEU B 34 -1.192 -7.142 -3.096 1.00 0.00 C ATOM 1782 CD1 LEU B 34 -0.683 -7.788 -4.376 1.00 0.00 C ATOM 1783 CD2 LEU B 34 -0.093 -6.332 -2.428 1.00 0.00 C ATOM 0 H LEU B 34 -3.460 -7.493 -1.525 1.00 0.00 H new ATOM 0 HA LEU B 34 -2.236 -4.968 -1.685 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -3.180 -6.874 -3.851 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -2.122 -5.504 -4.120 1.00 0.00 H new ATOM 0 HG LEU B 34 -1.496 -7.934 -2.411 1.00 0.00 H new ATOM 0 HD11 LEU B 34 0.182 -8.412 -4.150 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -1.470 -8.403 -4.811 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -0.395 -7.012 -5.086 1.00 0.00 H new ATOM 0 HD21 LEU B 34 0.763 -6.976 -2.228 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.211 -5.518 -3.087 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -0.464 -5.920 -1.489 1.00 0.00 H new ATOM 1795 N MET B 35 -5.310 -5.160 -2.854 1.00 0.00 N ATOM 1796 CA MET B 35 -6.459 -4.367 -3.275 1.00 0.00 C ATOM 1797 C MET B 35 -6.808 -3.313 -2.229 1.00 0.00 C ATOM 1798 O MET B 35 -7.013 -2.150 -2.565 1.00 0.00 O ATOM 1799 CB MET B 35 -7.662 -5.275 -3.546 1.00 0.00 C ATOM 1800 CG MET B 35 -8.928 -4.522 -3.926 1.00 0.00 C ATOM 1801 SD MET B 35 -10.249 -5.616 -4.484 1.00 0.00 S ATOM 1802 CE MET B 35 -10.320 -6.782 -3.127 1.00 0.00 C ATOM 0 H MET B 35 -5.500 -6.158 -2.759 1.00 0.00 H new ATOM 0 HA MET B 35 -6.197 -3.851 -4.199 1.00 0.00 H new ATOM 0 HB2 MET B 35 -7.408 -5.968 -4.348 1.00 0.00 H new ATOM 0 HB3 MET B 35 -7.860 -5.874 -2.657 1.00 0.00 H new ATOM 0 HG2 MET B 35 -9.276 -3.948 -3.067 1.00 0.00 H new ATOM 0 HG3 MET B 35 -8.697 -3.806 -4.715 1.00 0.00 H new ATOM 0 HE1 MET B 35 -11.319 -7.213 -3.070 1.00 0.00 H new ATOM 0 HE2 MET B 35 -9.591 -7.576 -3.291 1.00 0.00 H new ATOM 0 HE3 MET B 35 -10.092 -6.268 -2.193 1.00 0.00 H new ATOM 1812 N CYS B 36 -6.859 -3.714 -0.964 1.00 0.00 N ATOM 1813 CA CYS B 36 -7.171 -2.781 0.113 1.00 0.00 C ATOM 1814 C CYS B 36 -6.034 -1.790 0.339 1.00 0.00 C ATOM 1815 O CYS B 36 -6.271 -0.587 0.466 1.00 0.00 O ATOM 1816 CB CYS B 36 -7.484 -3.539 1.403 1.00 0.00 C ATOM 1817 SG CYS B 36 -9.003 -4.515 1.322 1.00 0.00 S ATOM 0 H CYS B 36 -6.690 -4.673 -0.660 1.00 0.00 H new ATOM 0 HA CYS B 36 -8.053 -2.213 -0.184 1.00 0.00 H new ATOM 0 HB2 CYS B 36 -6.650 -4.200 1.637 1.00 0.00 H new ATOM 0 HB3 CYS B 36 -7.564 -2.825 2.223 1.00 0.00 H new ATOM 0 HG CYS B 36 -10.020 -3.760 1.617 1.00 0.00 H new ATOM 1823 N LEU B 37 -4.802 -2.291 0.371 1.00 0.00 N ATOM 1824 CA LEU B 37 -3.635 -1.439 0.583 1.00 0.00 C ATOM 1825 C LEU B 37 -3.512 -0.388 -0.517 1.00 0.00 C ATOM 1826 O LEU B 37 -3.421 0.805 -0.235 1.00 0.00 O ATOM 1827 CB LEU B 37 -2.354 -2.279 0.643 1.00 0.00 C ATOM 1828 CG LEU B 37 -2.189 -3.139 1.902 1.00 0.00 C ATOM 1829 CD1 LEU B 37 -0.958 -4.030 1.791 1.00 0.00 C ATOM 1830 CD2 LEU B 37 -2.092 -2.260 3.142 1.00 0.00 C ATOM 0 H LEU B 37 -4.586 -3.281 0.253 1.00 0.00 H new ATOM 0 HA LEU B 37 -3.770 -0.928 1.536 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -2.327 -2.933 -0.229 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -1.497 -1.610 0.566 1.00 0.00 H new ATOM 0 HG LEU B 37 -3.069 -3.776 1.994 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -0.861 -4.631 2.695 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -1.061 -4.687 0.928 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -0.070 -3.410 1.670 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -1.975 -2.888 4.025 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -1.231 -1.597 3.052 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -3.000 -1.664 3.238 1.00 0.00 H new ATOM 1842 N GLY B 38 -3.528 -0.839 -1.766 1.00 0.00 N ATOM 1843 CA GLY B 38 -3.384 0.068 -2.890 1.00 0.00 C ATOM 1844 C GLY B 38 -4.538 1.044 -2.995 1.00 0.00 C ATOM 1845 O GLY B 38 -4.357 2.191 -3.407 1.00 0.00 O ATOM 0 H GLY B 38 -3.639 -1.820 -2.021 