USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1034 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 129 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.144) USER MOD Set 1.2: A 132 GLN : amide:sc= -4.75! C(o=-4.8!,f=-3!) USER MOD Set 2.1: A 42 CYS SG : rot 180:sc= 0.725 USER MOD Set 2.2: A 69 CYS SG : rot 180:sc= -1.56 USER MOD Set 2.3: A 72 CYS SG : rot 112:sc= -1.8 USER MOD Set 3.1: A 53 SER OG : rot 180:sc= -1.02 USER MOD Set 3.2: A 55 TYR OH : rot 30:sc= 0 USER MOD Set 4.1: A 11 GLN : amide:sc= -2.8 K(o=-5.3,f=-9.2!) USER MOD Set 4.2: A 14 GLN : amide:sc= -2.51 K(o=-5.3,f=-6.6!) USER MOD Single : A 8 THR OG1 : rot 34:sc= 0.47 USER MOD Single : A 15 SER OG : rot 73:sc= 0.203 USER MOD Single : A 22 ASN : amide:sc= -1.98! K(o=-2!,f=-0.58) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -31:sc= 0.199 USER MOD Single : A 41 SER OG : rot -104:sc= 0.843 USER MOD Single : A 46 HIS : no HD1:sc= -5.58! K(o=-5.6!,f=-1.6) USER MOD Single : A 51 ASN : amide:sc= -2.65 X(o=-2.7,f=-2.6!) USER MOD Single : A 57 ASN : amide:sc= -4.21! C(o=-4.2!,f=-18!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.0353) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -10.4! C(o=-10!,f=-9.5!) USER MOD Single : A 81 GLN : amide:sc= -0.0471 X(o=-0.047,f=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.49 X(o=-0.49,f=-0.24) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0932 USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 CYS SG : rot 80:sc= -5.01! USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 MET CE :methyl -174:sc= -8.89! (180deg=-9.11!) USER MOD Single : A 112 SER OG : rot 180:sc= 0.0187 USER MOD Single : A 115 HIS : no HD1:sc= -0.329 X(o=-0.33,f=-0.19) USER MOD Single : A 117 HIS : no HE2:sc= -11.4! C(o=-11!,f=-19!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.0411 USER MOD Single : A 124 THR OG1 : rot -147:sc= 0.514 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot -54:sc= -0.802! USER MOD Single : A 133 GLN : amide:sc= -1.73 K(o=-1.7,f=-5.5!) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 9.032 15.744 20.219 1.00 0.00 N ATOM 119 CA THR A 8 7.723 16.215 19.756 1.00 0.00 C ATOM 120 C THR A 8 7.872 17.664 19.322 1.00 0.00 C ATOM 121 O THR A 8 7.296 18.567 19.916 1.00 0.00 O ATOM 122 CB THR A 8 6.801 16.098 20.969 1.00 0.00 C ATOM 123 OG1 THR A 8 6.929 14.801 21.535 1.00 0.00 O ATOM 124 CG2 THR A 8 5.351 16.324 20.538 1.00 0.00 C ATOM 0 HA THR A 8 7.327 15.647 18.914 1.00 0.00 H new ATOM 0 HB THR A 8 7.079 16.849 21.708 1.00 0.00 H new ATOM 0 HG1 THR A 8 7.853 14.490 21.434 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.696 16.240 21.405 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.251 17.319 20.103 1.00 0.00 H new ATOM 0 HG23 THR A 8 5.070 15.575 19.798 1.00 0.00 H new ATOM 132 N ASP A 9 8.654 17.896 18.295 1.00 0.00 N ATOM 133 CA ASP A 9 8.878 19.293 17.799 1.00 0.00 C ATOM 134 C ASP A 9 7.577 20.091 17.848 1.00 0.00 C ATOM 135 O ASP A 9 7.578 21.297 18.090 1.00 0.00 O ATOM 136 CB ASP A 9 9.352 19.145 16.351 1.00 0.00 C ATOM 137 CG ASP A 9 8.380 18.253 15.572 1.00 0.00 C ATOM 138 OD1 ASP A 9 8.564 17.047 15.595 1.00 0.00 O ATOM 139 OD2 ASP A 9 7.469 18.793 14.967 1.00 0.00 O ATOM 0 H ASP A 9 9.151 17.173 17.775 1.00 0.00 H new ATOM 0 HA ASP A 9 9.605 19.825 18.412 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.418 20.125 15.879 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.353 18.713 16.329 1.00 0.00 H new ATOM 144 N ASP A 10 6.468 19.437 17.645 1.00 0.00 N ATOM 145 CA ASP A 10 5.176 20.126 17.702 1.00 0.00 C ATOM 146 C ASP A 10 4.984 20.751 19.078 1.00 0.00 C ATOM 147 O ASP A 10 4.735 21.956 19.209 1.00 0.00 O ATOM 148 CB ASP A 10 4.170 19.010 17.451 1.00 0.00 C ATOM 149 CG ASP A 10 4.084 18.717 15.952 1.00 0.00 C ATOM 150 OD1 ASP A 10 4.944 18.007 15.458 1.00 0.00 O ATOM 151 OD2 ASP A 10 3.160 19.206 15.323 1.00 0.00 O ATOM 0 H ASP A 10 6.415 18.439 17.440 1.00 0.00 H new ATOM 0 HA ASP A 10 5.078 20.940 16.984 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.469 18.111 17.990 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.190 19.299 17.831 1.00 0.00 H new ATOM 156 N GLN A 11 5.124 19.985 20.125 1.00 0.00 N ATOM 157 CA GLN A 11 4.957 20.615 21.448 1.00 0.00 C ATOM 158 C GLN A 11 6.256 21.256 21.875 1.00 0.00 C ATOM 159 O GLN A 11 6.245 22.237 22.605 1.00 0.00 O ATOM 160 CB GLN A 11 4.551 19.551 22.442 1.00 0.00 C ATOM 161 CG GLN A 11 4.393 20.250 23.789 1.00 0.00 C ATOM 162 CD GLN A 11 3.000 19.980 24.362 1.00 0.00 C ATOM 163 OE1 GLN A 11 2.406 20.846 24.999 1.00 0.00 O ATOM 164 NE2 GLN A 11 2.445 18.813 24.174 1.00 0.00 N ATOM 0 H GLN A 11 5.339 18.988 20.119 1.00 0.00 H new ATOM 0 HA GLN A 11 4.188 21.386 21.401 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.618 19.075 22.141 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.305 18.766 22.499 1.00 0.00 H new ATOM 0 HG2 GLN A 11 5.155 19.895 24.483 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.544 21.323 23.671 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.938 18.093 23.645 1.00 0.00 H new ATOM 0 HE22 GLN A 11 1.519 18.621 24.556 1.00 0.00 H new ATOM 173 N ARG A 12 7.380 20.762 21.421 1.00 0.00 N ATOM 174 CA ARG A 12 8.643 21.421 21.795 1.00 0.00 C ATOM 175 C ARG A 12 8.458 22.878 21.459 1.00 0.00 C ATOM 176 O ARG A 12 8.782 23.771 22.235 1.00 0.00 O ATOM 177 CB ARG A 12 9.711 20.819 20.897 1.00 0.00 C ATOM 178 CG ARG A 12 10.109 19.422 21.385 1.00 0.00 C ATOM 179 CD ARG A 12 10.461 19.454 22.878 1.00 0.00 C ATOM 180 NE ARG A 12 9.360 18.707 23.555 1.00 0.00 N ATOM 181 CZ ARG A 12 9.475 18.340 24.809 1.00 0.00 C ATOM 182 NH1 ARG A 12 10.556 18.622 25.492 1.00 0.00 N ATOM 183 NH2 ARG A 12 8.502 17.686 25.383 1.00 0.00 N ATOM 0 H ARG A 12 7.467 19.944 20.818 1.00 0.00 H new ATOM 0 HA ARG A 12 8.915 21.300 22.843 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.341 20.760 19.874 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.587 21.467 20.882 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.290 18.723 21.213 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.962 19.060 20.812 1.00 0.00 H new ATOM 0 HD2 ARG A 12 11.428 18.986 23.065 1.00 0.00 H new ATOM 0 HD3 ARG A 12 10.526 20.478 23.245 1.00 0.00 H new ATOM 0 HE ARG A 12 8.511 18.480 23.038 1.00 0.00 H new ATOM 0 HH11 ARG A 12 11.320 19.132 25.049 1.00 0.00 H new ATOM 0 HH12 ARG A 12 10.634 18.331 26.467 1.00 0.00 H new ATOM 0 HH21 ARG A 12 7.657 17.463 24.857 1.00 0.00 H new ATOM 0 HH22 ARG A 12 8.586 17.398 26.358 1.00 0.00 H new ATOM 197 N TRP A 13 7.878 23.130 20.315 1.00 0.00 N ATOM 198 CA TRP A 13 7.622 24.524 19.947 1.00 0.00 C ATOM 199 C TRP A 13 6.607 25.097 20.912 1.00 0.00 C ATOM 200 O TRP A 13 6.738 26.229 21.369 1.00 0.00 O ATOM 201 CB TRP A 13 7.017 24.524 18.550 1.00 0.00 C ATOM 202 CG TRP A 13 6.911 25.953 18.132 1.00 0.00 C ATOM 203 CD1 TRP A 13 5.788 26.567 17.699 1.00 0.00 C ATOM 204 CD2 TRP A 13 7.949 26.969 18.167 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.080 27.898 17.449 1.00 0.00 N ATOM 206 CE2 TRP A 13 7.401 28.194 17.729 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.304 26.939 18.528 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.174 29.356 17.661 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.085 28.099 18.459 1.00 0.00 C ATOM 210 CH2 TRP A 13 9.528 29.307 18.031 1.00 0.00 C ATOM 0 H TRP A 13 7.579 22.430 19.636 1.00 0.00 H new ATOM 0 HA TRP A 13 8.539 25.113 19.976 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.643 23.963 17.856 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.037 24.047 18.552 1.00 0.00 H new ATOM 0 HD1 TRP A 13 4.824 26.098 17.569 1.00 0.00 H new ATOM 0 HE1 TRP A 13 5.403 28.577 17.101 1.00 0.00 H new ATOM 0 HE3 TRP A 13 9.749 26.013 18.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 7.734 30.284 17.327 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.127 28.060 18.739 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.136 30.199 17.985 1.00 0.00 H new ATOM 221 N GLN A 14 5.601 24.333 21.265 1.00 0.00 N ATOM 222 CA GLN A 14 4.621 24.883 22.231 1.00 0.00 C ATOM 223 C GLN A 14 5.369 25.196 23.527 1.00 0.00 C ATOM 224 O GLN A 14 5.036 26.127 24.251 1.00 0.00 O ATOM 225 CB GLN A 14 3.567 23.784 22.421 1.00 0.00 C ATOM 226 CG GLN A 14 2.552 24.228 23.478 1.00 0.00 C ATOM 227 CD GLN A 14 1.527 23.115 23.713 1.00 0.00 C ATOM 228 OE1 GLN A 14 1.070 22.916 24.837 1.00 0.00 O ATOM 229 NE2 GLN A 14 1.134 22.376 22.711 1.00 0.00 N ATOM 0 H GLN A 14 5.425 23.384 20.935 1.00 0.00 H new ATOM 0 HA GLN A 14 4.138 25.802 21.898 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.061 23.584 21.477 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.046 22.855 22.729 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.064 24.466 24.410 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.047 25.137 23.151 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.512 22.539 21.778 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.449 21.635 22.861 1.00 0.00 H new ATOM 238 N SER A 15 6.411 24.451 23.796 1.00 0.00 N ATOM 239 CA SER A 15 7.236 24.703 25.000 1.00 0.00 C ATOM 240 C SER A 15 8.143 25.894 24.723 1.00 0.00 C ATOM 241 O SER A 15 8.467 26.682 25.615 1.00 0.00 O ATOM 242 CB SER A 15 8.058 23.429 25.200 1.00 0.00 C ATOM 243 OG SER A 15 7.183 22.353 25.515 1.00 0.00 O ATOM 0 H SER A 15 6.724 23.670 23.220 1.00 0.00 H new ATOM 0 HA SER A 15 6.644 24.930 25.887 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.624 23.201 24.296 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.782 23.571 26.002 1.00 0.00 H new ATOM 0 HG SER A 15 6.689 22.087 24.711 1.00 0.00 H new ATOM 249 N VAL A 16 8.548 26.042 23.493 1.00 0.00 N ATOM 250 CA VAL A 16 9.436 27.173 23.139 1.00 0.00 C ATOM 251 C VAL A 16 8.690 28.477 23.188 1.00 0.00 C ATOM 252 O VAL A 16 9.251 29.548 23.417 1.00 0.00 O ATOM 253 CB VAL A 16 9.934 26.891 21.723 1.00 0.00 C ATOM 254 CG1 VAL A 16 10.834 28.028 21.282 1.00 0.00 C ATOM 255 CG2 VAL A 16 10.738 25.597 21.684 1.00 0.00 C ATOM 0 H VAL A 16 8.300 25.425 22.719 1.00 0.00 H new ATOM 0 HA VAL A 16 10.263 27.260 23.843 1.00 0.00 H new ATOM 0 HB VAL A 16 9.073 26.798 21.062 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.195 27.836 20.272 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.273 28.962 21.295 1.00 0.00 H new ATOM 0 HG13 VAL A 16 11.683 28.105 21.962 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.084 25.414 20.667 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.597 25.682 22.349 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.109 24.768 22.008 1.00 0.00 H new ATOM 265 N LEU A 17 7.447 28.397 22.974 1.00 0.00 N ATOM 266 CA LEU A 17 6.607 29.589 22.993 1.00 0.00 C ATOM 267 C LEU A 17 5.999 29.726 24.375 1.00 0.00 C ATOM 268 O LEU A 17 5.761 30.820 24.882 1.00 0.00 O ATOM 269 CB LEU A 17 5.571 29.256 21.948 1.00 0.00 C ATOM 270 CG LEU A 17 6.233 28.992 20.581 1.00 0.00 C ATOM 271 CD1 LEU A 17 5.360 29.586 19.497 1.00 0.00 C ATOM 272 CD2 LEU A 17 7.635 29.620 20.475 1.00 0.00 C ATOM 0 H LEU A 17 