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.451 0.622 -2.789 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -3.314 -0.509 -3.812 1.00 0.00 H new ATOM 1849 N ASN B 39 -5.722 0.593 -2.607 1.00 0.00 N ATOM 1850 CA ASN B 39 -6.911 1.436 -2.634 1.00 0.00 C ATOM 1851 C ASN B 39 -6.782 2.552 -1.599 1.00 0.00 C ATOM 1852 O ASN B 39 -7.151 3.701 -1.854 1.00 0.00 O ATOM 1853 CB ASN B 39 -8.152 0.584 -2.361 1.00 0.00 C ATOM 1854 CG ASN B 39 -9.433 1.195 -2.894 1.00 0.00 C ATOM 1855 OD1 ASN B 39 -9.613 2.412 -2.899 1.00 0.00 O ATOM 1856 ND2 ASN B 39 -10.327 0.340 -3.369 1.00 0.00 N ATOM 0 H ASN B 39 -5.886 -0.355 -2.268 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.011 1.892 -3.619 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -8.014 -0.400 -2.810 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -8.250 0.433 -1.286 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -11.205 0.684 -3.758 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -10.137 -0.662 -3.345 1.00 0.00 H new ATOM 1863 N ALA B 40 -6.227 2.208 -0.440 1.00 0.00 N ATOM 1864 CA ALA B 40 -5.976 3.184 0.610 1.00 0.00 C ATOM 1865 C ALA B 40 -4.914 4.183 0.162 1.00 0.00 C ATOM 1866 O ALA B 40 -5.054 5.388 0.373 1.00 0.00 O ATOM 1867 CB ALA B 40 -5.544 2.483 1.889 1.00 0.00 C ATOM 0 H ALA B 40 -5.943 1.257 -0.206 1.00 0.00 H new ATOM 0 HA ALA B 40 -6.899 3.728 0.809 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -5.360 3.225 2.666 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -6.331 1.804 2.215 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -4.631 1.917 1.703 1.00 0.00 H new ATOM 1873 N VAL B 41 -3.858 3.668 -0.471 1.00 0.00 N ATOM 1874 CA VAL B 41 -2.799 4.513 -1.019 1.00 0.00 C ATOM 1875 C VAL B 41 -3.381 5.517 -2.008 1.00 0.00 C ATOM 1876 O VAL B 41 -3.091 6.712 -1.939 1.00 0.00 O ATOM 1877 CB VAL B 41 -1.712 3.682 -1.739 1.00 0.00 C ATOM 1878 CG1 VAL B 41 -0.653 4.591 -2.342 1.00 0.00 C ATOM 1879 CG2 VAL B 41 -1.074 2.685 -0.787 1.00 0.00 C ATOM 0 H VAL B 41 -3.715 2.669 -0.616 1.00 0.00 H new ATOM 0 HA VAL B 41 -2.340 5.033 -0.178 1.00 0.00 H new ATOM 0 HB VAL B 41 -2.191 3.127 -2.545 1.00 0.00 H new ATOM 0 HG11 VAL B 41 0.102 3.986 -2.844 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -1.118 5.263 -3.063 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -0.183 5.176 -1.552 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -0.313 2.112 -1.317 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -0.614 3.219 0.044 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -1.837 2.007 -0.405 1.00 0.00 H new ATOM 1889 N THR B 42 -4.221 5.019 -2.907 1.00 0.00 N ATOM 1890 CA THR B 42 -4.866 5.854 -3.910 1.00 0.00 C ATOM 1891 C THR B 42 -5.665 6.981 -3.255 1.00 0.00 C ATOM 1892 O THR B 42 -5.652 8.117 -3.727 1.00 0.00 O ATOM 1893 CB THR B 42 -5.793 5.013 -4.813 1.00 0.00 C ATOM 1894 OG1 THR B 42 -5.049 3.944 -5.413 1.00 0.00 O ATOM 1895 CG2 THR B 42 -6.422 5.867 -5.907 1.00 0.00 C ATOM 0 H THR B 42 -4.472 4.032 -2.961 1.00 0.00 H new ATOM 0 HA THR B 42 -4.081 6.294 -4.525 1.00 0.00 H new ATOM 0 HB THR B 42 -6.591 4.607 -4.191 1.00 0.00 H new ATOM 0 HG1 THR B 42 -4.909 3.233 -4.754 1.00 0.00 H new ATOM 0 HG21 THR B 42 -7.069 5.246 -6.526 1.00 0.00 H new ATOM 0 HG22 THR B 42 -7.010 6.665 -5.453 1.00 0.00 H new ATOM 0 HG23 THR B 42 -5.637 6.302 -6.525 1.00 0.00 H new ATOM 1903 N ASN B 43 -6.338 6.666 -2.153 1.00 0.00 N ATOM 1904 CA ASN B 43 -7.134 7.656 -1.438 1.00 0.00 C ATOM 1905 C ASN B 43 -6.222 8.715 -0.820 1.00 0.00 C ATOM 1906 O ASN B 43 -6.548 9.900 -0.822 1.00 0.00 O ATOM 1907 CB ASN B 43 -7.980 6.983 -0.351 1.00 0.00 C ATOM 1908 CG ASN B 43 -9.148 7.838 0.136 1.00 0.00 C ATOM 1909 OD1 ASN B 43 -10.186 7.309 0.526 1.00 0.00 O ATOM 1910 ND2 ASN B 43 -9.002 9.157 0.112 1.00 0.00 N ATOM 0 H ASN B 43 -6.348 5.735 -1.737 1.00 0.00 H new ATOM 0 HA ASN B 43 -7.806 8.140 -2.147 