6.951 27.527 22.779 1.00 0.00 H new ATOM 0 HA LEU A 17 7.116 30.531 22.788 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.005 28.377 22.258 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.861 30.078 21.860 1.00 0.00 H new ATOM 0 HG LEU A 17 6.339 27.913 20.468 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.816 29.407 18.523 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.375 29.120 19.527 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.259 30.659 19.658 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.057 29.405 19.493 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.561 30.699 20.610 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.281 29.201 21.247 1.00 0.00 H new ATOM 284 N ALA A 18 5.774 28.612 24.993 1.00 0.00 N ATOM 285 CA ALA A 18 5.208 28.611 26.367 1.00 0.00 C ATOM 286 C ALA A 18 6.307 28.956 27.374 1.00 0.00 C ATOM 287 O ALA A 18 6.034 29.215 28.545 1.00 0.00 O ATOM 288 CB ALA A 18 4.695 27.190 26.603 1.00 0.00 C ATOM 0 H ALA A 18 5.959 27.688 24.604 1.00 0.00 H new ATOM 0 HA ALA A 18 4.411 29.345 26.484 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.263 27.120 27.601 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.933 26.950 25.861 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.522 26.485 26.515 1.00 0.00 H new ATOM 294 N ARG A 19 7.552 28.958 26.949 1.00 0.00 N ATOM 295 CA ARG A 19 8.664 29.280 27.880 1.00 0.00 C ATOM 296 C ARG A 19 8.681 28.265 29.010 1.00 0.00 C ATOM 297 O ARG A 19 8.856 28.600 30.177 1.00 0.00 O ATOM 298 CB ARG A 19 8.385 30.691 28.404 1.00 0.00 C ATOM 299 CG ARG A 19 7.948 31.617 27.259 1.00 0.00 C ATOM 300 CD ARG A 19 7.482 32.957 27.838 1.00 0.00 C ATOM 301 NE ARG A 19 6.255 33.311 27.065 1.00 0.00 N ATOM 302 CZ ARG A 19 5.142 32.632 27.221 1.00 0.00 C ATOM 303 NH1 ARG A 19 5.081 31.627 28.059 1.00 0.00 N ATOM 304 NH2 ARG A 19 4.083 32.963 26.534 1.00 0.00 N ATOM 0 H ARG A 19 7.838 28.749 25.992 1.00 0.00 H new ATOM 0 HA ARG A 19 9.638 29.241 27.393 1.00 0.00 H new ATOM 0 HB2 ARG A 19 7.607 30.654 29.166 1.00 0.00 H new ATOM 0 HB3 ARG A 19 9.280 31.091 28.881 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.776 31.775 26.568 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.142 31.154 26.690 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.266 32.872 28.903 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.251 33.722 27.729 1.00 0.00 H new ATOM 0 HE ARG A 19 6.282 34.090 26.407 1.00 0.00 H new ATOM 0 HH11 ARG A 19 5.905 31.363 28.600 1.00 0.00 H new ATOM 0 HH12 ARG A 19 4.210 31.108 28.170 1.00 0.00 H new ATOM 0 HH21 ARG A 19 4.123 33.745 25.880 1.00 0.00 H new ATOM 0 HH22 ARG A 19 3.215 32.440 26.651 1.00 0.00 H new ATOM 318 N ASP A 20 8.505 27.022 28.666 1.00 0.00 N ATOM 319 CA ASP A 20 8.511 25.948 29.689 1.00 0.00 C ATOM 320 C ASP A 20 9.929 25.756 30.243 1.00 0.00 C ATOM 321 O ASP A 20 10.809 25.261 29.543 1.00 0.00 O ATOM 322 CB ASP A 20 8.044 24.694 28.948 1.00 0.00 C ATOM 323 CG ASP A 20 7.846 23.546 29.942 1.00 0.00 C ATOM 324 OD1 ASP A 20 7.689 23.827 31.120 1.00 0.00 O ATOM 325 OD2 ASP A 20 7.851 22.407 29.506 1.00 0.00 O ATOM 0 H ASP A 20 8.356 26.703 27.709 1.00 0.00 H new ATOM 0 HA ASP A 20 7.869 26.179 30.539 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.111 24.897 28.423 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.779 24.411 28.194 1.00 0.00 H new ATOM 330 N PRO A 21 10.115 26.138 31.482 1.00 0.00 N ATOM 331 CA PRO A 21 11.441 25.989 32.138 1.00 0.00 C ATOM 332 C PRO A 21 11.717 24.509 32.427 1.00 0.00 C ATOM 333 O PRO A 21 12.695 24.158 33.084 1.00 0.00 O ATOM 334 CB PRO A 21 11.296 26.778 33.437 1.00 0.00 C ATOM 335 CG PRO A 21 9.830 26.781 33.723 1.00 0.00 C ATOM 336 CD PRO A 21 9.123 26.730 32.393 1.00 0.00 C ATOM 0 HA PRO A 21 12.268 26.346 31.525 1.00 0.00 H new ATOM 0 HB2 PRO A 21 11.856 26.311 34.247 1.00 0.00 H new ATOM 0 HB3 PRO A 21 11.679 27.793 33.328 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.555 25.925 34.339 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.547 27.676 34.277 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.218 26.124 32.445 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.822 27.724 32.063 1.00 0.00 H new ATOM 344 N ASN A 22 10.857 23.639 31.967 1.00 0.00 N ATOM 345 CA ASN A 22 11.022 22.201 32.212 1.00 0.00 C ATOM 346 C ASN A 22 11.455 21.528 30.927 1.00 0.00 C ATOM 347 O ASN A 22 11.916 20.388 30.913 1.00 0.00 O ATOM 348 CB ASN A 22 9.607 21.809 32.555 1.00 0.00 C ATOM 349 CG ASN A 22 9.497 20.300 32.634 1.00 0.00 C ATOM 350 OD1 ASN A 22 9.467 19.717 33.716 1.00 0.00 O ATOM 351 ND2 ASN A 22 9.434 19.639 31.520 1.00 0.00 N ATOM 0 H ASN A 22 10.032 23.884 31.420 1.00 0.00 H new ATOM 0 HA ASN A 22 11.758 21.936 32.971 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.317 22.254 33.507 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.920 22.194 31.801 1.00 0.00 H new ATOM 0 HD21 ASN A 22 9.358 18.622 31.534 1.00 0.00 H new ATOM 0 HD22 ASN A 22 9.460 20.136 30.630 1.00 0.00 H new ATOM 358 N ALA A 23 11.367 22.248 29.861 1.00 0.00 N ATOM 359 CA ALA A 23 11.827 21.709 28.565 1.00 0.00 C ATOM 360 C ALA A 23 13.086 22.464 28.154 1.00 0.00 C ATOM 361 O ALA A 23 13.762 22.136 27.170 1.00 0.00 O ATOM 362 CB ALA A 23 10.701 21.982 27.586 1.00 0.00 C ATOM 0 H ALA A 23 10.993 23.196 29.829 1.00 0.00 H new ATOM 0 HA ALA A 23 12.060 20.645 28.603 1.00 0.00 H new ATOM 0 HB1 ALA A 23 10.977 21.606 26.601 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.795 21.481 27.925 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.522 23.056 27.528 1.00 0.00 H new ATOM 368 N ASP A 24 13.414 23.464 28.925 1.00 0.00 N ATOM 369 CA ASP A 24 14.619 24.267 28.657 1.00 0.00 C ATOM 370 C ASP A 24 15.813 23.421 29.054 1.00 0.00 C ATOM 371 O ASP A 24 15.882 22.937 30.165 1.00 0.00 O ATOM 372 CB ASP A 24 14.444 25.487 29.576 1.00 0.00 C ATOM 373 CG ASP A 24 15.301 26.662 29.108 1.00 0.00 C ATOM 374 OD1 ASP A 24 16.226 26.435 28.359 1.00 0.00 O ATOM 375 OD2 ASP A 24 15.023 27.772 29.525 1.00 0.00 O ATOM 0 H ASP A 24 12.881 23.757 29.744 1.00 0.00 H new ATOM 0 HA ASP A 24 14.763 24.575 27.621 1.00 0.00 H new ATOM 0 HB2 ASP A 24 13.395 25.784 29.594 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.717 25.218 30.596 1.00 0.00 H new ATOM 380 N GLY A 25 16.726 23.180 28.169 1.00 0.00 N ATOM 381 CA GLY A 25 17.870 22.285 28.534 1.00 0.00 C ATOM 382 C GLY A 25 17.567 20.909 27.932 1.00 0.00 C ATOM 383 O GLY A 25 18.460 20.184 27.498 1.00 0.00 O ATOM 0 H GLY A 25 16.741 23.552 27.220 1.00 0.00 H new ATOM 0 HA2 GLY A 25 18.808 22.679 28.144 1.00 0.00 H new ATOM 0 HA3 GLY A 25 17.978 22.218 29.617 1.00 0.00 H new ATOM 387 N GLU A 26 16.302 20.554 27.877 1.00 0.00 N ATOM 388 CA GLU A 26 15.900 19.257 27.285 1.00 0.00 C ATOM 389 C GLU A 26 16.099 19.325 25.776 1.00 0.00 C ATOM 390 O GLU A 26 16.692 18.441 25.166 1.00 0.00 O ATOM 391 CB GLU A 26 14.412 19.099 27.612 1.00 0.00 C ATOM 392 CG GLU A 26 14.014 17.625 27.504 1.00 0.00 C ATOM 393 CD GLU A 26 14.043 17.190 26.037 1.00 0.00 C ATOM 394 OE1 GLU A 26 13.356 17.810 25.242 1.00 0.00 O ATOM 395 OE2 GLU A 26 14.750 16.243 25.734 1.00 0.00 O ATOM 0 H GLU A 26 15.530 21.122 28.224 1.00 0.00 H new ATOM 0 HA GLU A 26 16.483 18.421 27.671 1.00 0.00 H new ATOM 0 HB2 GLU A 26 14.210 19.468 28.618 1.00 0.00 H new ATOM 0 HB3 GLU A 26 13.813 19.699 26.926 1.00 0.00 H new ATOM 0 HG2 GLU A 26 14.697 17.010 28.089 1.00 0.00 H new ATOM 0 HG3 GLU A 26 13.017 17.476 27.918 1.00 0.00 H new ATOM 402 N PHE A 27 15.620 20.377 25.169 1.00 0.00 N ATOM 403 CA PHE A 27 15.790 20.537 23.692 1.00 0.00 C ATOM 404 C PHE A 27 16.050 21.987 23.349 1.00 0.00 C ATOM 405 O PHE A 27 15.917 22.892 24.170 1.00 0.00 O ATOM 406 CB PHE A 27 14.495 20.084 23.028 1.00 0.00 C ATOM 407 CG PHE A 27 13.414 21.143 23.131 1.00 0.00 C ATOM 408 CD1 PHE A 27 12.719 21.316 24.330 1.00 0.00 C ATOM 409 CD2 PHE A 27 13.072 21.914 22.005 1.00 0.00 C ATOM 410 CE1 PHE A 27 11.672 22.246 24.408 1.00 0.00 C ATOM 411 CE2 PHE A 27 12.033 22.855 22.095 1.00 0.00 C ATOM 412 CZ PHE A 27 11.333 23.007 23.293 1.00 0.00 C ATOM 0 H PHE A 27 15.117 21.135 25.631 1.00 0.00 H new ATOM 0 HA PHE A 27 16.636 19.944 23.344 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.684 19.857 21.979 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.148 19.163 23.496 1.00 0.00 H new ATOM 0 HD1 PHE A 27 12.988 20.733 25.198 1.00 0.00 H new ATOM 0 HD2 PHE A 27 13.606 21.783 21.075 1.00 0.00 H new ATOM 0 HE1 PHE A 27 11.129 22.372 25.333 1.00 0.00 H new ATOM 0 HE2 PHE A 27 11.776 23.460 21.238 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.524 23.719 23.355 1.00 0.00 H new ATOM 422 N VAL A 28 16.397 22.208 22.134 1.00 0.00 N ATOM 423 CA VAL A 28 16.660 23.581 21.659 1.00 0.00 C ATOM 424 C VAL A 28 15.821 23.812 20.437 1.00 0.00 C ATOM 425 O VAL A 28 15.193 22.895 19.918 1.00 0.00 O ATOM 426 CB VAL A 28 18.145 23.645 21.279 1.00 0.00 C ATOM 427 CG1 VAL A 28 18.884 22.453 21.852 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.317 23.597 19.769 1.00 0.00 C ATOM 0 H VAL A 28 16.514 21.481 21.428 1.00 0.00 H new ATOM 0 HA VAL A 28 16.425 24.330 22.415 1.00 0.00 H new ATOM 0 HB VAL A 28 18.543 24.578 21.677 1.00 0.00 H new ATOM 0 HG11 VAL A 28 19.937 22.510 21.575 1.00 0.00 H new ATOM 0 HG12 VAL A 28 18.794 22.457 22.938 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.454 21.533 21.455 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.378 23.644 19.522 1.00 0.00 H new ATOM 0 HG22 VAL A 28 17.895 22.669 19.384 1.00 0.00 H new ATOM 0 HG23 VAL A 28 17.802 24.444 19.317 1.00 0.00 H new ATOM 438 N PHE A 29 15.851 24.987 19.924 1.00 0.00 N ATOM 439 CA PHE A 29 15.112 25.223 18.682 1.00 0.00 C ATOM 440 C PHE A 29 15.932 26.126 17.797 1.00 0.00 C ATOM 441 O PHE A 29 16.326 27.225 18.170 1.00 0.00 O ATOM 442 CB PHE A 29 13.732 25.752 19.070 1.00 0.00 C ATOM 443 CG PHE A 29 13.604 27.273 19.024 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.307 27.921 17.816 1.00 0.00 C ATOM 445 CD2 PHE A 29 13.695 28.024 20.208 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.113 29.317 17.791 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.490 29.414 20.178 1.00 0.00 C ATOM 448 CZ PHE A 29 13.201 30.057 18.974 1.00 0.00 C ATOM 0 H PHE A 29 16.351 25.790 20.306 1.00 0.00 H new ATOM 0 HA PHE A 29 14.945 24.323 18.091 1.00 0.00 H new ATOM 0 HB2 PHE A 29 12.988 25.317 18.402 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.495 25.410 20.077 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.227 27.349 16.903 1.00 0.00 H new ATOM 0 HD2 PHE A 29 13.923 27.532 21.142 1.00 0.00 H new ATOM 0 HE1 PHE A 29 12.896 29.815 16.858 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.556 29.987 21.091 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.045 31.126 18.956 1.00 0.00 H new ATOM 458 N ALA A 30 16.255 25.615 16.654 1.00 0.00 N ATOM 459 CA ALA A 30 17.146 26.352 15.716 1.00 0.00 C ATOM 460 C ALA A 30 16.390 27.090 14.625 1.00 0.00 C ATOM 461 O ALA A 30 15.798 26.495 13.727 1.00 0.00 O ATOM 462 CB ALA A 30 18.038 