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -8.368 6.040 -0.737 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -7.340 6.741 0.497 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -9.764 9.760 0.423 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -8.128 9.567 -0.217 1.00 0.00 H new ATOM 1917 N ILE B 44 -5.083 8.280 -0.296 1.00 0.00 N ATOM 1918 CA ILE B 44 -4.114 9.195 0.303 1.00 0.00 C ATOM 1919 C ILE B 44 -3.521 10.123 -0.755 1.00 0.00 C ATOM 1920 O ILE B 44 -3.486 11.341 -0.579 1.00 0.00 O ATOM 1921 CB ILE B 44 -2.974 8.430 1.017 1.00 0.00 C ATOM 1922 CG1 ILE B 44 -3.537 7.586 2.163 1.00 0.00 C ATOM 1923 CG2 ILE B 44 -1.911 9.393 1.531 1.00 0.00 C ATOM 1924 CD1 ILE B 44 -4.297 8.391 3.198 1.00 0.00 C ATOM 0 H ILE B 44 -4.806 7.299 -0.273 1.00 0.00 H new ATOM 0 HA ILE B 44 -4.648 9.788 1.045 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.503 7.764 0.294 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -4.199 6.825 1.750 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.716 7.063 2.654 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -1.121 8.831 2.029 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -1.489 9.949 0.694 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -2.362 10.089 2.238 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -4.666 7.725 3.978 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.634 9.135 3.639 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -5.139 8.893 2.722 1.00 0.00 H new ATOM 1936 N ILE B 45 -3.080 9.542 -1.864 1.00 0.00 N ATOM 1937 CA ILE B 45 -2.487 10.309 -2.953 1.00 0.00 C ATOM 1938 C ILE B 45 -3.523 11.241 -3.592 1.00 0.00 C ATOM 1939 O ILE B 45 -3.182 12.294 -4.133 1.00 0.00 O ATOM 1940 CB ILE B 45 -1.883 9.377 -4.030 1.00 0.00 C ATOM 1941 CG1 ILE B 45 -0.838 8.451 -3.404 1.00 0.00 C ATOM 1942 CG2 ILE B 45 -1.256 10.186 -5.156 1.00 0.00 C ATOM 1943 CD1 ILE B 45 -0.200 7.494 -4.391 1.00 0.00 C ATOM 0 H ILE B 45 -3.122 8.537 -2.033 1.00 0.00 H new ATOM 0 HA ILE B 45 -1.685 10.912 -2.529 1.00 0.00 H new ATOM 0 HB ILE B 45 -2.688 8.773 -4.447 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -0.058 9.057 -2.944 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -1.307 7.876 -2.606 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -0.838 9.509 -5.901 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -2.017 10.813 -5.621 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -0.463 10.817 -4.753 1.00 0.00 H new ATOM 0 HD11 ILE B 45 0.529 6.871 -3.874 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -0.969 6.861 -4.833 1.00 0.00 H new ATOM 0 HD13 ILE B 45 0.299 8.061 -5.177 1.00 0.00 H new ATOM 1955 N ALA B 46 -4.794 10.867 -3.496 1.00 0.00 N ATOM 1956 CA ALA B 46 -5.875 11.675 -4.052 1.00 0.00 C ATOM 1957 C ALA B 46 -6.110 12.934 -3.223 1.00 0.00 C ATOM 1958 O ALA B 46 -6.842 13.834 -3.637 1.00 0.00 O ATOM 1959 CB ALA B 46 -7.150 10.856 -4.136 1.00 0.00 C ATOM 0 H ALA B 46 -5.102 10.009 -3.038 1.00 0.00 H new ATOM 0 HA ALA B 46 -5.582 11.984 -5.055 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -7.949 11.469 -4.552 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -6.985 9.991 -4.778 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -7.433 10.519 -3.139 1.00 0.00 H new ATOM 1965 N GLN B 47 -5.499 12.989 -2.046 1.00 0.00 N ATOM 1966 CA GLN B 47 -5.599 14.159 -1.185 1.00 0.00 C ATOM 1967 C GLN B 47 -4.432 15.103 -1.448 1.00 0.00 C ATOM 1968 O GLN B 47 -4.415 16.242 -0.982 1.00 0.00 O ATOM 1969 CB GLN B 47 -5.615 13.740 0.285 1.00 0.00 C ATOM 1970 CG GLN B 47 -6.693 12.720 0.612 1.00 0.00 C ATOM 1971 CD GLN B 47 -6.675 12.295 2.065 1.00 0.00 C ATOM 1972 OE1 GLN B 47 -6.321 13.073 2.947 1.00 0.00 O ATOM 1973 NE2 GLN B 47 -7.043 11.050 2.321 1.00 0.00 N ATOM 0 H GLN B 47 -4.928 12.234 -1.666 1.00 0.00 H new ATOM 0 HA GLN B 47 -6.531 14.677 -1.409 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -4.642 