25.277 15.097 1.00 0.00 C ATOM 0 H ALA A 30 15.938 24.705 16.319 1.00 0.00 H new ATOM 0 HA ALA A 30 17.701 27.123 16.250 1.00 0.00 H new ATOM 0 HB1 ALA A 30 18.727 25.739 14.390 1.00 0.00 H new ATOM 0 HB2 ALA A 30 18.605 24.777 15.883 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.419 24.547 14.576 1.00 0.00 H new ATOM 468 N VAL A 31 16.447 28.384 14.674 1.00 0.00 N ATOM 469 CA VAL A 31 15.787 29.204 13.634 1.00 0.00 C ATOM 470 C VAL A 31 16.799 29.405 12.493 1.00 0.00 C ATOM 471 O VAL A 31 17.830 30.064 12.664 1.00 0.00 O ATOM 472 CB VAL A 31 15.471 30.533 14.319 1.00 0.00 C ATOM 473 CG1 VAL A 31 14.371 31.255 13.555 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.003 30.288 15.747 1.00 0.00 C ATOM 0 H VAL A 31 16.929 28.915 15.400 1.00 0.00 H new ATOM 0 HA VAL A 31 14.884 28.755 13.222 1.00 0.00 H new ATOM 0 HB VAL A 31 16.374 31.143 14.333 1.00 0.00 H new ATOM 0 HG11 VAL A 31 14.148 32.202 14.046 1.00 0.00 H new ATOM 0 HG12 VAL A 31 14.702 31.445 12.534 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.474 30.636 13.537 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.781 31.242 16.226 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.105 29.670 15.735 1.00 0.00 H new ATOM 0 HG23 VAL A 31 15.788 29.777 16.304 1.00 0.00 H new ATOM 484 N ARG A 32 16.534 28.832 11.352 1.00 0.00 N ATOM 485 CA ARG A 32 17.464 28.948 10.192 1.00 0.00 C ATOM 486 C ARG A 32 17.465 30.363 9.625 1.00 0.00 C ATOM 487 O ARG A 32 18.384 30.782 8.922 1.00 0.00 O ATOM 488 CB ARG A 32 16.835 28.042 9.155 1.00 0.00 C ATOM 489 CG ARG A 32 17.203 26.586 9.432 1.00 0.00 C ATOM 490 CD ARG A 32 16.867 25.728 8.208 1.00 0.00 C ATOM 491 NE ARG A 32 15.644 24.962 8.591 1.00 0.00 N ATOM 492 CZ ARG A 32 15.705 24.005 9.485 1.00 0.00 C ATOM 493 NH1 ARG A 32 16.838 23.700 10.064 1.00 0.00 N ATOM 494 NH2 ARG A 32 14.622 23.348 9.802 1.00 0.00 N ATOM 0 H ARG A 32 15.697 28.278 11.171 1.00 0.00 H new ATOM 0 HA ARG A 32 18.489 28.699 10.467 1.00 0.00 H new ATOM 0 HB2 ARG A 32 15.751 28.159 9.169 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.174 28.327 8.159 1.00 0.00 H new ATOM 0 HG2 ARG A 32 18.265 26.507 9.663 1.00 0.00 H new ATOM 0 HG3 ARG A 32 16.659 26.223 10.304 1.00 0.00 H new ATOM 0 HD2 ARG A 32 16.684 26.348 7.330 1.00 0.00 H new ATOM 0 HD3 ARG A 32 17.690 25.058 7.959 1.00 0.00 H new ATOM 0 HE ARG A 32 14.751 25.186 8.152 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.688 24.209 9.821 1.00 0.00 H new ATOM 0 HH12 ARG A 32 16.871 22.953 10.758 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.735 23.580 9.355 1.00 0.00 H new ATOM 0 HH22 ARG A 32 14.663 22.602 10.497 1.00 0.00 H new ATOM 508 N THR A 33 16.441 31.090 9.919 1.00 0.00 N ATOM 509 CA THR A 33 16.327 32.487 9.413 1.00 0.00 C ATOM 510 C THR A 33 17.400 33.345 10.070 1.00 0.00 C ATOM 511 O THR A 33 17.935 34.277 9.474 1.00 0.00 O ATOM 512 CB THR A 33 14.922 32.946 9.822 1.00 0.00 C ATOM 513 OG1 THR A 33 14.530 34.047 9.015 1.00 0.00 O ATOM 514 CG2 THR A 33 14.904 33.365 11.295 1.00 0.00 C ATOM 0 H THR A 33 15.660 30.779 10.497 1.00 0.00 H new ATOM 0 HA THR A 33 16.467 32.565 8.335 1.00 0.00 H new ATOM 0 HB THR A 33 14.228 32.118 9.682 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.632 34.340 9.275 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.900 33.688 11.569 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.196 32.519 11.917 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.604 34.187 11.448 1.00 0.00 H new ATOM 522 N THR A 34 17.728 33.027 11.287 1.00 0.00 N ATOM 523 CA THR A 34 18.783 33.807 11.999 1.00 0.00 C ATOM 524 C THR A 34 19.992 32.912 12.290 1.00 0.00 C ATOM 525 O THR A 34 21.021 33.371 12.781 1.00 0.00 O ATOM 526 CB THR A 34 18.135 34.293 13.298 1.00 0.00 C ATOM 527 OG1 THR A 34 19.067 35.082 14.021 1.00 0.00 O ATOM 528 CG2 THR A 34 17.704 33.100 14.149 1.00 0.00 C ATOM 0 H THR A 34 17.315 32.263 11.822 1.00 0.00 H new ATOM 0 HA THR A 34 19.145 34.645 11.403 1.00 0.00 H new ATOM 0 HB THR A 34 17.256 34.891 13.058 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.976 34.765 13.838 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.244 33.457 15.070 1.00 0.00 H new ATOM 0 HG22 THR A 34 16.984 32.498 13.594 1.00 0.00 H new ATOM 0 HG23 THR A 34 18.576 32.492 14.391 1.00 0.00 H new ATOM 536 N GLY A 35 19.888 31.646 11.985 1.00 0.00 N ATOM 537 CA GLY A 35 21.024 30.720 12.228 1.00 0.00 C ATOM 538 C GLY A 35 21.281 30.588 13.729 1.00 0.00 C ATOM 539 O GLY A 35 22.419 30.435 14.160 1.00 0.00 O ATOM 0 H GLY A 35 19.059 31.215 11.576 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.804 29.742 11.801 1.00 0.00 H new ATOM 0 HA3 GLY A 35 21.919 31.091 11.729 1.00 0.00 H new ATOM 543 N ILE A 36 20.252 30.627 14.535 1.00 0.00 N ATOM 544 CA ILE A 36 20.466 30.481 16.010 1.00 0.00 C ATOM 545 C ILE A 36 19.599 29.345 16.506 1.00 0.00 C ATOM 546 O ILE A 36 18.664 28.919 15.836 1.00 0.00 O ATOM 547 CB ILE A 36 19.947 31.767 16.667 1.00 0.00 C ATOM 548 CG1 ILE A 36 20.830 32.949 16.322 1.00 0.00 C ATOM 549 CG2 ILE A 36 19.956 31.626 18.211 1.00 0.00 C ATOM 550 CD1 ILE A 36 20.130 34.192 16.853 1.00 0.00 C ATOM 0 H ILE A 36 19.283 30.752 14.243 1.00 0.00 H new ATOM 0 HA ILE A 36 21.516 30.297 16.238 1.00 0.00 H new ATOM 0 HB ILE A 36 18.935 31.930 16.296 1.00 0.00 H new ATOM 0 HG12 ILE A 36 21.816 32.839 16.773 1.00 0.00 H new ATOM 0 HG13 ILE A 36 20.978 33.019 15.244 1.00 0.00 H new ATOM 0 HG21 ILE A 36 19.585 32.546 18.663 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.315 30.794 18.504 1.00 0.00 H new ATOM 0 HG23 ILE A 36 20.974 31.438 18.553 1.00 0.00 H new ATOM 0 HD11 ILE A 36 20.731 35.073 16.627 1.00 0.00 H new ATOM 0 HD12 ILE A 36 19.153 34.289 16.380 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.004 34.106 17.932 1.00 0.00 H new ATOM 562 N PHE A 37 19.838 28.903 17.693 1.00 0.00 N ATOM 563 CA PHE A 37 18.973 27.860 18.269 1.00 0.00 C ATOM 564 C PHE A 37 18.863 28.108 19.763 1.00 0.00 C ATOM 565 O PHE A 37 19.845 28.075 20.502 1.00 0.00 O ATOM 566 CB PHE A 37 19.594 26.505 17.916 1.00 0.00 C ATOM 567 CG PHE A 37 20.719 26.147 18.843 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.425 25.656 20.114 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.045 26.258 18.421 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.449 25.280 20.972 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.076 25.870 19.278 1.00 0.00 C ATOM 572 CZ PHE A 37 22.775 25.379 20.556 1.00 0.00 C ATOM 0 H PHE A 37 20.599 29.220 18.293 1.00 0.00 H new ATOM 0 HA PHE A 37 17.959 27.874 17.870 1.00 0.00 H new ATOM 0 HB2 PHE A 37 18.827 25.732 17.960 1.00 0.00 H new ATOM 0 HB3 PHE A 37 19.963 26.531 16.891 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.397 25.568 20.432 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.272 26.642 17.437 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.218 24.911 21.961 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.104 25.948 18.957 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.572 25.077 21.219 1.00 0.00 H new ATOM 596 N ARG A 39 16.452 27.857 23.567 1.00 0.00 N ATOM 597 CA ARG A 39 15.680 26.885 24.321 1.00 0.00 C ATOM 598 C ARG A 39 14.220 27.300 24.235 1.00 0.00 C ATOM 599 O ARG A 39 13.901 28.327 23.639 1.00 0.00 O ATOM 600 CB ARG A 39 16.231 27.015 25.728 1.00 0.00 C ATOM 601 CG ARG A 39 17.220 25.872 25.997 1.00 0.00 C ATOM 602 CD ARG A 39 18.652 26.403 25.888 1.00 0.00 C ATOM 603 NE ARG A 39 19.222 26.324 27.268 1.00 0.00 N ATOM 604 CZ ARG A 39 18.989 27.268 28.155 1.00 0.00 C ATOM 605 NH1 ARG A 39 18.250 28.308 27.861 1.00 0.00 N ATOM 606 NH2 ARG A 39 19.508 27.166 29.348 1.00 0.00 N ATOM 0 HA ARG A 39 15.746 25.856 23.969 1.00 0.00 H new ATOM 0 HB2 ARG A 39 16.729 27.977 25.848 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.418 26.985 26.453 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.050 25.455 26.989 1.00 0.00 H new ATOM 0 HG3 ARG A 39 17.064 25.065 25.281 1.00 0.00 H new ATOM 0 HD2 ARG A 39 19.238 25.807 25.188 1.00 0.00 H new ATOM 0 HD3 ARG A 39 18.662 27.429 25.519 1.00 0.00 H new ATOM 0 HE ARG A 39 19.801 25.525 27.526 1.00 0.00 H new ATOM 0 HH11 ARG A 39 17.843 28.398 26.930 1.00 0.00 H new ATOM 0 HH12 ARG A 39 18.081 29.029 28.563 1.00 0.00 H new ATOM 0 HH21 ARG A 39 20.087 26.361 29.585 1.00 0.00 H new ATOM 0 HH22 ARG A 39 19.334 27.892 30.044 1.00 0.00 H new ATOM 620 N PRO A 40 13.372 26.510 24.797 1.00 0.00 N ATOM 621 CA PRO A 40 11.933 26.815 24.751 1.00 0.00 C ATOM 622 C PRO A 40 11.579 28.110 25.497 1.00 0.00 C ATOM 623 O PRO A 40 10.523 28.695 25.266 1.00 0.00 O ATOM 624 CB PRO A 40 11.291 25.604 25.423 1.00 0.00 C ATOM 625 CG PRO A 40 12.374 25.031 26.275 1.00 0.00 C ATOM 626 CD PRO A 40 13.651 25.275 25.524 1.00 0.00 C ATOM 0 HA PRO A 40 11.585 26.983 23.732 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.427 25.894 26.021 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.941 24.881 24.687 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.397 25.510 27.254 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.217 23.966 26.445 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.501 25.386 26.198 1.00 0.00 H new ATOM 0 HD3 PRO A 40 13.885 24.453 24.848 1.00 0.00 H new ATOM 634 N SER A 41 12.392 28.553 26.409 1.00 0.00 N ATOM 635 CA SER A 41 12.042 29.768 27.168 1.00 0.00 C ATOM 636 C SER A 41 13.010 30.942 26.905 1.00 0.00 C ATOM 637 O SER A 41 13.232 31.769 27.788 1.00 0.00 O ATOM 638 CB SER A 41 12.078 29.297 28.619 1.00 0.00 C ATOM 639 OG SER A 41 13.395 29.434 29.132 1.00 0.00 O ATOM 0 H SER A 41 13.283 28.123 26.658 1.00 0.00 H new ATOM 0 HA SER A 41 11.073 30.174 26.878 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.381 29.882 29.219 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.759 28.257 28.682 1.00 0.00 H new ATOM 0 HG SER A 41 13.822 28.553 29.177 1.00 0.00 H new ATOM 645 N CYS A 42 13.589 31.046 25.720 1.00 0.00 N ATOM 646 CA CYS A 42 14.528 32.183 25.437 1.00 0.00 C ATOM 647 C CYS A 42 13.961 33.489 25.981 1.00 0.00 C ATOM 648 O CYS A 42 12.767 33.770 25.891 1.00 0.00 O ATOM 649 CB CYS A 42 14.674 32.270 23.914 1.00 0.00 C ATOM 650 SG CYS A 42 15.837 33.608 23.489 1.00 0.00 S ATOM 0 H CYS A 42 13.450 30.396 24.946 1.00 0.00 H new ATOM 0 HA CYS A 42 15.492 32.016 25.916 1.00 0.00 H new ATOM 0 HB2 CYS A 42 15.035 31.321 23.518 1.00 0.00 H new ATOM 0 HB3 CYS A 42 13.703 32.458 23.455 1.00 0.00 H new ATOM 0 HG CYS A 42 15.962 33.680 22.197 1.00 0.00 H new ATOM 655 N ARG A 43 14.808 34.272 26.557 1.00 0.00 N ATOM 656 CA ARG A 43 14.365 35.571 27.146 1.00 0.00 C ATOM 657 C ARG A 43 14.681 36.760 26.233 1.00 0.00 C ATOM 658 O ARG A 43 14.455 37.908 26.612 1.00 0.00 O ATOM 659 CB ARG A 43 15.120 35.707 28.477 1.00 0.00 C ATOM 660 CG ARG A 43 16.628 35.511 28.278 1.00 0.00 C ATOM 661 CD ARG A 43 17.127 34.424 29.238 1.00 0.00 C ATOM 662 NE ARG A 43 18.374 34.975 29.852 1.00 0.00 N ATOM 663 CZ ARG A 43 18.328 36.003 30.665 1.00 0.00 C ATOM 664 NH1 ARG A 43 17.189 36.576 30.963 1.00 0.00 N ATOM 665 NH2 ARG A 43 19.434 36.461 31.188 1.00 0.00 N