13.325 0.547 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -5.762 14.624 0.905 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -7.670 13.141 0.373 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -6.561 11.842 -0.021 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -7.330 10.436 1.559 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -7.039 10.704 3.281 1.00 0.00 H new ATOM 1982 N VAL B 48 -3.462 14.613 -2.206 1.00 0.00 N ATOM 1983 CA VAL B 48 -2.279 15.385 -2.547 1.00 0.00 C ATOM 1984 C VAL B 48 -2.551 16.220 -3.794 1.00 0.00 C ATOM 1985 O VAL B 48 -3.174 15.731 -4.735 1.00 0.00 O ATOM 1986 CB VAL B 48 -1.075 14.447 -2.802 1.00 0.00 C ATOM 1987 CG1 VAL B 48 0.187 15.235 -3.112 1.00 0.00 C ATOM 1988 CG2 VAL B 48 -0.849 13.528 -1.612 1.00 0.00 C ATOM 0 H VAL B 48 -3.474 13.672 -2.600 1.00 0.00 H new ATOM 0 HA VAL B 48 -2.040 16.044 -1.712 1.00 0.00 H new ATOM 0 HB VAL B 48 -1.311 13.837 -3.674 1.00 0.00 H new ATOM 0 HG11 VAL B 48 1.013 14.545 -3.286 1.00 0.00 H new ATOM 0 HG12 VAL B 48 0.027 15.842 -4.003 1.00 0.00 H new ATOM 0 HG13 VAL B 48 0.427 15.884 -2.270 1.00 0.00 H new ATOM 0 HG21 VAL B 48 0.002 12.877 -1.812 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -0.647 14.126 -0.723 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -1.739 12.921 -1.447 1.00 0.00 H new ATOM 1998 N PRO B 49 -2.125 17.499 -3.803 1.00 0.00 N ATOM 1999 CA PRO B 49 -2.270 18.381 -4.970 1.00 0.00 C ATOM 2000 C PRO B 49 -1.820 17.707 -6.266 1.00 0.00 C ATOM 2001 O PRO B 49 -0.749 17.095 -6.316 1.00 0.00 O ATOM 2002 CB PRO B 49 -1.354 19.556 -4.637 1.00 0.00 C ATOM 2003 CG PRO B 49 -1.346 19.615 -3.149 1.00 0.00 C ATOM 2004 CD PRO B 49 -1.490 18.195 -2.668 1.00 0.00 C ATOM 0 HA PRO B 49 -3.308 18.665 -5.142 1.00 0.00 H new ATOM 0 HB2 PRO B 49 -0.350 19.401 -5.033 1.00 0.00 H new ATOM 0 HB3 PRO B 49 -1.727 20.485 -5.069 1.00 0.00 H new ATOM 0 HG2 PRO B 49 -0.420 20.057 -2.783 1.00 0.00 H new ATOM 0 HG3 PRO B 49 -2.163 20.235 -2.780 1.00 0.00 H new ATOM 0 HD2 PRO B 49 -0.523 17.757 -2.421 1.00 0.00 H new ATOM 0 HD3 PRO B 49 -2.105 18.138 -1.770 1.00 0.00 H new ATOM 2012 N GLU B 50 -2.640 17.839 -7.308 1.00 0.00 N ATOM 2013 CA GLU B 50 -2.422 17.146 -8.586 1.00 0.00 C ATOM 2014 C GLU B 50 -1.031 17.395 -9.159 1.00 0.00 C ATOM 2015 O GLU B 50 -0.461 16.514 -9.806 1.00 0.00 O ATOM 2016 CB GLU B 50 -3.488 17.561 -9.598 1.00 0.00 C ATOM 2017 CG GLU B 50 -4.860 17.003 -9.275 1.00 0.00 C ATOM 2018 CD GLU B 50 -5.932 17.448 -10.244 1.00 0.00 C ATOM 2019 OE1 GLU B 50 -5.710 17.369 -11.470 1.00 0.00 O ATOM 2020 OE2 GLU B 50 -7.017 17.860 -9.781 1.00 0.00 O ATOM 0 H GLU B 50 -3.473 18.427 -7.295 1.00 0.00 H new ATOM 0 HA GLU B 50 -2.500 16.077 -8.387 1.00 0.00 H new ATOM 0 HB2 GLU B 50 -3.543 18.649 -9.634 1.00 0.00 H new ATOM 0 HB3 GLU B 50 -3.189 17.224 -10.591 1.00 0.00 H new ATOM 0 HG2 GLU B 50 -4.810 15.914 -9.274 1.00 0.00 H new ATOM 0 HG3 GLU B 50 -5.141 17.310 -8.268 1.00 0.00 H new ATOM 2027 N SER B 51 -0.490 18.584 -8.914 1.00 0.00 N ATOM 2028 CA SER B 51 0.853 18.934 -9.363 1.00 0.00 C ATOM 2029 C SER B 51 1.865 17.849 -8.982 1.00 0.00 C ATOM 2030 O SER B 51 2.577 17.322 -9.838 1.00 0.00 O ATOM 2031 CB SER B 51 1.266 20.281 -8.761 1.00 0.00 C ATOM 2032 OG SER B 51 2.545 20.686 -9.213 1.00 0.00 O ATOM 0 H SER B 51 -0.966 19.327 -8.403 1.00 0.00 H new ATOM 0 HA SER B 51 0.842 19.013 -10.450 1.00 0.00 H new ATOM 0 HB2 SER B 51 0.529 21.039 -9.026 1.00 0.00 H new ATOM 0 HB3 SER B 51 1.271 20.208 -7.673 1.00 0.00 H new ATOM 0 HG SER B 51 2.776 21.549 -8.811 1.00 0.00 H new ATOM 2038 N LYS B 52 1.897 17.491 -7.704 1.00 0.00 N ATOM 2039 CA LYS B 52 2.844 16.498 -7.220 1.00 0.00 C ATOM 2040 C LYS B 52 2.171 15.142 -7.018 1.00 0.00 C ATOM 2041 O LYS B 52 2.812 14.185 -6.585 1.00 0.00 O ATOM 2042 CB LYS B 52 3.500 16.964 -5.913 1.00 0.00 C ATOM 2043 CG LYS B 52 2.512 17.420 -4.848 1.00 0.00 C ATOM 2044 