ATOM 0 H ARG A 43 15.804 34.075 26.652 1.00 0.00 H new ATOM 0 HA ARG A 43 13.283 35.577 27.281 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.931 36.691 28.907 1.00 0.00 H new ATOM 0 HB3 ARG A 43 14.745 34.971 29.188 1.00 0.00 H new ATOM 0 HG2 ARG A 43 16.837 35.226 27.247 1.00 0.00 H new ATOM 0 HG3 ARG A 43 17.156 36.447 28.463 1.00 0.00 H new ATOM 0 HD2 ARG A 43 16.380 34.200 30.000 1.00 0.00 H new ATOM 0 HD3 ARG A 43 17.329 33.494 28.707 1.00 0.00 H new ATOM 0 HE ARG A 43 19.273 34.545 29.635 1.00 0.00 H new ATOM 0 HH11 ARG A 43 16.320 36.224 30.561 1.00 0.00 H new ATOM 0 HH12 ARG A 43 17.170 37.375 31.597 1.00 0.00 H new ATOM 0 HH21 ARG A 43 20.326 36.019 30.963 1.00 0.00 H new ATOM 0 HH22 ARG A 43 19.406 37.260 31.821 1.00 0.00 H new ATOM 679 N ALA A 44 15.208 36.541 25.056 1.00 0.00 N ATOM 680 CA ALA A 44 15.528 37.716 24.190 1.00 0.00 C ATOM 681 C ALA A 44 14.347 38.087 23.294 1.00 0.00 C ATOM 682 O ALA A 44 13.921 39.237 23.249 1.00 0.00 O ATOM 683 CB ALA A 44 16.720 37.266 23.349 1.00 0.00 C ATOM 0 H ALA A 44 15.426 35.625 24.664 1.00 0.00 H new ATOM 0 HA ALA A 44 15.747 38.605 24.781 1.00 0.00 H new ATOM 0 HB1 ALA A 44 17.020 38.074 22.682 1.00 0.00 H new ATOM 0 HB2 ALA A 44 17.552 37.009 24.005 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.440 36.393 22.759 1.00 0.00 H new ATOM 689 N ARG A 45 13.813 37.123 22.599 1.00 0.00 N ATOM 690 CA ARG A 45 12.645 37.358 21.684 1.00 0.00 C ATOM 691 C ARG A 45 12.482 36.063 20.844 1.00 0.00 C ATOM 692 O ARG A 45 13.110 35.051 21.151 1.00 0.00 O ATOM 693 CB ARG A 45 13.024 38.594 20.822 1.00 0.00 C ATOM 694 CG ARG A 45 11.781 39.264 20.231 1.00 0.00 C ATOM 695 CD ARG A 45 11.651 40.689 20.808 1.00 0.00 C ATOM 696 NE ARG A 45 12.717 41.516 20.137 1.00 0.00 N ATOM 697 CZ ARG A 45 12.459 42.182 19.036 1.00 0.00 C ATOM 698 NH1 ARG A 45 11.268 42.146 18.490 1.00 0.00 N ATOM 699 NH2 ARG A 45 13.400 42.892 18.475 1.00 0.00 N ATOM 0 H ARG A 45 14.140 36.157 22.623 1.00 0.00 H new ATOM 0 HA ARG A 45 11.699 37.560 22.187 1.00 0.00 H new ATOM 0 HB2 ARG A 45 13.571 39.312 21.433 1.00 0.00 H new ATOM 0 HB3 ARG A 45 13.692 38.287 20.017 1.00 0.00 H new ATOM 0 HG2 ARG A 45 11.857 39.304 19.144 1.00 0.00 H new ATOM 0 HG3 ARG A 45 10.891 38.680 20.467 1.00 0.00 H new ATOM 0 HD2 ARG A 45 10.660 41.099 20.612 1.00 0.00 H new ATOM 0 HD3 ARG A 45 11.786 40.684 21.890 1.00 0.00 H new ATOM 0 HE ARG A 45 13.651 41.559 20.544 1.00 0.00 H new ATOM 0 HH11 ARG A 45 10.526 41.595 18.921 1.00 0.00 H new ATOM 0 HH12 ARG A 45 11.083 42.669 17.634 1.00 0.00 H new ATOM 0 HH21 ARG A 45 14.330 42.927 18.892 1.00 0.00 H new ATOM 0 HH22 ARG A 45 13.205 43.412 17.619 1.00 0.00 H new ATOM 713 N HIS A 46 11.668 36.042 19.818 1.00 0.00 N ATOM 714 CA HIS A 46 11.502 34.782 19.017 1.00 0.00 C ATOM 715 C HIS A 46 11.386 34.994 17.522 1.00 0.00 C ATOM 716 O HIS A 46 10.965 36.039 17.045 1.00 0.00 O ATOM 717 CB HIS A 46 10.202 34.164 19.477 1.00 0.00 C ATOM 718 CG HIS A 46 10.457 33.219 20.588 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.406 31.862 20.377 1.00 0.00 N ATOM 720 CD2 HIS A 46 10.709 33.391 21.918 1.00 0.00 C ATOM 721 CE1 HIS A 46 10.597 31.271 21.548 1.00 0.00 C ATOM 722 NE2 HIS A 46 10.794 32.151 22.534 1.00 0.00 N ATOM 0 H HIS A 46 11.113 36.836 19.499 1.00 0.00 H new ATOM 0 HA HIS A 46 12.390 34.170 19.178 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.514 34.944 19.803 1.00 0.00 H new ATOM 0 HB3 HIS A 46 9.724 33.643 18.648 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.824 34.344 22.414 1.00 0.00 H new ATOM 0 HE1 HIS A 46 10.594 30.200 21.689 1.00 0.00 H new ATOM 0 HE2 HIS A 46 10.968 31.955 23.520 1.00 0.00 H new ATOM 730 N ALA A 47 11.682 33.947 16.801 1.00 0.00 N ATOM 731 CA ALA A 47 11.553 33.937 15.324 1.00 0.00 C ATOM 732 C ALA A 47 10.450 32.945 14.928 1.00 0.00 C ATOM 733 O ALA A 47 9.987 32.153 15.747 1.00 0.00 O ATOM 734 CB ALA A 47 12.912 33.474 14.812 1.00 0.00 C ATOM 0 H ALA A 47 12.020 33.069 17.195 1.00 0.00 H new ATOM 0 HA ALA A 47 11.285 34.909 14.909 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.898 33.440 13.723 1.00 0.00 H new ATOM 0 HB2 ALA A 47 13.682 34.170 15.144 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.129 32.480 15.203 1.00 0.00 H new ATOM 740 N LEU A 48 9.998 32.995 13.707 1.00 0.00 N ATOM 741 CA LEU A 48 8.907 32.091 13.271 1.00 0.00 C ATOM 742 C LEU A 48 9.245 30.608 13.495 1.00 0.00 C ATOM 743 O LEU A 48 10.400 30.229 13.657 1.00 0.00 O ATOM 744 CB LEU A 48 8.723 32.383 11.781 1.00 0.00 C ATOM 745 CG LEU A 48 7.966 33.704 11.615 1.00 0.00 C ATOM 746 CD1 LEU A 48 8.488 34.442 10.382 1.00 0.00 C ATOM 747 CD2 LEU A 48 6.473 33.415 11.444 1.00 0.00 C ATOM 0 H LEU A 48 10.343 33.631 12.988 1.00 0.00 H new ATOM 0 HA LEU A 48 8.001 32.269 13.850 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.693 32.442 11.287 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.172 31.572 11.305 1.00 0.00 H new ATOM 0 HG LEU A 48 8.119 34.324 12.498 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.948 35.382 10.265 1.00 0.00 H new ATOM 0 HD12 LEU A 48 9.552 34.647 10.504 1.00 0.00 H new ATOM 0 HD13 LEU A 48 8.337 33.824 9.497 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.932 34.354 11.326 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.321 32.795 10.561 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.101 32.890 12.324 1.00 0.00 H new ATOM 759 N ARG A 49 8.237 29.770 13.491 1.00 0.00 N ATOM 760 CA ARG A 49 8.443 28.295 13.688 1.00 0.00 C ATOM 761 C ARG A 49 8.975 27.680 12.402 1.00 0.00 C ATOM 762 O ARG A 49 9.703 26.690 12.383 1.00 0.00 O ATOM 763 CB ARG A 49 7.036 27.774 13.903 1.00 0.00 C ATOM 764 CG ARG A 49 7.080 26.420 14.611 1.00 0.00 C ATOM 765 CD ARG A 49 5.933 25.539 14.104 1.00 0.00 C ATOM 766 NE ARG A 49 4.731 25.974 14.876 1.00 0.00 N ATOM 767 CZ ARG A 49 3.609 25.300 14.800 1.00 0.00 C ATOM 768 NH1 ARG A 49 3.520 24.232 14.046 1.00 0.00 N ATOM 769 NH2 ARG A 49 2.569 25.696 15.484 1.00 0.00 N ATOM 0 H ARG A 49 7.264 30.047 13.358 1.00 0.00 H new ATOM 0 HA ARG A 49 9.137 28.068 14.497 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.463 28.486 14.498 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.526 27.676 12.945 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.037 25.932 14.425 1.00 0.00 H new ATOM 0 HG3 ARG A 49 6.997 26.559 15.689 1.00 0.00 H new ATOM 0 HD2 ARG A 49 5.781 25.670 13.033 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.146 24.483 14.269 1.00 0.00 H new ATOM 0 HE ARG A 49 4.783 26.803 15.468 1.00 0.00 H new ATOM 0 HH11 ARG A 49 4.329 23.917 13.510 1.00 0.00 H new ATOM 0 HH12 ARG A 49 2.642 23.716 13.995 1.00 0.00 H new ATOM 0 HH21 ARG A 49 2.632 26.526 16.074 1.00 0.00 H new ATOM 0 HH22 ARG A 49 1.694 25.175 15.428 1.00 0.00 H new ATOM 783 N GLU A 50 8.580 28.275 11.334 1.00 0.00 N ATOM 784 CA GLU A 50 8.963 27.836 9.975 1.00 0.00 C ATOM 785 C GLU A 50 10.430 27.442 9.901 1.00 0.00 C ATOM 786 O GLU A 50 10.786 26.304 9.602 1.00 0.00 O ATOM 787 CB GLU A 50 8.730 29.101 9.176 1.00 0.00 C ATOM 788 CG GLU A 50 8.700 28.767 7.715 1.00 0.00 C ATOM 789 CD GLU A 50 10.120 28.550 7.188 1.00 0.00 C ATOM 790 OE1 GLU A 50 10.782 29.536 6.905 1.00 0.00 O ATOM 791 OE2 GLU A 50 10.521 27.404 7.076 1.00 0.00 O ATOM 0 H GLU A 50 7.973 29.095 11.344 1.00 0.00 H new ATOM 0 HA GLU A 50 8.410 26.961 9.632 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.790 29.565 9.474 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.520 29.824 9.379 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.104 27.869 7.553 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.219 29.573 7.161 1.00 0.00 H new ATOM 798 N ASN A 51 11.276 28.378 10.176 1.00 0.00 N ATOM 799 CA ASN A 51 12.741 28.116 10.143 1.00 0.00 C ATOM 800 C ASN A 51 13.189 27.585 11.492 1.00 0.00 C ATOM 801 O ASN A 51 14.362 27.603 11.830 1.00 0.00 O ATOM 802 CB ASN A 51 13.362 29.494 9.932 1.00 0.00 C ATOM 803 CG ASN A 51 12.940 30.059 8.579 1.00 0.00 C ATOM 804 OD1 ASN A 51 13.234 29.480 7.535 1.00 0.00 O ATOM 805 ND2 ASN A 51 12.258 31.170 8.544 1.00 0.00 N ATOM 0 H ASN A 51 11.018 29.332 10.427 1.00 0.00 H new ATOM 0 HA ASN A 51 13.021 27.393 9.377 1.00 0.00 H new ATOM 0 HB2 ASN A 51 13.049 30.168 10.730 1.00 0.00 H new ATOM 0 HB3 ASN A 51 14.449 29.423 9.982 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.967 31.562 7.648 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.016 31.647 9.412 1.00 0.00 H new ATOM 812 N VAL A 52 12.273 27.137 12.280 1.00 0.00 N ATOM 813 CA VAL A 52 12.643 26.648 13.630 1.00 0.00 C ATOM 814 C VAL A 52 12.574 25.115 13.743 1.00 0.00 C ATOM 815 O VAL A 52 11.547 24.493 13.483 1.00 0.00 O ATOM 816 CB VAL A 52 11.620 27.336 14.532 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.311 26.479 15.748 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.183 28.677 14.998 1.00 0.00 C ATOM 0 H VAL A 52 11.280 27.085 12.053 1.00 0.00 H new ATOM 0 HA VAL A 52 13.675 26.879 13.894 1.00 0.00 H new ATOM 0 HB VAL A 52 10.701 27.486 13.965 1.00 0.00 H new ATOM 0 HG11 VAL A 52 10.580 26.989 16.376 1.00 0.00 H new ATOM 0 HG12 VAL A 52 10.905 25.521 15.424 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.225 26.312 16.317 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.457 29.172 15.642 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.106 28.511 15.553 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.388 29.306 14.132 1.00 0.00 H new ATOM 828 N SER A 53 13.656 24.512 14.169 1.00 0.00 N ATOM 829 CA SER A 53 13.696 23.035 14.361 1.00 0.00 C ATOM 830 C SER A 53 14.075 22.756 15.812 1.00 0.00 C ATOM 831 O SER A 53 14.334 23.680 16.571 1.00 0.00 O ATOM 832 CB SER A 53 14.776 22.527 13.412 1.00 0.00 C ATOM 833 OG SER A 53 15.874 23.428 13.424 1.00 0.00 O ATOM 0 H SER A 53 14.527 24.992 14.395 1.00 0.00 H new ATOM 0 HA SER A 53 12.743 22.548 14.156 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.104 21.532 13.715 1.00 0.00 H new ATOM 0 HB3 SER A 53 14.376 22.437 12.402 1.00 0.00 H new ATOM 0 HG SER A 53 16.570 23.103 12.816 1.00 0.00 H new ATOM 839 N PHE A 54 14.081 21.522 16.230 1.00 0.00 N ATOM 840 CA PHE A 54 14.402 21.223 17.629 1.00 0.00 C ATOM 841 C PHE A 54 15.551 20.236 17.735 1.00 0.00 C ATOM 842 O PHE A 54 15.771 19.394 16.867 1.00 0.00 O ATOM 843 CB PHE A 54 13.118 20.628 18.151 1.00 0.00 C ATOM 844 CG PHE A 54 12.038 21.656 17.971 1.00 0.00 C ATOM 845 CD1 PHE A 54 11.946 22.727 18.861 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.157 21.560 16.891 1.00 0.00 C ATOM 847 CE1 PHE A 54 10.972 23.708 18.672 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.177 22.537 16.704 1.00 0.00 C ATOM 849 CZ PHE A 54 10.087 23.611 17.595 1.00 0.00 C ATOM 0 H PHE A 54 13.874 20.710 15.649 1.00 0.00 H new ATOM 0 HA PHE A 54 14.729 22.099 18.190 1.00 0.00 H new ATOM 0 HB2 PHE A 54 12.871 19.714 17.610 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.220 20.359 19.202 1.00 0.00 H new ATOM 0 HD1 PHE A 54 12.628 22.796 19.695 1.00 0.00 H new ATOM 0 HD2 PHE A 54 11.234 20.732 16.202 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.902 24.540 19.357 1.00 0.00 H new ATOM 0 HE2 PHE A 54 9.490 22.463 15.874 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.331 24.368 17.450 1.00 0.00 H new ATOM 859 N TYR A 55 16.291 20.347 18.789 1.00 0.00 N ATOM 860 CA TYR A 55 17.452 19.447 19.001 1.00 0.00 C ATOM 861 C TYR A 55 17.403 18.861 20.402 1.00 0.00 C ATOM 862 O TYR A 55 16.849 19.460 21.317 1.00 0.00 O ATOM 863 CB TYR A 55 18.665 20.364 18.871 1.00 0.00 C ATOM 864 CG TYR A 55 18.788 20.815 17.439 1.00 0.00 C ATOM 865 CD1 TYR A 55 17.917 21.790 16.940 1.00 0.00 C ATOM 866 CD2 TYR A 55 19.755 20.248 16.608 1.00 0.00 C ATOM 867 CE1 TYR A 55 18.017 22.199 15.607 1.00 0.00 C ATOM 868 CE2 TYR A 55 19.856 20.654 15.272 1.00 0.00 C ATOM 869 CZ TYR A 55 18.985 21.630 14.771 1.00 0.00 C ATOM 870 OH TYR A 55 19.082 22.032 13.454 1.00 0.00 O ATOM 0 H TYR A 55 16.141 21.034 19.528 1.00 0.00 H new ATOM 0 HA TYR A 55 17.472 18.614 18.298 1.00 0.00 H new ATOM 0 HB2 TYR A 55 18.557 21.226 19.529 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.569 19.839 19.179 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.168 22.226 17.584 1.00 0.00 H new ATOM 0 HD2 TYR A 55 20.426 19.496 16.996 1.00 0.00 H new ATOM 0 HE1 TYR A 55 17.347 22.954 15.222 1.00 0.00 H new ATOM 0 HE2 TYR A 55 20.604 20.215 14.629 1.00 0.00 H new ATOM 0 HH TYR A 55 18.797 22.966 13.375 1.00 0.00 H new ATOM 880 N ALA A 56 18.000 17.723 20.601 1.00 0.00 N ATOM 881 CA ALA A 56 18.009 17.144 21.965 1.00 0.00 C ATOM 882 C ALA A 56 18.936 17.993 22.821 1.00 0.00 C ATOM 883 O ALA A 56 18.651 18.287 23.977 1.00 0.00 O ATOM 884 CB ALA A 56 18.552 15.733 21.810 1.00 0.00 C ATOM 0 H ALA A 56 18.477 17.175 19.885 1.00 0.00 H new ATOM 0 HA ALA A 56 17.026 17.123 22.435 1.00 0.00 H new ATOM 0 HB1 ALA A 56 18.585 15.247 22.785 1.00 0.00 H new ATOM 0 HB2 ALA A 56 17.904 15.165 21.143 1.00 0.00 H new ATOM 0 HB3 ALA A 56 19.557 15.774 21.391 1.00 0.00 H new ATOM 890 N ASN A 57 20.040 18.411 22.264 1.00 0.00 N ATOM 891 CA ASN A 57 20.967 19.258 23.031 1.00 0.00 C ATOM 892 C ASN A 57 21.490 20.391 22.170 1.00 0.00 C ATOM 893 O ASN A 57 21.446 20.358 20.935 1.00 0.00 O ATOM 894 CB ASN A 57 22.127 18.371 23.421 1.00 0.00 C ATOM 895 CG ASN A 57 22.740 17.756 22.173 1.00 0.00 C ATOM 896 OD1 ASN A 57 23.676 18.315 21.608 1.00 0.00 O ATOM 897 ND2 ASN A 57 22.254 16.644 21.703 1.00 0.00 N ATOM 0 H ASN A 57 20.331 18.197 21.310 1.00 0.00 H new ATOM 0 HA ASN A 57 20.465 19.690 23.896 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.877 18.951 23.959 1.00 0.00 H new ATOM 0 HB3 ASN A 57 21.787 17.586 24.096 1.00 0.00 H new ATOM 0 HD21 ASN A 57 22.651 16.230 20.859 1.00 0.00 H new ATOM 0 HD22 ASN A 57 21.476 16.186 22.178 1.00 0.00 H new ATOM 904 N ALA A 58 22.006 21.377 22.810 1.00 0.00 N ATOM 905 CA ALA A 58 22.572 22.524 22.079 1.00 0.00 C ATOM 906 C ALA A 58 23.733 22.066 21.198 1.00 0.00 C ATOM 907 O ALA A 58 24.051 22.715 20.218 1.00 0.00 O ATOM 908 CB ALA A 58 23.069 23.476 23.163 1.00 0.00 C ATOM 0 H ALA A 58 22.063 21.442 23.826 1.00 0.00 H new ATOM 0 HA ALA A 58 21.841 22.997 21.423 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.507 24.360 22.698 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.233 23.775 23.796 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.823 22.974 23.770 1.00 0.00 H new ATOM 914 N SER A 59 24.372 20.958 21.503 1.00 0.00 N ATOM 915 CA SER A 59 25.503 20.524 20.633 1.00 0.00 C ATOM 916 C SER A 59 24.943 20.032 19.307 1.00 0.00 C ATOM 917 O SER A 59 25.512 20.268 18.246 1.00 0.00 O ATOM 918 CB SER A 59 26.214 19.401 21.389 1.00 0.00 C ATOM 919 OG SER A 59 27.532 19.255 20.875 1.00 0.00 O ATOM 0 H SER A 59 24.163 20.352 22.297 1.00 0.00 H new ATOM 0 HA SER A 59 26.201 21.333 20.416 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.249 19.629 22.454 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.663 18.467 21.281 1.00 0.00 H new ATOM 0 HG SER A 59 27.994 18.537 21.357 1.00 0.00 H new ATOM 925 N GLU A 60 23.810 19.391 19.347 1.00 0.00 N ATOM 926 CA GLU A 60 23.177 18.924 18.095 1.00 0.00 C ATOM 927 C GLU A 60 22.865 20.170 17.267 1.00 0.00 C ATOM 928 O GLU A 60 23.253 20.305 16.100 1.00 0.00 O ATOM 929 CB GLU A 60 21.899 18.219 18.559 1.00 0.00 C ATOM 930 CG GLU A 60 21.405 17.271 17.471 1.00 0.00 C ATOM 931 CD GLU A 60 22.420 16.142 17.268 1.00 0.00 C ATOM 932 OE1 GLU A 60 23.308 16.009 18.095 1.00 0.00 O ATOM 933 OE2 GLU A 60 22.289 15.426 16.289 1.00 0.00 O ATOM 0 H GLU A 60 23.296 19.172 20.200 1.00 0.00 H new ATOM 0 HA GLU A 60 23.786 18.254 17.488 1.00 0.00 H new ATOM 0 HB2 GLU A 60 22.092 17.664 19.477 1.00 0.00 H new ATOM 0 HB3 GLU A 60 21.129 18.956 18.788 1.00 0.00 H new ATOM 0 HG2 GLU A 60 20.436 16.856 17.750 1.00 0.00 H new ATOM 0 HG3 GLU A 60 21.262 17.816 16.538 1.00 0.00 H new ATOM 940 N ALA A 61 22.224 21.117 17.892 1.00 0.00 N ATOM 941 CA ALA A 61 21.929 22.400 17.202 1.00 0.00 C ATOM 942 C ALA A 61 23.242 23.024 16.768 1.00 0.00 C ATOM 943 O ALA A 61 23.390 23.533 15.658 1.00 0.00 O ATOM 944 CB ALA A 61 21.294 23.264 18.272 1.00 0.00 C ATOM 0 H ALA A 61 21.891 21.056 18.854 1.00 0.00 H new ATOM 0 HA ALA A 61 21.291 22.283 16.326 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.041 24.237 17.851 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.389 22.781 18.640 1.00 0.00 H new ATOM 0 HB3 ALA A 61 21.995 23.396 19.096 1.00 0.00 H new ATOM 950 N LEU A 62 24.205 22.967 17.641 1.00 0.00 N ATOM 951 CA LEU A 62 25.535 23.522 17.331 1.00 0.00 C ATOM 952 C LEU A 62 26.122 22.742 16.151 1.00 0.00 C ATOM 953 O LEU A 62 26.906 23.265 15.362 1.00 0.00 O ATOM 954 CB LEU A 62 26.337 23.287 18.614 1.00 0.00 C ATOM 955 CG LEU A 62 25.943 24.299 19.702 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.564 23.874 21.035 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.433 25.705 19.349 1.00 0.00 C ATOM 0 H LEU A 62 24.119 22.552 18.569 1.00 0.00 H new ATOM 0 HA LEU A 62 25.530 24.575 17.050 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.164 22.273 18.975 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.403 23.372 18.402 1.00 0.00 H new ATOM 0 HG LEU A 62 24.856 24.318 19.777 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.287 24.589 21.810 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.198 22.884 21.308 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.649 23.846 20.938 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.140 26.400 20.136 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.519 25.699 19.255 1.00 0.00 H new ATOM 0 HD23 LEU A 62 25.989 26.018 18.404 1.00 0.00 H new ATOM 969 N ALA A 63 25.738 21.495 16.013 1.00 0.00 N ATOM 970 CA ALA A 63 26.244 20.673 14.893 1.00 0.00 C ATOM 971 C ALA A 63 25.481 21.005 13.605 1.00 0.00 C ATOM 972 O ALA A 63 25.927 20.686 12.505 1.00 0.00 O ATOM 973 CB ALA A 63 26.001 19.221 15.309 1.00 0.00 C ATOM 0 H ALA A 63 25.090 21.017 16.639 1.00 0.00 H new ATOM 0 HA ALA A 63 27.299 20.860 14.693 1.00 0.00 H new ATOM 0 HB1 ALA A 63 26.353 18.553 14.523 1.00 0.00 H new ATOM 0 HB2 ALA A 63 26.542 19.012 16.232 1.00 0.00 H new ATOM 0 HB3 ALA A 63 24.935 19.062 15.469 1.00 0.00 H new ATOM 979 N ALA A 64 24.341 21.646 13.716 1.00 0.00 N ATOM 980 CA ALA A 64 23.569 21.997 12.477 1.00 0.00 C ATOM 981 C ALA A 64 24.160 23.230 11.807 1.00 0.00 C ATOM 982 O ALA A 64 23.683 23.700 10.776 1.00 0.00 O ATOM 983 CB ALA A 64 22.124 22.270 12.915 1.00 0.00 C ATOM 0 H ALA A 64 23.916 21.938 14.596 1.00 0.00 H new ATOM 0 HA ALA A 64 23.612 21.183 11.753 1.00 0.00 H new ATOM 0 HB1 ALA A 64 21.523 22.530 12.044 1.00 0.00 H new ATOM 0 HB2 ALA A 64 21.712 21.378 13.387 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.109 23.096 13.626 1.00 0.00 H new ATOM 989 N GLY A 65 25.184 23.748 12.383 1.00 0.00 N ATOM 990 CA GLY A 65 25.847 24.959 11.818 1.00 0.00 C ATOM 991 C GLY A 65 25.128 26.222 12.301 1.00 0.00 C ATOM 992 O GLY A 65 24.866 27.140 11.526 1.00 0.00 O ATOM 0 H GLY A 65 25.608 23.387 13.238 1.00 0.00 H new ATOM 0 HA2 GLY A 65 26.893 24.987 12.123 1.00 0.00 H new ATOM 0 HA3 GLY A 65 25.833 24.917 10.729 1.00 0.00 H new ATOM 996 N PHE A 66 24.811 26.290 13.567 1.00 0.00 N ATOM 997 CA PHE A 66 24.116 27.499 14.103 1.00 0.00 C ATOM 998 C PHE A 66 24.925 28.186 15.197 1.00 0.00 C ATOM 999 O PHE A 66 25.818 27.605 15.809 1.00 0.00 O ATOM 1000 CB PHE A 66 22.796 27.001 14.695 1.00 0.00 C ATOM 1001 CG PHE A 66 21.858 26.591 13.594 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.143 25.487 12.791 1.00 0.00 C ATOM 1003 CD2 PHE A 66 20.693 27.335 13.380 1.00 0.00 C ATOM 1004 CE1 PHE A 66 21.261 25.123 11.768 1.00 0.00 C ATOM 1005 CE2 PHE A 66 19.812 26.974 12.360 1.00 0.00 C ATOM 1006 CZ PHE A 66 20.095 25.870 11.555 1.00 0.00 C ATOM 0 H PHE A 66 25.003 25.561 14.254 1.00 0.00 H new ATOM 0 HA PHE A 66 23.974 28.229 13.307 1.00 0.00 H new ATOM 0 HB2 PHE A 66 22.982 26.156 15.358 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.340 27.786 15.298 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.043 24.914 12.959 1.00 0.00 H new ATOM 0 HD2 PHE A 66 20.475 28.189 14.004 1.00 0.00 H new ATOM 0 HE1 PHE A 66 21.478 24.269 11.144 1.00 0.00 H new ATOM 0 HE2 PHE A 66 18.912 27.548 12.194 1.00 0.00 H new ATOM 0 HZ PHE A 66 19.413 25.590 10.765 1.00 0.00 H new ATOM 1016 N ARG A 67 24.581 29.410 15.474 1.00 0.00 N ATOM 1017 CA ARG A 67 25.258 30.165 16.555 1.00 0.00 C ATOM 1018 C ARG A 67 24.346 30.105 17.781 1.00 0.00 C ATOM 1019 O ARG A 67 23.229 30.617 17.745 1.00 0.00 O ATOM 1020 CB ARG A 67 25.376 31.600 16.036 1.00 0.00 C ATOM 1021 CG ARG A 67 26.849 32.016 15.978 1.00 0.00 C ATOM 1022 CD ARG A 67 27.010 33.433 16.543 1.00 0.00 C ATOM 1023 NE ARG A 67 26.020 34.270 15.801 1.00 0.00 N ATOM 1024 CZ ARG A 67 25.889 35.547 16.070 1.00 0.00 C ATOM 1025 NH1 ARG A 67 26.622 36.114 16.993 1.00 0.00 N ATOM 1026 NH2 ARG A 67 25.017 36.258 15.409 1.00 0.00 N ATOM 0 H ARG A 67 23.847 29.925 14.988 1.00 0.00 H new ATOM 0 HA ARG A 67 26.239 29.774 16.823 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.929 31.675 15.045 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.823 32.278 16.687 1.00 0.00 H new ATOM 0 HG2 ARG A 67 27.457 31.315 16.550 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.206 31.982 14.949 1.00 0.00 H new ATOM 0 HD2 ARG A 67 26.816 33.453 17.615 1.00 0.00 H new ATOM 0 HD3 ARG A 67 28.025 33.802 16.396 1.00 0.00 H new ATOM 0 HE ARG A 67 25.440 33.844 15.078 1.00 0.00 H new ATOM 0 HH11 ARG A 67 27.305 35.562 17.513 1.00 0.00 H new ATOM 0 HH12 ARG A 67 26.511 37.108 17.193 1.00 0.00 H new ATOM 0 HH21 ARG A 67 24.443 35.820 14.689 1.00 0.00 H new ATOM 0 HH22 ARG A 67 24.910 37.252 15.613 1.00 0.00 H new ATOM 1040 N PRO A 68 24.808 29.463 18.817 1.00 0.00 N ATOM 1041 CA PRO A 68 23.977 29.321 20.034 1.00 0.00 C ATOM 1042 C PRO A 68 23.689 30.684 20.662 1.00 0.00 C ATOM 1043 O PRO A 68 24.554 31.553 20.742 1.00 0.00 O ATOM 1044 CB PRO A 68 24.811 28.413 20.938 1.00 0.00 C ATOM 1045 CG PRO A 68 26.217 28.565 20.448 1.00 0.00 C ATOM 1046 CD PRO A 68 26.125 28.834 18.969 1.00 0.00 C ATOM 0 HA PRO A 68 22.991 28.898 19.841 