CD LYS B 52 3.209 17.743 -3.532 1.00 0.00 C ATOM 2045 CE LYS B 52 3.737 16.488 -2.854 1.00 0.00 C ATOM 2046 NZ LYS B 52 4.389 16.788 -1.551 1.00 0.00 N ATOM 0 H LYS B 52 1.280 17.873 -6.987 1.00 0.00 H new ATOM 0 HA LYS B 52 3.618 16.384 -7.979 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.101 16.149 -5.510 1.00 0.00 H new ATOM 0 HB3 LYS B 52 4.183 17.784 -6.134 1.00 0.00 H new ATOM 0 HG2 LYS B 52 1.977 18.301 -5.202 1.00 0.00 H new ATOM 0 HG3 LYS B 52 1.768 16.640 -4.684 1.00 0.00 H new ATOM 0 HD2 LYS B 52 4.033 18.432 -3.716 1.00 0.00 H new ATOM 0 HD3 LYS B 52 2.512 18.251 -2.866 1.00 0.00 H new ATOM 0 HE2 LYS B 52 2.916 15.789 -2.695 1.00 0.00 H new ATOM 0 HE3 LYS B 52 4.453 15.995 -3.512 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 4.734 15.905 -1.124 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 5.189 17.434 -1.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 3.700 17.235 -0.913 1.00 0.00 H new ATOM 2060 N ARG B 53 0.886 15.057 -7.348 1.00 0.00 N ATOM 2061 CA ARG B 53 0.136 13.813 -7.200 1.00 0.00 C ATOM 2062 C ARG B 53 0.703 12.734 -8.119 1.00 0.00 C ATOM 2063 O ARG B 53 0.878 11.586 -7.714 1.00 0.00 O ATOM 2064 CB ARG B 53 -1.348 14.044 -7.504 1.00 0.00 C ATOM 2065 CG ARG B 53 -2.220 12.819 -7.285 1.00 0.00 C ATOM 2066 CD ARG B 53 -3.685 13.109 -7.569 1.00 0.00 C ATOM 2067 NE ARG B 53 -4.217 14.150 -6.690 1.00 0.00 N ATOM 2068 CZ ARG B 53 -5.392 14.753 -6.863 1.00 0.00 C ATOM 2069 NH1 ARG B 53 -6.210 14.379 -7.840 1.00 0.00 N ATOM 2070 NH2 ARG B 53 -5.764 15.726 -6.039 1.00 0.00 N ATOM 0 H ARG B 53 0.341 15.835 -7.720 1.00 0.00 H new ATOM 0 HA ARG B 53 0.231 13.474 -6.168 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -1.715 14.856 -6.876 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -1.450 14.370 -8.539 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -1.878 12.010 -7.930 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -2.111 12.474 -6.257 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -3.799 13.419 -8.608 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -4.267 12.196 -7.443 1.00 0.00 H new ATOM 0 HE ARG B 53 -3.650 14.433 -5.891 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -5.941 13.622 -8.468 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -7.107 14.849 -7.962 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -5.150 16.010 -5.275 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -6.663 16.189 -6.170 1.00 0.00 H new ATOM 2084 N VAL B 54 1.010 13.120 -9.351 1.00 0.00 N ATOM 2085 CA VAL B 54 1.592 12.197 -10.317 1.00 0.00 C ATOM 2086 C VAL B 54 3.029 11.853 -9.922 1.00 0.00 C ATOM 2087 O VAL B 54 3.521 10.752 -10.184 1.00 0.00 O ATOM 2088 CB VAL B 54 1.568 12.792 -11.743 1.00 0.00 C ATOM 2089 CG1 VAL B 54 2.102 11.796 -12.764 1.00 0.00 C ATOM 2090 CG2 VAL B 54 0.160 13.230 -12.112 1.00 0.00 C ATOM 0 H VAL B 54 0.866 14.066 -9.705 1.00 0.00 H new ATOM 0 HA VAL B 54 0.991 11.288 -10.315 1.00 0.00 H new ATOM 0 HB VAL B 54 2.220 13.666 -11.754 1.00 0.00 H new ATOM 0 HG11 VAL B 54 2.073 12.243 -13.758 1.00 0.00 H new ATOM 0 HG12 VAL B 54 3.130 11.534 -12.514 1.00 0.00 H new ATOM 0 HG13 VAL B 54 1.486 10.897 -12.752 1.00 0.00 H new ATOM 0 HG21 VAL B 54 0.161 13.647 -13.119 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -0.510 12.371 -12.075 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -0.182 13.987 -11.406 1.00 0.00 H new ATOM 2100 N ALA B 55 3.687 12.795 -9.261 1.00 0.00 N ATOM 2101 CA ALA B 55 5.060 12.603 -8.827 1.00 0.00 C ATOM 2102 C ALA B 55 5.138 11.601 -7.679 1.00 0.00 C ATOM 2103 O ALA B 55 5.925 10.657 -7.722 1.00 0.00 O ATOM 2104 CB ALA B 55 5.680 13.932 -8.419 1.00 0.00 C ATOM 0 H ALA B 55 3.289 13.701 -9.014 1.00 0.00 H new ATOM 0 HA ALA B 55 5.626 12.198 -9.666 1.00 0.00 H new ATOM 0 HB1 ALA B 55 6.709 13.770 -8.097 1.00 0.00 H new ATOM 0 HB2 ALA B 55 5.669 14.615 -9.269 1.00 0.00 H new ATOM 0 HB3 ALA B 55 5.107 14.364 -7.599 1.00 0.00 H new ATOM 2110 N VAL B 56 4.305 11.794 -6.661 1.00 0.00 N ATOM 2111 CA VAL B 56 4.331 10.930 -5.484 1.00 0.00 C ATOM 2112 C VAL B 56 3.886 9.505 -5.820 1.00 0.00 C ATOM 2113 O VAL B 56 4.414 8.543 -5.265 1.00 0.00 O ATOM 2114 CB VAL B 56 3.475 11.490 -4.320 1.00 0.00 C ATOM 2115 CG1 VAL B 56 4.055 12.800 -3.805 1.00 0.00 C ATOM 2116 CG2 VAL B 56 2.027 11.681 -4.739 1.00 0.00 C ATOM 0 H VAL B 56 3.607 12.537 -6.626 1.00 0.00 H new ATOM 0 HA VAL B 56 5.369 10.904 -5.153 1.00 0.00 H new ATOM 0 HB VAL B 56 3.498 10.758 -3.513 1.00 0.00 H new ATOM 0 HG11 VAL B 56 3.438 13.175 -2.988 1.00 0.00 H new ATOM 0 HG12 VAL B 56 5.070 12.632 -3.445 1.00 0.00 H new ATOM 0 HG13 VAL B 56 4.073 13.532 -4.612 1.00 0.00 H new ATOM 0 HG21 VAL B 56 1.454 12.075 -3.899 1.00 0.00 H new ATOM 0 HG22 VAL B 56 1.979 12.382 -5.572 1.00 0.00 H new ATOM 0 HG23 VAL B 56 1.608 10.723 -5.047 1.00 0.00 H new ATOM 2126 N VAL B 57 2.938 9.363 -6.744 1.00 0.00 N ATOM 2127 CA VAL B 57 2.467 8.038 -7.128 1.00 0.00 C ATOM 2128 C VAL B 57 3.521 7.311 -7.963 1.00 0.00 C ATOM 2129 O VAL B 57 3.649 6.086 -7.896 1.00 0.00 O ATOM 2130 CB VAL B 57 1.122 8.091 -7.893 1.00 0.00 C ATOM 2131 CG1 VAL B 57 1.269 8.800 -9.228 1.00 0.00 C ATOM 2132 CG2 VAL B 57 0.557 6.693 -8.086 1.00 0.00 C ATOM 0 H VAL B 57 2.488 10.137 -7.233 1.00 0.00 H new ATOM 0 HA VAL B 57 2.296 7.483 -6.206 1.00 0.00 H new ATOM 0 HB VAL B 57 0.421 8.666 -7.288 1.00 0.00 H new ATOM 0 HG11 VAL B 57 0.306 8.819 -9.738 1.00 0.00 H new ATOM 0 HG12 VAL B 57 1.612 9.821 -9.062 1.00 0.00 H new ATOM 0 HG13 VAL B 57 1.995 8.269 -9.844 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -0.388 6.754 -8.626 1.00 0.00 H new ATOM 0 HG22 VAL B 57 1.263 6.091 -8.658 1.00 0.00 H new ATOM 0 HG23 VAL B 57 0.390 6.230 -7.113 1.00 0.00 H new ATOM 2142 N ASP B 58 4.293 8.070 -8.735 1.00 0.00 N ATOM 2143 CA ASP B 58 5.359 7.490 -9.539 1.00 0.00 C ATOM 2144 C ASP B 58 6.481 7.012 -8.627 1.00 0.00 C ATOM 2145 O ASP B 58 7.002 5.911 -8.789 1.00 0.00 O ATOM 2146 CB ASP B 58 5.900 8.506 -10.541 1.00 0.00 C ATOM 2147 CG ASP B 58 6.355 7.858 -11.834 1.00 0.00 C ATOM 2148 OD1 ASP B 58 7.273 7.016 -11.800 1.00 0.00 O ATOM 2149 OD2 ASP B 58 5.780 8.182 -12.895 1.00 0.00 O ATOM 0 H ASP B 58 4.200 9.082 -8.820 1.00 0.00 H new ATOM 0 HA ASP B 58 4.955 6.645 -10.096 1.00 0.00 H new ATOM 0 HB2 ASP B 58 5.127 9.243 -10.760 1.00 0.00 H new ATOM 0 HB3 ASP B 58 6.736 9.044 -10.094 1.00 0.00 H new ATOM 2154 N ASN B 59 6.827 7.845 -7.649 1.00 0.00 N ATOM 2155 CA ASN B 59 7.849 7.494 -6.664 1.00 0.00 C ATOM 2156 C ASN B 59 7.420 6.282 -5.845 1.00 0.00 C ATOM 2157 O ASN B 59 8.225 5.394 -5.574 1.00 0.00 O ATOM 2158 CB ASN B 59 8.134 8.675 -5.729 1.00 0.00 C ATOM 2159 CG ASN B 59 9.101 9.686 -6.320 1.00 0.00 C ATOM 2160 OD1 ASN B 59 10.313 9.580 -6.136 1.00 0.00 O ATOM 2161 ND2 ASN B 59 8.578 10.674 -7.028 1.00 0.00 N ATOM 0 H ASN B 59 6.415 8.769 -7.516 1.00 0.00 H new ATOM 0 HA ASN B 59 8.761 7.247 -7.207 1.00 0.00 H new ATOM 0 HB2 ASN B 59 7.196 9.176 -5.490 1.00 0.00 H new ATOM 0 HB3 ASN B 59 8.541 8.297 -4.791 1.00 0.00 H new ATOM 0 HD21 ASN B 59 9.185 11.381 -7.443 1.00 0.00 H new ATOM 0 HD22 ASN B 59 7.568 10.729 -7.159 1.00 0.00 H new ATOM 2168 N PHE B 60 6.146 6.252 -5.460 1.00 0.00 N ATOM 2169 CA PHE B 60 5.592 5.138 -4.695 1.00 0.00 C ATOM 2170 C PHE B 60 5.768 3.829 -5.450 1.00 0.00 C ATOM 2171 O PHE B 60 6.312 2.855 -4.930 1.00 0.00 O ATOM 2172 CB PHE B 60 4.101 5.379 -4.440 1.00 0.00 C ATOM 2173 CG PHE B 60 3.431 4.292 -3.657 1.00 0.00 C ATOM 2174 CD1 PHE B 60 3.714 4.105 -2.312 1.00 0.00 C ATOM 2175 CD2 PHE B 60 2.511 3.458 -4.268 1.00 0.00 C ATOM 2176 CE1 PHE B 60 3.088 3.105 -1.594 1.00 0.00 C ATOM 2177 CE2 PHE B 60 1.884 2.458 -3.558 1.00 0.00 C ATOM 2178 CZ PHE B 60 2.173 2.278 -2.221 1.00 0.00 C ATOM 0 H PHE B 60 5.475 6.991 -5.667 1.00 0.00 H new ATOM 0 