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.723 28.709 21.983 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.479 27.377 20.871 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.721 29.384 20.961 1.00 0.00 H new ATOM 0 HG3 PRO A 68 26.796 27.662 20.643 1.00 0.00 H new ATOM 0 HD2 PRO A 68 26.925 29.492 18.630 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.200 27.915 18.388 1.00 0.00 H new ATOM 1054 N CYS A 69 22.473 30.879 21.101 1.00 0.00 N ATOM 1055 CA CYS A 69 22.089 32.173 21.722 1.00 0.00 C ATOM 1056 C CYS A 69 22.734 32.248 23.118 1.00 0.00 C ATOM 1057 O CYS A 69 22.347 31.517 24.025 1.00 0.00 O ATOM 1058 CB CYS A 69 20.559 32.103 21.793 1.00 0.00 C ATOM 1059 SG CYS A 69 19.870 33.395 22.877 1.00 0.00 S ATOM 0 H CYS A 69 21.725 30.187 21.053 1.00 0.00 H new ATOM 0 HA CYS A 69 22.416 33.058 21.176 1.00 0.00 H new ATOM 0 HB2 CYS A 69 20.144 32.210 20.791 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.257 31.122 22.160 1.00 0.00 H new ATOM 0 HG CYS A 69 18.574 33.295 22.902 1.00 0.00 H new ATOM 1064 N LYS A 70 23.720 33.094 23.312 1.00 0.00 N ATOM 1065 CA LYS A 70 24.392 33.172 24.656 1.00 0.00 C ATOM 1066 C LYS A 70 23.378 33.446 25.774 1.00 0.00 C ATOM 1067 O LYS A 70 23.726 33.473 26.951 1.00 0.00 O ATOM 1068 CB LYS A 70 25.417 34.305 24.558 1.00 0.00 C ATOM 1069 CG LYS A 70 26.587 34.011 25.500 1.00 0.00 C ATOM 1070 CD LYS A 70 27.889 34.509 24.869 1.00 0.00 C ATOM 1071 CE LYS A 70 28.904 34.820 25.972 1.00 0.00 C ATOM 1072 NZ LYS A 70 29.394 33.491 26.432 1.00 0.00 N ATOM 0 H LYS A 70 24.088 33.731 22.605 1.00 0.00 H new ATOM 0 HA LYS A 70 24.871 32.225 24.906 1.00 0.00 H new ATOM 0 HB2 LYS A 70 25.775 34.399 23.533 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.952 35.255 24.822 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.426 34.500 26.461 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.651 32.940 25.694 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.290 33.754 24.193 1.00 0.00 H new ATOM 0 HD3 LYS A 70 27.699 35.401 24.273 1.00 0.00 H new ATOM 0 HE2 LYS A 70 29.722 35.433 25.594 1.00 0.00 H new ATOM 0 HE3 LYS A 70 28.442 35.374 26.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 29.227 33.394 27.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.885 32.739 25.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 30.413 33.411 26.239 1.00 0.00 H new ATOM 1086 N ARG A 71 22.132 33.616 25.439 1.00 0.00 N ATOM 1087 CA ARG A 71 21.100 33.830 26.485 1.00 0.00 C ATOM 1088 C ARG A 71 20.538 32.467 26.832 1.00 0.00 C ATOM 1089 O ARG A 71 20.165 32.183 27.956 1.00 0.00 O ATOM 1090 CB ARG A 71 20.014 34.652 25.818 1.00 0.00 C ATOM 1091 CG ARG A 71 19.327 35.557 26.846 1.00 0.00 C ATOM 1092 CD ARG A 71 20.322 36.603 27.367 1.00 0.00 C ATOM 1093 NE ARG A 71 19.497 37.561 28.164 1.00 0.00 N ATOM 1094 CZ ARG A 71 20.029 38.258 29.140 1.00 0.00 C ATOM 1095 NH1 ARG A 71 21.296 38.135 29.442 1.00 0.00 N ATOM 1096 NH2 ARG A 71 19.282 39.085 29.820 1.00 0.00 N ATOM 0 H ARG A 71 21.783 33.616 24.481 1.00 0.00 H new ATOM 0 HA ARG A 71 21.483 34.321 27.380 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.444 35.257 25.020 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.280 33.992 25.356 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.469 36.053 26.392 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.948 34.959 27.674 1.00 0.00 H new ATOM 0 HD2 ARG A 71 21.094 36.141 27.982 1.00 0.00 H new ATOM 0 HD3 ARG A 71 20.829 37.108 26.545 1.00 0.00 H new ATOM 0 HE ARG A 71 18.507 37.674 27.946 1.00 0.00 H new ATOM 0 HH11 ARG A 71 21.885 37.490 28.916 1.00 0.00 H new ATOM 0 HH12 ARG A 71 21.694 38.684 30.204 1.00 0.00 H new ATOM 0 HH21 ARG A 71 18.293 39.185 29.591 1.00 0.00 H new ATOM 0 HH22 ARG A 71 19.687 39.631 30.580 1.00 0.00 H new ATOM 1110 N CYS A 72 20.464 31.630 25.840 1.00 0.00 N ATOM 1111 CA CYS A 72 19.917 30.254 26.024 1.00 0.00 C ATOM 1112 C CYS A 72 21.033 29.215 26.111 1.00 0.00 C ATOM 1113 O CYS A 72 20.776 28.025 26.255 1.00 0.00 O ATOM 1114 CB CYS A 72 19.104 30.004 24.762 1.00 0.00 C ATOM 1115 SG CYS A 72 17.572 30.934 24.859 1.00 0.00 S ATOM 0 H CYS A 72 20.765 31.843 24.889 1.00 0.00 H new ATOM 0 HA CYS A 72 19.338 30.174 26.944 1.00 0.00 H new ATOM 0 HB2 CYS A 72 19.672 30.306 23.882 1.00 0.00 H new ATOM 0 HB3 CYS A 72 18.892 28.940 24.655 1.00 0.00 H new ATOM 0 HG CYS A 72 17.580 31.877 23.964 1.00 0.00 H new ATOM 1120 N GLN A 73 22.261 29.622 26.001 1.00 0.00 N ATOM 1121 CA GLN A 73 23.362 28.623 26.050 1.00 0.00 C ATOM 1122 C GLN A 73 23.961 28.531 27.473 1.00 0.00 C ATOM 1123 O GLN A 73 24.050 27.440 28.030 1.00 0.00 O ATOM 1124 CB GLN A 73 24.365 29.114 24.986 1.00 0.00 C ATOM 1125 CG GLN A 73 25.809 28.920 25.468 1.00 0.00 C ATOM 1126 CD GLN A 73 26.764 29.051 24.279 1.00 0.00 C ATOM 1127 OE1 GLN A 73 26.789 30.080 23.607 1.00 0.00 O ATOM 1128 NE2 GLN A 73 27.556 28.058 23.983 1.00 0.00 N ATOM 0 H GLN A 73 22.551 30.592 25.880 1.00 0.00 H new ATOM 0 HA GLN A 73 23.037 27.605 25.834 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.211 28.568 24.055 1.00 0.00 H new ATOM 0 HB3 GLN A 73 24.187 30.168 24.771 1.00 0.00 H new ATOM 0 HG2 GLN A 73 26.053 29.662 26.228 1.00 0.00 H new ATOM 0 HG3 GLN A 73 25.921 27.940 25.932 1.00 0.00 H new ATOM 0 HE21 GLN A 73 27.534 27.205 24.541 1.00 0.00 H new ATOM 0 HE22 GLN A 73 28.197 28.135 23.193 1.00 0.00 H new ATOM 1137 N PRO A 74 24.351 29.654 28.029 1.00 0.00 N ATOM 1138 CA PRO A 74 24.935 29.670 29.391 1.00 0.00 C ATOM 1139 C PRO A 74 23.864 29.921 30.472 1.00 0.00 C ATOM 1140 O PRO A 74 24.150 29.861 31.667 1.00 0.00 O ATOM 1141 CB PRO A 74 25.893 30.852 29.327 1.00 0.00 C ATOM 1142 CG PRO A 74 25.351 31.760 28.256 1.00 0.00 C ATOM 1143 CD PRO A 74 24.310 30.997 27.464 1.00 0.00 C ATOM 0 HA PRO A 74 25.404 28.723 29.657 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.945 31.366 30.287 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.904 30.524 29.087 1.00 0.00 H new ATOM 0 HG2 PRO A 74 24.910 32.651 28.702 1.00 0.00 H new ATOM 0 HG3 PRO A 74 26.155 32.096 27.601 1.00 0.00 H new ATOM 0 HD2 PRO A 74 23.322 31.444 27.569 1.00 0.00 H new ATOM 0 HD3 PRO A 74 24.545 30.990 26.400 1.00 0.00 H new ATOM 1151 N ASP A 75 22.651 30.230 30.086 1.00 0.00 N ATOM 1152 CA ASP A 75 21.584 30.515 31.101 1.00 0.00 C ATOM 1153 C ASP A 75 21.071 29.244 31.780 1.00 0.00 C ATOM 1154 O ASP A 75 21.494 28.129 31.482 1.00 0.00 O ATOM 1155 CB ASP A 75 20.451 31.160 30.318 1.00 0.00 C ATOM 1156 CG ASP A 75 19.854 30.127 29.357 1.00 0.00 C ATOM 1157 OD1 ASP A 75 20.560 29.194 29.007 1.00 0.00 O ATOM 1158 OD2 ASP A 75 18.698 30.277 28.995 1.00 0.00 O ATOM 0 H ASP A 75 22.351 30.298 29.113 1.00 0.00 H new ATOM 0 HA ASP A 75 21.976 31.149 31.896 1.00 0.00 H new ATOM 0 HB2 ASP A 75 19.684 31.527 31.000 1.00 0.00 H new ATOM 0 HB3 ASP A 75 20.821 32.021 29.762 1.00 0.00 H new ATOM 1163 N LYS A 76 20.157 29.418 32.699 1.00 0.00 N ATOM 1164 CA LYS A 76 19.576 28.264 33.436 1.00 0.00 C ATOM 1165 C LYS A 76 18.354 27.696 32.693 1.00 0.00 C ATOM 1166 O LYS A 76 17.531 28.427 32.148 1.00 0.00 O ATOM 1167 CB LYS A 76 19.152 28.833 34.795 1.00 0.00 C ATOM 1168 CG LYS A 76 20.201 29.824 35.322 1.00 0.00 C ATOM 1169 CD LYS A 76 21.592 29.184 35.288 1.00 0.00 C ATOM 1170 CE LYS A 76 22.610 30.151 35.895 1.00 0.00 C ATOM 1171 NZ LYS A 76 23.940 29.545 35.602 1.00 0.00 N ATOM 0 H LYS A 76 19.785 30.328 32.972 1.00 0.00 H new ATOM 0 HA LYS A 76 20.291 27.447 33.533 1.00 0.00 H new ATOM 0 HB2 LYS A 76 18.188 29.333 34.700 1.00 0.00 H new ATOM 0 HB3 LYS A 76 19.021 28.021 35.510 1.00 0.00 H new ATOM 0 HG2 LYS A 76 20.194 30.730 34.716 1.00 0.00 H new ATOM 0 HG3 LYS A 76 19.953 30.120 36.341 1.00 0.00 H new ATOM 0 HD2 LYS A 76 21.587 28.247 35.845 1.00 0.00 H new ATOM 0 HD3 LYS A 76 21.869 28.944 34.262 1.00 0.00 H new ATOM 0 HE2 LYS A 76 22.523 31.144 35.454 1.00 0.00 H new ATOM 0 HE3 LYS A 76 22.456 30.264 36.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 24.691 30.152 35.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 23.997 28.603 36.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 24.062 29.456 34.573 1.00 0.00 H new ATOM 1185 N ALA A 77 18.236 26.397 32.677 1.00 0.00 N ATOM 1186 CA ALA A 77 17.089 25.718 31.995 1.00 0.00 C ATOM 1187 C ALA A 77 16.918 24.339 32.651 1.00 0.00 C ATOM 1188 O ALA A 77 16.786 24.254 33.864 1.00 0.00 O ATOM 1189 CB ALA A 77 17.537 25.612 30.543 1.00 0.00 C ATOM 0 H ALA A 77 18.900 25.760 33.117 1.00 0.00 H new ATOM 0 HA ALA A 77 16.132 26.236 32.066 1.00 0.00 H new ATOM 0 HB1 ALA A 77 16.758 25.124 29.957 1.00 0.00 H new ATOM 0 HB2 ALA A 77 17.720 26.610 30.145 1.00 0.00 H new ATOM 0 HB3 ALA A 77 18.454 25.026 30.487 1.00 0.00 H new ATOM 1195 N ASN A 78 16.988 23.243 31.930 1.00 0.00 N ATOM 1196 CA ASN A 78 16.911 21.949 32.658 1.00 0.00 C ATOM 1197 C ASN A 78 18.138 21.846 33.551 1.00 0.00 C ATOM 1198 O ASN A 78 18.050 21.323 34.660 1.00 0.00 O ATOM 1199 CB ASN A 78 16.868 20.811 31.634 1.00 0.00 C ATOM 1200 CG ASN A 78 15.446 20.627 31.079 1.00 0.00 C ATOM 1201 OD1 ASN A 78 15.177 19.638 30.404 1.00 0.00 O ATOM 1202 ND2 ASN A 78 14.510 21.510 31.332 1.00 0.00 N ATOM 0 H ASN A 78 17.090 23.192 30.916 1.00 0.00 H new ATOM 0 HA ASN A 78 16.015 21.885 33.275 1.00 0.00 H new ATOM 0 HB2 ASN A 78 17.557 21.025 30.817 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.204 19.884 32.100 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.567 21.372 30.969 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.725 22.335 31.892 1.00 0.00 H new ATOM 1209 N PRO A 79 19.229 22.439 33.112 1.00 0.00 N ATOM 1210 CA PRO A 79 20.429 22.487 33.996 1.00 0.00 C ATOM 1211 C PRO A 79 20.070 23.351 35.225 1.00 0.00 C ATOM 1212 O PRO A 79 20.668 23.231 36.292 1.00 0.00 O ATOM 1213 CB PRO A 79 21.464 23.157 33.079 1.00 0.00 C ATOM 1214 CG PRO A 79 20.642 23.949 32.128 1.00 0.00 C ATOM 1215 CD PRO A 79 19.478 23.079 31.817 1.00 0.00 C ATOM 0 HA PRO A 79 20.788 21.535 34.386 1.00 0.00 H new ATOM 0 HB2 PRO A 79 22.145 23.793 33.644 1.00 0.00 H new ATOM 0 HB3 PRO A 79 22.075 22.418 32.560 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.323 24.893 32.571 1.00 0.00 H new ATOM 0 HG3 PRO A 79 21.205 24.194 31.227 1.00 0.00 H new ATOM 0 HD2 PRO A 79 18.618 23.654 31.473 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.708 22.351 31.039 1.00 0.00 H new ATOM 1223 N ARG A 80 19.070 24.209 35.083 1.00 0.00 N ATOM 1224 CA ARG A 80 18.629 25.067 36.215 1.00 0.00 C ATOM 1225 C ARG A 80 18.330 24.183 37.433 1.00 0.00 C ATOM 1226 O ARG A 80 18.980 24.280 38.472 1.00 0.00 O ATOM 1227 CB ARG A 80 17.344 25.763 35.762 1.00 0.00 C ATOM 1228 CG ARG A 80 17.093 27.006 36.623 1.00 0.00 C ATOM 1229 CD ARG A 80 15.994 26.710 37.651 1.00 0.00 C ATOM 1230 NE ARG A 80 14.866 27.622 37.294 1.00 0.00 N ATOM 1231 CZ ARG A 80 14.921 28.903 37.576 1.00 0.00 C ATOM 1232 NH1 ARG A 80 15.967 29.413 38.177 1.00 0.00 N ATOM 1233 NH2 ARG A 80 13.922 29.678 37.254 1.00 0.00 N ATOM 0 H ARG A 80 18.546 24.342 34.218 1.00 0.00 H new ATOM 0 HA ARG A 80 19.396 25.792 36.489 1.00 0.00 H new ATOM 0 HB2 ARG A 80 17.424 26.047 34.713 1.00 0.00 H new ATOM 0 HB3 ARG A 80 16.501 25.077 35.843 1.00 0.00 H new ATOM 0 HG2 ARG A 80 18.011 27.299 37.132 1.00 0.00 H new ATOM 0 HG3 ARG A 80 16.797 27.844 35.992 1.00 0.00 H new ATOM 0 HD2 ARG A 80 15.685 25.666 37.607 1.00 0.00 H new ATOM 0 HD3 ARG A 80 16.344 26.896 38.666 1.00 0.00 H new ATOM 0 HE ARG A 80 14.043 27.245 36.825 1.00 0.00 H new ATOM 0 HH11 ARG A 80 16.752 28.813 38.432 1.00 0.00 H new ATOM 0 HH12 ARG A 80 15.997 30.410 38.390 1.00 0.00 H new ATOM 0 HH21 ARG A 80 13.104 29.288 36.786 1.00 0.00 H new ATOM 0 HH22 ARG A 80 13.959 30.674 37.470 1.00 0.00 H new ATOM 1247 N GLN A 81 17.352 23.319 37.314 1.00 0.00 N ATOM 1248 CA GLN A 81 16.982 22.410 38.445 1.00 0.00 C ATOM 1249 C GLN A 81 18.216 21.664 39.001 1.00 0.00 C ATOM 1250 O GLN A 81 18.314 21.400 40.198 1.00 0.00 O ATOM 1251 CB GLN A 81 15.992 21.414 37.839 1.00 0.00 C ATOM 1252 CG GLN A 81 14.727 22.152 37.390 1.00 0.00 C ATOM 1253 CD GLN A 81 13.491 21.415 37.909 1.00 0.00 C ATOM 1254 OE1 GLN A 81 12.672 20.937 37.126 1.00 0.00 O ATOM 1255 NE2 GLN A 81 13.309 21.295 39.195 1.00 0.00 N ATOM 0 H GLN A 81 16.788 23.203 36.472 1.00 0.00 H new ATOM 0 HA GLN A 81 16.561 22.967 39.282 1.00 0.00 H new ATOM 0 HB2 GLN A 81 16.448 20.904 36.990 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.737 20.648 38.572 1.00 0.00 H new ATOM 0 HG2 GLN A 81 14.738 23.175 37.767 1.00 0.00 H new ATOM 0 HG3 GLN A 81 14.696 22.213 36.302 1.00 0.00 H new ATOM 0 HE21 GLN A 81 13.988 21.691 39.845 1.00 0.00 H new ATOM 0 HE22 GLN A 81 12.488 20.805 39.550 1.00 0.00 H new ATOM 1264 N HIS A 82 19.159 21.317 38.146 1.00 0.00 N ATOM 1265 CA HIS A 82 20.379 20.585 38.621 1.00 0.00 C ATOM 1266 C HIS A 82 21.252 21.527 39.474 1.00 0.00 C ATOM 1267 O HIS A 82 21.760 21.154 40.538 1.00 0.00 O ATOM 1268 CB HIS A 82 21.125 20.167 37.348 1.00 0.00 C ATOM 1269 CG HIS A 82 21.164 18.665 37.248 1.00 0.00 C ATOM 1270 ND1 HIS A 82 21.411 18.010 36.052 1.00 0.00 N ATOM 1271 CD2 HIS A 82 20.991 17.676 38.187 1.00 0.00 C ATOM 1272 CE1 HIS A 82 21.380 16.688 36.298 1.00 0.00 C ATOM 1273 NE2 HIS A 82 21.128 16.429 37.585 1.00 0.00 N ATOM 0 H HIS A 82 19.133 21.510 37.145 1.00 0.00 H new ATOM 0 HA HIS A 82 20.129 19.723 39.240 1.00 0.00 H new ATOM 0 HB2 HIS A 82 20.630 20.586 36.472 1.00 0.00 H new ATOM 0 HB3 HIS A 82 22.139 20.566 37.363 1.00 0.00 H new ATOM 0 HD2 HIS A 82 20.781 17.842 39.233 1.00 0.00 H new ATOM 0 HE1 HIS A 82 21.539 15.928 35.547 1.00 0.00 H new ATOM 0 HE2 HIS A 82 21.052 15.514 38.030 1.00 0.00 H new ATOM 1281 N ARG A 83 21.405 22.751 39.045 1.00 0.00 N ATOM 1282 CA ARG A 83 22.212 23.728 39.832 1.00 0.00 C ATOM 1283 C ARG A 83 21.480 24.036 41.139 1.00 0.00 C ATOM 1284 O ARG A 83 22.093 24.359 42.169 1.00 0.00 O ATOM 1285 CB ARG A 83 22.302 24.976 38.953 1.00 0.00 C ATOM 1286 CG ARG A 83 23.155 26.037 39.652 1.00 0.00 C ATOM 1287 CD ARG A 83 23.930 26.841 38.607 1.00 0.00 C ATOM 1288 NE ARG A 83 23.892 28.248 39.102 1.00 0.00 N ATOM 1289 CZ ARG A 83 22.795 28.959 39.013 1.00 0.00 C ATOM 1290 NH1 ARG A 83 21.707 28.453 38.489 1.00 0.00 N ATOM 1291 NH2 ARG A 83 22.787 30.187 39.453 1.00 0.00 N ATOM 0 H ARG A 83 21.005 23.117 38.181 1.00 0.00 H new ATOM 0 HA ARG A 83 23.203 23.354 40.088 1.00 0.00 H new ATOM 0 HB2 ARG A 83 22.739 24.722 37.987 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.304 25.368 38.758 1.00 0.00 H new ATOM 0 HG2 ARG A 83 22.520 26.701 40.239 1.00 0.00 H new ATOM 0 HG3 ARG A 83 23.847 25.562 40.347 1.00 0.00 H new ATOM 0 HD2 ARG A 83 24.955 26.483 38.513 1.00 0.00 H new ATOM 0 HD3 ARG A 83 23.471 26.756 37.622 1.00 0.00 H new ATOM 0 HE ARG A 83 24.729 28.661 39.514 1.00 0.00 H new ATOM 0 HH11 ARG A 83 21.706 27.493 38.143 1.00 0.00 H new ATOM 0 HH12 ARG A 83 20.860 29.018 38.426 1.00 0.00 H new ATOM 0 HH21 ARG A 83 23.631 30.587 39.863 1.00 0.00 H new ATOM 0 HH22 ARG A 83 21.937 30.747 39.387 1.00 0.00 H new ATOM 1305 N LEU A 84 20.178 23.899 41.141 1.00 0.00 N ATOM 1306 CA LEU A 84 19.455 24.153 42.385 1.00 0.00 C ATOM 1307 C LEU A 84 19.628 22.944 43.295 1.00 0.00 C ATOM 1308 O LEU A 84 19.708 23.074 44.516 1.00 0.00 O ATOM 1309 CB LEU A 84 18.008 24.354 42.085 1.00 0.00 C ATOM 1310 CG LEU A 84 17.348 24.736 43.412 1.00 0.00 C ATOM 1311 CD1 LEU A 84 17.977 26.025 44.017 1.00 0.00 C ATOM 1312 CD2 LEU A 84 15.885 24.946 43.152 1.00 0.00 C ATOM 0 H LEU A 84 19.608 23.626 40.341 1.00 0.00 H new ATOM 0 HA LEU A 84 19.843 25.047 42.873 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.870 25.138 41.341 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.565 23.446 41.677 1.00 0.00 H new ATOM 0 HG LEU A 84 17.503 23.937 44.137 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.482 26.264 44.958 1.00 0.00 H new ATOM 0 HD12 LEU A 84 19.040 25.861 44.197 1.00 0.00 H new ATOM 0 HD13 LEU A 84 17.850 26.853 43.320 1.00 0.00 H new ATOM 0 HD21 LEU A 84 15.386 25.220 44.081 1.00 0.00 H new ATOM 0 HD22 LEU A 84 15.756 25.745 42.422 1.00 0.00 H new ATOM 0 HD23 LEU A 84 15.449 24.026 42.764 1.00 0.00 H new ATOM 1324 N ASP A 85 19.750 21.775 42.729 1.00 0.00 N ATOM 1325 CA ASP A 85 19.990 20.573 43.581 1.00 0.00 C ATOM 1326 C ASP A 85 21.297 20.794 44.346 1.00 0.00 C ATOM 1327 O ASP A 85 21.427 20.466 45.533 1.00 0.00 O ATOM 1328 CB ASP A 85 20.136 19.414 42.600 1.00 0.00 C ATOM 1329 CG ASP A 85 18.768 18.782 42.343 1.00 0.00 C ATOM 1330 OD1 ASP A 85 18.201 18.241 43.278 1.00 0.00 O ATOM 1331 OD2 ASP A 85 18.308 18.851 41.214 1.00 0.00 O ATOM 0 H ASP A 85 19.695 21.599 41.726 1.00 0.00 H new ATOM 0 HA ASP A 85 19.194 20.382 44.301 1.00 0.00 H new ATOM 0 HB2 ASP A 85 20.565 19.770 41.663 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.822 18.669 43.002 1.00 0.00 H new ATOM 1336 N LYS A 86 22.256 21.396 43.694 1.00 0.00 N ATOM 1337 CA LYS A 86 23.557 21.698 44.374 1.00 0.00 C ATOM 1338 C LYS A 86 23.295 22.586 45.610 1.00 0.00 C ATOM 1339 O LYS A 86 23.705 22.273 46.732 1.00 0.00 O ATOM 1340 CB LYS A 86 24.386 22.453 43.332 1.00 0.00 C ATOM 1341 CG LYS A 86 25.856 22.487 43.767 1.00 0.00 C ATOM 1342 CD LYS A 86 26.721 21.836 42.685 1.00 0.00 C ATOM 1343 CE LYS A 86 28.068 22.557 42.599 1.00 0.00 C ATOM 1344 NZ LYS A 86 28.730 21.988 41.392 1.00 0.00 N ATOM 0 H LYS A 86 22.198 21.693 42.720 1.00 0.00 H new ATOM 0 HA LYS A 86 24.071 20.801 44.720 1.00 0.00 H new ATOM 0 HB2 LYS A 86 24.295 21.968 42.360 1.00 0.00 H new ATOM 0 HB3 LYS A 86 24.007 23.469 43.218 1.00 0.00 H new ATOM 0 HG2 LYS A 86 26.174 23.516 43.932 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.979 21.960 44.713 1.00 0.00 H new ATOM 0 HD2 LYS A 86 26.876 20.782 42.915 1.00 0.00 H new ATOM 0 HD3 LYS A 86 26.211 21.881 41.722 1.00 0.00 H new ATOM 0 HE2 LYS A 86 27.934 23.635 42.505 1.00 0.00 H new ATOM 0 HE3 LYS A 86 28.665 22.387 43.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 29.661 22.433 41.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 28.850 20.962 41.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 28.141 22.171 40.554 1.00 0.00 H new ATOM 1358 N ILE A 87 22.599 23.677 45.425 1.00 0.00 N ATOM 1359 CA ILE A 87 22.274 24.594 46.575 1.00 0.00 C ATOM 1360 C ILE A 87 21.619 23.812 47.745 1.00 0.00 C ATOM 1361 O ILE A 87 21.983 23.974 48.906 1.00 0.00 O ATOM 1362 CB ILE A 87 21.296 25.593 45.956 1.00 0.00 C ATOM 1363 CG1 ILE A 87 22.044 26.524 44.992 1.00 0.00 C ATOM 1364 CG2 ILE A 87 20.641 26.412 47.052 1.00 0.00 C ATOM 1365 CD1 ILE A 87 23.004 27.430 45.772 1.00 0.00 C ATOM 0 H ILE A 87 22.236 23.981 44.522 1.00 0.00 H new ATOM 0 HA ILE A 87 23.154 25.072 47.006 1.00 0.00 H new ATOM 0 HB ILE A 87 20.529 25.049 45.405 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.600 25.934 44.263 1.00 0.00 H new ATOM 0 HG13 ILE A 87 21.331 27.131 44.434 1.00 0.00 H new ATOM 0 HG21 ILE A 87 19.945 27.123 46.608 1.00 0.00 H new ATOM 0 HG22 ILE A 87 20.101 25.749 47.728 1.00 0.00 H new ATOM 0 HG23 ILE A 87 21.406 26.953 47.609 1.00 0.00 H new ATOM 0 HD11 ILE A 87 23.529 28.086 45.078 1.00 0.00 H new ATOM 0 HD12 ILE A 87 22.439 28.032 46.484 1.00 0.00 H new ATOM 0 HD13 ILE A 87 23.727 26.817 46.310 1.00 0.00 H new ATOM 1377 N THR A 88 20.675 22.951 47.459 1.00 0.00 N ATOM 1378 CA THR A 88 20.039 22.144 48.545 1.00 0.00 C ATOM 1379 C THR A 88 21.157 21.477 49.345 1.00 0.00 C ATOM 1380 O THR A 88 21.178 21.510 50.573 1.00 0.00 O ATOM 1381 CB THR A 88 19.177 21.100 47.834 1.00 0.00 C ATOM 1382 OG1 THR A 88 18.488 21.715 46.756 1.00 0.00 O ATOM 1383 CG2 THR A 88 18.168 20.515 48.823 1.00 0.00 C ATOM 0 H THR A 88 20.317 22.772 46.521 1.00 0.00 H new ATOM 0 HA THR A 88 19.432 22.737 49.229 1.00 0.00 H new ATOM 0 HB THR A 88 19.811 20.301 47.450 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.936 21.048 46.297 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.553 19.771 48.318 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.700 20.045 49.650 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.531 21.312 49.207 1.00 0.00 H new ATOM 1391 N HIS A 89 22.129 20.921 48.657 1.00 0.00 N ATOM 1392 CA HIS A 89 23.290 20.313 49.372 1.00 0.00 C ATOM 1393 C HIS A 89 23.882 21.392 50.289 1.00 0.00 C ATOM 1394 O HIS A 89 24.252 21.132 51.434 1.00 0.00 O ATOM 1395 CB HIS A 89 24.285 19.916 48.281 1.00 0.00 C ATOM 1396 CG HIS A 89 25.070 18.717 48.737 1.00 0.00 C ATOM 1397 ND1 HIS A 89 25.001 17.495 48.086 1.00 0.00 N ATOM 1398 CD2 HIS A 89 25.940 18.537 49.783 1.00 0.00 C ATOM 1399 CE1 HIS A 89 25.810 16.641 48.741 1.00 0.00 C ATOM 1400 NE2 HIS A 89 26.406 17.225 49.783 1.00 0.00 N ATOM 0 H HIS A 89 22.165 20.864 47.639 1.00 0.00 H new ATOM 0 HA HIS A 89 23.026 19.446 49.978 1.00 0.00 H new ATOM 0 HB2 HIS A 89 23.756 19.688 47.356 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.958 20.746 48.067 1.00 0.00 H new ATOM 0 HD2 HIS A 89 26.220 19.297 50.497 1.00 0.00 H new ATOM 0 HE1 HIS A 89 25.959 15.609 48.458 1.00 0.00 H new ATOM 0 HE2 HIS A 89 27.062 16.801 50.439 1.00 0.00 H new ATOM 1408 N ALA A 90 23.922 22.620 49.812 1.00 0.00 N ATOM 1409 CA ALA A 90 24.425 23.744 50.658 1.00 0.00 C ATOM 1410 C ALA A 90 23.618 23.752 51.947 1.00 0.00 C ATOM 1411 O ALA A 90 24.154 23.941 53.036 1.00 0.00 O ATOM 1412 CB ALA A 90 24.174 25.046 49.864 1.00 0.00 C ATOM 0 H ALA A 90 23.627 22.886 48.873 1.00 0.00 H new ATOM 0 HA ALA A 90 25.484 23.646 50.897 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.526 25.899 50.444 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.712 25.004 48.917 1.00 0.00 H new ATOM 0 HB3 ALA A 90 23.107 25.154 49.671 1.00 0.00 H new ATOM 1418 N CYS A 91 22.329 23.514 51.858 1.00 0.00 N ATOM 1419 CA CYS A 91 21.522 23.487 53.111 1.00 0.00 C ATOM 1420 C CYS A 91 22.028 22.347 54.003 1.00 0.00 C ATOM 1421 O CYS A 91 22.269 22.522 55.199 1.00 0.00 O ATOM 1422 CB CYS A 91 20.065 23.219 52.718 1.00 0.00 C ATOM 1423 SG CYS A 91 19.107 22.908 54.233 1.00 0.00 S ATOM 0 H CYS A 91 21.816 23.342 50.994 1.00 0.00 H new ATOM 0 HA CYS A 91 21.605 24.430 53.651 1.00 0.00 H new ATOM 0 HB2 CYS A 91 19.655 24.073 52.179 1.00 0.00 H new ATOM 0 HB3 CYS A 91 20.005 