HA PHE B 60 6.124 5.072 -3.746 1.00 0.00 H new ATOM 0 HB2 PHE B 60 3.982 6.322 -3.907 1.00 0.00 H new ATOM 0 HB3 PHE B 60 3.593 5.488 -5.398 1.00 0.00 H new ATOM 0 HD1 PHE B 60 4.431 4.747 -1.822 1.00 0.00 H new ATOM 0 HD2 PHE B 60 2.282 3.593 -5.315 1.00 0.00 H new ATOM 0 HE1 PHE B 60 3.312 2.969 -0.546 1.00 0.00 H new ATOM 0 HE2 PHE B 60 1.167 1.816 -4.047 1.00 0.00 H new ATOM 0 HZ PHE B 60 1.685 1.492 -1.664 1.00 0.00 H new ATOM 2188 N THR B 61 5.312 3.829 -6.688 1.00 0.00 N ATOM 2189 CA THR B 61 5.334 2.639 -7.511 1.00 0.00 C ATOM 2190 C THR B 61 6.764 2.239 -7.872 1.00 0.00 C ATOM 2191 O THR B 61 7.088 1.049 -7.950 1.00 0.00 O ATOM 2192 CB THR B 61 4.488 2.844 -8.780 1.00 0.00 C ATOM 2193 OG1 THR B 61 4.809 4.099 -9.393 1.00 0.00 O ATOM 2194 CG2 THR B 61 3.004 2.803 -8.439 1.00 0.00 C ATOM 0 H THR B 61 4.918 4.650 -7.148 1.00 0.00 H new ATOM 0 HA THR B 61 4.898 1.824 -6.933 1.00 0.00 H new ATOM 0 HB THR B 61 4.714 2.038 -9.479 1.00 0.00 H new ATOM 0 HG1 THR B 61 4.291 4.813 -8.967 1.00 0.00 H new ATOM 0 HG21 THR B 61 2.418 2.949 -9.346 1.00 0.00 H new ATOM 0 HG22 THR B 61 2.758 1.836 -8.000 1.00 0.00 H new ATOM 0 HG23 THR B 61 2.773 3.594 -7.726 1.00 0.00 H new ATOM 2202 N LYS B 62 7.623 3.233 -8.070 1.00 0.00 N ATOM 2203 CA LYS B 62 9.031 2.979 -8.341 1.00 0.00 C ATOM 2204 C LYS B 62 9.698 2.350 -7.119 1.00 0.00 C ATOM 2205 O LYS B 62 10.427 1.364 -7.240 1.00 0.00 O ATOM 2206 CB LYS B 62 9.744 4.276 -8.732 1.00 0.00 C ATOM 2207 CG LYS B 62 11.206 4.089 -9.099 1.00 0.00 C ATOM 2208 CD LYS B 62 11.827 5.394 -9.564 1.00 0.00 C ATOM 2209 CE LYS B 62 13.276 5.205 -9.971 1.00 0.00 C ATOM 2210 NZ LYS B 62 13.856 6.446 -10.542 1.00 0.00 N ATOM 0 H LYS B 62 7.368 4.220 -8.048 1.00 0.00 H new ATOM 0 HA LYS B 62 9.105 2.282 -9.176 1.00 0.00 H new ATOM 0 HB2 LYS B 62 9.222 4.725 -9.577 1.00 0.00 H new ATOM 0 HB3 LYS B 62 9.675 4.981 -7.903 1.00 0.00 H new ATOM 0 HG2 LYS B 62 11.754 3.709 -8.237 1.00 0.00 H new ATOM 0 HG3 LYS B 62 11.293 3.341 -9.887 1.00 0.00 H new ATOM 0 HD2 LYS B 62 11.260 5.788 -10.407 1.00 0.00 H new ATOM 0 HD3 LYS B 62 11.766 6.133 -8.765 1.00 0.00 H new ATOM 0 HE2 LYS B 62 13.860 4.897 -9.103 1.00 0.00 H new ATOM 0 HE3 LYS B 62 13.346 4.401 -10.704 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 14.847 6.276 -10.808 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 13.315 6.726 -11.385 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 13.813 7.207 -9.834 1.00 0.00 H new ATOM 2224 N ALA B 63 9.420 2.912 -5.944 1.00 0.00 N ATOM 2225 CA ALA B 63 9.981 2.409 -4.693 1.00 0.00 C ATOM 2226 C ALA B 63 9.534 0.976 -4.433 1.00 0.00 C ATOM 2227 O ALA B 63 10.332 0.139 -4.017 1.00 0.00 O ATOM 2228 CB ALA B 63 9.584 3.311 -3.531 1.00 0.00 C ATOM 0 H ALA B 63 8.807 3.719 -5.833 1.00 0.00 H new ATOM 0 HA ALA B 63 11.067 2.414 -4.782 1.00 0.00 H new ATOM 0 HB1 ALA B 63 10.010 2.922 -2.606 1.00 0.00 H new ATOM 0 HB2 ALA B 63 9.960 4.319 -3.708 1.00 0.00 H new ATOM 0 HB3 ALA B 63 8.498 3.338 -3.446 1.00 0.00 H new ATOM 2234 N LEU B 64 8.260 0.703 -4.692 1.00 0.00 N ATOM 2235 CA LEU B 64 7.713 -0.641 -4.544 1.00 0.00 C ATOM 2236 C LEU B 64 8.522 -1.656 -5.339 1.00 0.00 C ATOM 2237 O LEU B 64 9.074 -2.599 -4.774 1.00 0.00 O ATOM 2238 CB LEU B 64 6.258 -0.681 -5.003 1.00 0.00 C ATOM 2239 CG LEU B 64 5.235 -0.214 -3.971 1.00 0.00 C ATOM 2240 CD1 LEU B 64 3.857 -0.128 -4.598 1.00 0.00 C ATOM 2241 CD2 LEU B 64 5.220 -1.162 -2.784 1.00 0.00 C ATOM 0 H LEU B 64 7.584 1.398 -5.007 1.00 0.00 H new ATOM 0 HA LEU B 64 7.767 -0.902 -3.487 1.00 0.00 H new ATOM 0 HB2 LEU B 64 6.158 -0.062 -5.895 1.00 0.00 H new ATOM 0 HB3 LEU B 64 6.014 -1.702 -5.295 1.00 0.00 H new ATOM 0 HG LEU B 64 5.517 0.779 -3.621 1.00 0.00 H new ATOM 0 HD11 LEU B 64 3.137 0.206 -3.851 1.00 0.00 H new ATOM 0 HD12 LEU B 64 3.877 0.582 -5.425 1.00 0.00 H new ATOM 0 HD13 LEU B 64 3.564 -1.110 -4.970 1.00 0.00 H new ATOM 0 HD21 LEU B 64 4.487 -0.819 -2.054 1.00 0.00 H new ATOM 0 HD22 LEU B 64 4.955 -2.164 -3.122 1.00 0.00 H new ATOM 0 HD23 LEU B 64 6.208 -1.184 -2.323 1.00 0.00 H new ATOM 2253 N LYS B 65 8.611 -1.448 -6.647 1.00 0.00 N ATOM 2254 CA LYS B 65 9.325 -2.376 -7.515 1.00 0.00 C ATOM 2255 C LYS B 65 10.804 -2.440 -7.139 1.00 0.00 C ATOM 2256 O LYS B 65 11.449 -3.472 -7.305 1.00 0.00 O ATOM 2257 CB LYS B 65 9.149 -1.981 -8.986 1.00 0.00 C ATOM 2258 CG LYS B 65 7.691 -1.988 -9.438 1.00 0.00 C ATOM 2259 CD LYS B 65 7.534 -1.782 -10.943 1.00 0.00 C ATOM 2260 CE LYS B 65 8.007 -0.409 -11.403 1.00 0.00 C ATOM 2261 NZ LYS B 65 9.490 -0.333 -11.518 1.00 0.00 N ATOM 0 H LYS B 65 8.200 -0.648 -7.128 1.00 0.00 H new ATOM 0 HA LYS B 65 8.901 -3.371 -7.378 1.00 0.00 H new ATOM 0 HB2 LYS B 65 9.566 -0.986 -9.141 1.00 0.00 H new ATOM 0 HB3 LYS B 65 9.720 -2.667 -9.611 1.00 0.00 H new ATOM 0 HG2 LYS B 65 7.233 -2.936 -9.157 1.00 0.00 H new ATOM 0 HG3 LYS B 65 7.149 -1.203 -8.911 1.00 0.00 H new ATOM 0 HD2 LYS B 65 8.097 -2.551 -11.471 1.00 0.00 H new ATOM 0 HD3 LYS B 65 6.486 -1.911 -11.215 1.00 0.00 H new ATOM 0 HE2 LYS B 65 7.557 -0.177 -12.368 1.00 0.00 H new ATOM 0 HE3 LYS B 65 7.660 0.347 -10.699 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 9.870 0.238 -10.736 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 9.891 -1.291 -11.474 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 9.746 0.108 -12.425 1.00 0.00 H new ATOM 2275 N GLN B 66 11.325 -1.340 -6.612 1.00 0.00 N ATOM 2276 CA GLN B 66 12.699 -1.299 -6.130 1.00 0.00 C ATOM 2277 C GLN B 66 12.870 -2.197 -4.904 1.00 0.00 C ATOM 2278 O GLN B 66 13.789 -3.009 -4.853 1.00 0.00 O ATOM 2279 CB GLN B 66 13.111 0.145 -5.812 1.00 0.00 C ATOM 2280 CG GLN B 66 14.435 0.277 -5.070 1.00 0.00 C ATOM 2281 CD GLN B 66 15.604 -0.378 -5.785 1.00 0.00 C ATOM 2282 OE1 GLN B 66 16.537 -0.859 -5.144 1.00 0.00 O ATOM 2283 NE2 GLN B 66 15.575 -0.391 -7.108 1.00 0.00 N ATOM 0 H GLN B 66 10.816 -0.463 -6.507 1.00 0.00 H new ATOM 0 HA GLN B 66 13.352 -1.677 -6.917 1.00 0.00 H new ATOM 0 HB2 GLN B 66 13.175 0.705 -6.745 1.00 0.00 H new ATOM 0 HB3 GLN B 66 12.327 0.610 -5.215 1.00 0.00 H new ATOM 0 HG2 GLN B 66 14.656 1.334 -4.925 1.00 0.00 H new ATOM 0 HG3 GLN B 66 14.332 -0.166 -4.080 1.00 0.00 H new ATOM 0 HE21 GLN B 66 14.784 0.018 -7.605 1.00 0.00 H new ATOM 0 HE22 GLN B 66 16.344 -0.810 -7.631 1.00 0.00 H new ATOM 2292 N SER B 67 11.972 -2.068 -3.930 1.00 0.00 N ATOM 2293 CA SER B 67 12.059 -2.859 -2.706 1.00 0.00 C ATOM 2294 C SER B 67 11.833 -4.347 -2.989 1.00 0.00 C ATOM 2295 O SER B 67 12.409 -5.211 -2.327 1.00 0.00 O ATOM 2296 CB SER B 67 11.063 -2.347 -1.659 1.00 0.00 C ATOM 2297 OG SER B 67 9.732 -2.369 -2.149 1.00 0.00 O ATOM 0 H SER B 67 11.180 -1.426 -3.964 1.00 0.00 H new ATOM 0 HA SER B 67 13.067 -2.746 -2.306 1.00 0.00 H new ATOM 0 HB2 SER B 67 11.131 -2.961 -0.761 1.00 0.00 H new ATOM 0 HB3 SER B 67 11.328 -1.330 -1.371 1.00 0.00 H new ATOM 0 HG SER B 67 9.742 -2.522 -3.117 1.00 0.00 H new ATOM 2303 N VAL B 68 11.000 -4.646 -3.981 1.00 0.00 N ATOM 2304 CA VAL B 68 10.782 -6.026 -4.396 1.00 0.00 C ATOM 2305 C VAL B 68 12.076 -6.619 -4.946 1.00 0.00 C ATOM 2306 O VAL B 68 12.455 -7.739 -4.603 1.00 0.00 O ATOM 2307 CB VAL B 68 9.665 -6.140 -5.457 1.00 0.00 C ATOM 2308 CG1 VAL B 68 9.521 -7.574 -5.946 1.00 0.00 C ATOM 2309 CG2 VAL B 68 8.345 -5.643 -4.892 1.00 0.00 C ATOM 0 H VAL B 68 10.468 -3.955 -4.510 1.00 0.00 H new ATOM 0 HA VAL B 68 10.465 -6.585 -3.516 1.00 0.00 H new ATOM 0 HB VAL B 68 9.942 -5.516 -6.307 1.00 0.00 H new ATOM 0 HG11 VAL B 68 8.728 -7.626 -6.692 1.00 0.00 H new ATOM 0 HG12 VAL B 68 10.460 -7.903 -6.391 1.00 0.00 H new ATOM 0 HG13 VAL B 68 9.272 -8.222 -5.106 1.00 0.00 H new ATOM 0 HG21 VAL B 68 7.568 -5.730 -5.652 1.00 0.00 H new ATOM 0 HG22 VAL B 68 8.072 -6.243 -4.024 1.00 0.00 H new ATOM 0 HG23 VAL B 68 8.446 -4.599 -4.595 1.00 0.00 H new