22.361 52.049 1.00 0.00 H new ATOM 0 HG CYS A 91 18.814 24.040 54.801 1.00 0.00 H new ATOM 1429 N ARG A 92 22.192 21.183 53.434 1.00 0.00 N ATOM 1430 CA ARG A 92 22.683 20.011 54.217 1.00 0.00 C ATOM 1431 C ARG A 92 23.916 20.404 55.032 1.00 0.00 C ATOM 1432 O ARG A 92 23.890 20.397 56.256 1.00 0.00 O ATOM 1433 CB ARG A 92 23.048 18.969 53.157 1.00 0.00 C ATOM 1434 CG ARG A 92 22.843 17.562 53.720 1.00 0.00 C ATOM 1435 CD ARG A 92 21.427 17.080 53.394 1.00 0.00 C ATOM 1436 NE ARG A 92 21.336 17.101 51.903 1.00 0.00 N ATOM 1437 CZ ARG A 92 20.168 17.103 51.303 1.00 0.00 C ATOM 1438 NH1 ARG A 92 19.056 17.088 51.995 1.00 0.00 N ATOM 1439 NH2 ARG A 92 20.113 17.121 49.999 1.00 0.00 N ATOM 0 H ARG A 92 22.005 20.992 52.450 1.00 0.00 H new ATOM 0 HA ARG A 92 21.943 19.637 54.925 1.00 0.00 H new ATOM 0 HB2 ARG A 92 22.431 19.109 52.269 1.00 0.00 H new ATOM 0 HB3 ARG A 92 24.085 19.099 52.848 1.00 0.00 H new ATOM 0 HG2 ARG A 92 23.578 16.878 53.294 1.00 0.00 H new ATOM 0 HG3 ARG A 92 22.998 17.565 54.799 1.00 0.00 H new ATOM 0 HD2 ARG A 92 21.253 16.077 53.784 1.00 0.00 H new ATOM 0 HD3 ARG A 92 20.677 17.731 53.843 1.00 0.00 H new ATOM 0 HE ARG A 92 22.190 17.114 51.345 1.00 0.00 H new ATOM 0 HH11 ARG A 92 19.090 17.075 53.014 1.00 0.00 H new ATOM 0 HH12 ARG A 92 18.156 17.090 51.515 1.00 0.00 H new ATOM 0 HH21 ARG A 92 20.974 17.133 49.452 1.00 0.00 H new ATOM 0 HH22 ARG A 92 19.209 17.123 49.527 1.00 0.00 H new ATOM 1453 N LEU A 93 24.989 20.761 54.376 1.00 0.00 N ATOM 1454 CA LEU A 93 26.222 21.170 55.113 1.00 0.00 C ATOM 1455 C LEU A 93 25.908 22.261 56.152 1.00 0.00 C ATOM 1456 O LEU A 93 26.518 22.286 57.226 1.00 0.00 O ATOM 1457 CB LEU A 93 27.252 21.634 54.072 1.00 0.00 C ATOM 1458 CG LEU A 93 26.672 22.704 53.153 1.00 0.00 C ATOM 1459 CD1 LEU A 93 26.936 24.087 53.750 1.00 0.00 C ATOM 1460 CD2 LEU A 93 27.356 22.605 51.785 1.00 0.00 C ATOM 0 H LEU A 93 25.065 20.787 53.359 1.00 0.00 H new ATOM 0 HA LEU A 93 26.630 20.332 55.677 1.00 0.00 H new ATOM 0 HB2 LEU A 93 28.133 22.027 54.580 1.00 0.00 H new ATOM 0 HB3 LEU A 93 27.580 20.781 53.478 1.00 0.00 H new ATOM 0 HG LEU A 93 25.598 22.555 53.045 1.00 0.00 H new ATOM 0 HD11 LEU A 93 26.522 24.852 53.093 1.00 0.00 H new ATOM 0 HD12 LEU A 93 26.465 24.156 54.730 1.00 0.00 H new ATOM 0 HD13 LEU A 93 28.010 24.240 53.852 1.00 0.00 H new ATOM 0 HD21 LEU A 93 26.949 23.366 51.119 1.00 0.00 H new ATOM 0 HD22 LEU A 93 28.428 22.761 51.902 1.00 0.00 H new ATOM 0 HD23 LEU A 93 27.178 21.617 51.360 1.00 0.00 H new ATOM 1472 N LEU A 94 24.986 23.163 55.866 1.00 0.00 N ATOM 1473 CA LEU A 94 24.664 24.271 56.845 1.00 0.00 C ATOM 1474 C LEU A 94 23.981 23.680 58.105 1.00 0.00 C ATOM 1475 O LEU A 94 23.816 24.347 59.123 1.00 0.00 O ATOM 1476 CB LEU A 94 23.628 25.146 56.076 1.00 0.00 C ATOM 1477 CG LEU A 94 24.264 26.422 55.493 1.00 0.00 C ATOM 1478 CD1 LEU A 94 24.256 26.357 53.959 1.00 0.00 C ATOM 1479 CD2 LEU A 94 23.434 27.640 55.911 1.00 0.00 C ATOM 0 H LEU A 94 24.444 23.182 55.002 1.00 0.00 H new ATOM 0 HA LEU A 94 25.549 24.819 57.170 1.00 0.00 H new ATOM 0 HB2 LEU A 94 23.188 24.560 55.269 1.00 0.00 H new ATOM 0 HB3 LEU A 94 22.816 25.421 56.749 1.00 0.00 H new ATOM 0 HG LEU A 94 25.286 26.503 55.863 1.00 0.00 H new ATOM 0 HD11 LEU A 94 24.707 27.263 53.554 1.00 0.00 H new ATOM 0 HD12 LEU A 94 24.826 25.489 53.629 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.229 26.273 53.604 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.882 28.544 55.500 1.00 0.00 H new ATOM 0 HD22 LEU A 94 22.417 27.535 55.533 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.411 27.709 56.999 1.00 0.00 H new ATOM 1491 N GLU A 95 23.606 22.427 58.034 1.00 0.00 N ATOM 1492 CA GLU A 95 22.956 21.747 59.194 1.00 0.00 C ATOM 1493 C GLU A 95 23.641 20.397 59.449 1.00 0.00 C ATOM 1494 O GLU A 95 23.365 19.719 60.437 1.00 0.00 O ATOM 1495 CB GLU A 95 21.500 21.537 58.757 1.00 0.00 C ATOM 1496 CG GLU A 95 20.799 20.550 59.702 1.00 0.00 C ATOM 1497 CD GLU A 95 20.765 21.128 61.118 1.00 0.00 C ATOM 1498 OE1 GLU A 95 19.907 21.955 61.377 1.00 0.00 O ATOM 1499 OE2 GLU A 95 21.596 20.733 61.918 1.00 0.00 O ATOM 0 H GLU A 95 23.725 21.839 57.209 1.00 0.00 H new ATOM 0 HA GLU A 95 23.025 22.324 60.116 1.00 0.00 H new ATOM 0 HB2 GLU A 95 20.971 22.490 58.758 1.00 0.00 H new ATOM 0 HB3 GLU A 95 21.470 21.157 57.736 1.00 0.00 H new ATOM 0 HG2 GLU A 95 19.785 20.356 59.354 1.00 0.00 H new ATOM 0 HG3 GLU A 95 21.324 19.595 59.701 1.00 0.00 H new ATOM 1506 N GLN A 96 24.521 19.993 58.571 1.00 0.00 N ATOM 1507 CA GLN A 96 25.212 18.689 58.746 1.00 0.00 C ATOM 1508 C GLN A 96 26.388 18.844 59.701 1.00 0.00 C ATOM 1509 O GLN A 96 26.578 18.029 60.603 1.00 0.00 O ATOM 1510 CB GLN A 96 25.698 18.308 57.348 1.00 0.00 C ATOM 1511 CG GLN A 96 26.178 16.856 57.355 1.00 0.00 C ATOM 1512 CD GLN A 96 26.367 16.377 55.915 1.00 0.00 C ATOM 1513 OE1 GLN A 96 27.477 16.395 55.389 1.00 0.00 O ATOM 1514 NE2 GLN A 96 25.333 15.947 55.242 1.00 0.00 N ATOM 0 H GLN A 96 24.790 20.515 57.737 1.00 0.00 H new ATOM 0 HA GLN A 96 24.559 17.926 59.170 1.00 0.00 H new ATOM 0 HB2 GLN A 96 24.892 18.433 56.624 1.00 0.00 H new ATOM 0 HB3 GLN A 96 26.508 18.969 57.040 1.00 0.00 H new ATOM 0 HG2 GLN A 96 27.116 16.774 57.903 1.00 0.00 H new ATOM 0 HG3 GLN A 96 25.453 16.224 57.868 1.00 0.00 H new ATOM 0 HE21 GLN A 96 24.411 15.932 55.678 1.00 0.00 H new ATOM 0 HE22 GLN A 96 25.448 15.627 54.280 1.00 0.00 H new ATOM 1523 N GLU A 97 27.185 19.870 59.538 1.00 0.00 N ATOM 1524 CA GLU A 97 28.336 20.028 60.481 1.00 0.00 C ATOM 1525 C GLU A 97 27.848 20.631 61.803 1.00 0.00 C ATOM 1526 O GLU A 97 26.669 20.544 62.143 1.00 0.00 O ATOM 1527 CB GLU A 97 29.328 20.977 59.776 1.00 0.00 C ATOM 1528 CG GLU A 97 28.635 22.239 59.209 1.00 0.00 C ATOM 1529 CD GLU A 97 27.372 22.602 60.006 1.00 0.00 C ATOM 1530 OE1 GLU A 97 27.508 23.216 61.046 1.00 0.00 O ATOM 1531 OE2 GLU A 97 26.291 22.250 59.563 1.00 0.00 O ATOM 0 H GLU A 97 27.095 20.585 58.817 1.00 0.00 H new ATOM 0 HA GLU A 97 28.806 19.074 60.718 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.103 21.277 60.481 1.00 0.00 H new ATOM 0 HB3 GLU A 97 29.824 20.443 58.966 1.00 0.00 H new ATOM 0 HG2 GLU A 97 29.332 23.077 59.230 1.00 0.00 H new ATOM 0 HG3 GLU A 97 28.370 22.071 58.165 1.00 0.00 H new ATOM 1538 N THR A 98 28.715 21.273 62.536 1.00 0.00 N ATOM 1539 CA THR A 98 28.282 21.918 63.809 1.00 0.00 C ATOM 1540 C THR A 98 28.216 23.440 63.584 1.00 0.00 C ATOM 1541 O THR A 98 27.127 24.008 63.539 1.00 0.00 O ATOM 1542 CB THR A 98 29.323 21.505 64.863 1.00 0.00 C ATOM 1543 OG1 THR A 98 29.027 20.190 65.315 1.00 0.00 O ATOM 1544 CG2 THR A 98 29.280 22.473 66.050 1.00 0.00 C ATOM 0 H THR A 98 29.704 21.379 62.310 1.00 0.00 H new ATOM 0 HA THR A 98 27.292 21.610 64.146 1.00 0.00 H new ATOM 0 HB THR A 98 30.318 21.532 64.419 1.00 0.00 H new ATOM 0 HG1 THR A 98 29.687 19.918 65.986 1.00 0.00 H new ATOM 0 HG21 THR A 98 30.020 22.173 66.791 1.00 0.00 H new ATOM 0 HG22 THR A 98 29.501 23.483 65.704 1.00 0.00 H new ATOM 0 HG23 THR A 98 28.287 22.453 66.500 1.00 0.00 H new ATOM 1552 N PRO A 99 29.373 24.055 63.372 1.00 0.00 N ATOM 1553 CA PRO A 99 29.445 25.509 63.031 1.00 0.00 C ATOM 1554 C PRO A 99 28.830 25.736 61.633 1.00 0.00 C ATOM 1555 O PRO A 99 29.039 24.926 60.732 1.00 0.00 O ATOM 1556 CB PRO A 99 30.938 25.822 63.037 1.00 0.00 C ATOM 1557 CG PRO A 99 31.596 24.512 62.774 1.00 0.00 C ATOM 1558 CD PRO A 99 30.725 23.467 63.417 1.00 0.00 C ATOM 0 HA PRO A 99 28.897 26.147 63.724 1.00 0.00 H new ATOM 0 HB2 PRO A 99 31.193 26.555 62.271 1.00 0.00 H new ATOM 0 HB3 PRO A 99 31.252 26.239 63.994 1.00 0.00 H new ATOM 0 HG2 PRO A 99 31.692 24.333 61.703 1.00 0.00 H new ATOM 0 HG3 PRO A 99 32.602 24.491 63.192 1.00 0.00 H new ATOM 0 HD2 PRO A 99 30.768 22.522 62.875 1.00 0.00 H new ATOM 0 HD3 PRO A 99 31.037 23.261 64.441 1.00 0.00 H new ATOM 1566 N VAL A 100 28.098 26.798 61.408 1.00 0.00 N ATOM 1567 CA VAL A 100 27.510 27.003 60.036 1.00 0.00 C ATOM 1568 C VAL A 100 28.585 27.537 59.072 1.00 0.00 C ATOM 1569 O VAL A 100 29.573 28.135 59.494 1.00 0.00 O ATOM 1570 CB VAL A 100 26.399 28.040 60.218 1.00 0.00 C ATOM 1571 CG1 VAL A 100 25.612 28.177 58.914 1.00 0.00 C ATOM 1572 CG2 VAL A 100 25.453 27.594 61.337 1.00 0.00 C ATOM 0 H VAL A 100 27.882 27.521 62.094 1.00 0.00 H new ATOM 0 HA VAL A 100 27.130 26.073 59.614 1.00 0.00 H new ATOM 0 HB VAL A 100 26.843 29.000 60.481 1.00 0.00 H new ATOM 0 HG11 VAL A 100 24.820 28.915 59.043 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.282 28.498 58.117 1.00 0.00 H new ATOM 0 HG13 VAL A 100 25.172 27.215 58.652 1.00 0.00 H new ATOM 0 HG21 VAL A 100 24.664 28.335 61.463 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.010 26.633 61.077 1.00 0.00 H new ATOM 0 HG23 VAL A 100 26.011 27.496 62.268 1.00 0.00 H new ATOM 1582 N THR A 101 28.435 27.296 57.784 1.00 0.00 N ATOM 1583 CA THR A 101 29.478 27.753 56.809 1.00 0.00 C ATOM 1584 C THR A 101 28.872 28.471 55.584 1.00 0.00 C ATOM 1585 O THR A 101 28.081 27.911 54.830 1.00 0.00 O ATOM 1586 CB THR A 101 30.176 26.464 56.364 1.00 0.00 C ATOM 1587 OG1 THR A 101 29.516 25.337 56.927 1.00 0.00 O ATOM 1588 CG2 THR A 101 31.621 26.485 56.848 1.00 0.00 C ATOM 0 H THR A 101 27.641 26.806 57.372 1.00 0.00 H new ATOM 0 HA THR A 101 30.150 28.477 57.270 1.00 0.00 H new ATOM 0 HB THR A 101 30.145 26.396 55.277 1.00 0.00 H new ATOM 0 HG1 THR A 101 29.966 24.516 56.637 1.00 0.00 H new ATOM 0 HG21 THR A 101 32.123 25.570 56.534 1.00 0.00 H new ATOM 0 HG22 THR A 101 32.135 27.346 56.421 1.00 0.00 H new ATOM 0 HG23 THR A 101 31.639 26.554 57.936 1.00 0.00 H new ATOM 1596 N LEU A 102 29.267 29.702 55.380 1.00 0.00 N ATOM 1597 CA LEU A 102 28.790 30.504 54.232 1.00 0.00 C ATOM 1598 C LEU A 102 30.017 31.114 53.573 1.00 0.00 C ATOM 1599 O LEU A 102 30.148 31.144 52.353 1.00 0.00 O ATOM 1600 CB LEU A 102 27.903 31.586 54.843 1.00 0.00 C ATOM 1601 CG LEU A 102 26.486 31.038 55.037 1.00 0.00 C ATOM 1602 CD1 LEU A 102 26.025 31.301 56.473 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.539 31.738 54.064 1.00 0.00 C ATOM 0 H LEU A 102 29.923 30.193 55.988 1.00 0.00 H new ATOM 0 HA LEU A 102 28.239 29.933 53.485 1.00 0.00 H new ATOM 0 HB2 LEU A 102 28.313 31.910 55.800 1.00 0.00 H new ATOM 0 HB3 LEU A 102 27.880 32.461 54.194 1.00 0.00 H new ATOM 0 HG LEU A 102 26.482 29.965 54.848 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.017 30.910 56.609 1.00 0.00 H new ATOM 0 HD12 LEU A 102 26.703 30.806 57.169 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.027 32.374 56.665 1.00 0.00 H new ATOM 0 HD21 LEU A 102 24.529 31.351 54.198 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.546 32.811 54.258 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.866 31.552 53.041 1.00 0.00 H new ATOM 1615 N GLU A 103 30.939 31.581 54.389 1.00 0.00 N ATOM 1616 CA GLU A 103 32.213 32.185 53.882 1.00 0.00 C ATOM 1617 C GLU A 103 32.785 31.399 52.690 1.00 0.00 C ATOM 1618 O GLU A 103 33.194 31.982 51.687 1.00 0.00 O ATOM 1619 CB GLU A 103 33.174 32.121 55.069 1.00 0.00 C ATOM 1620 CG GLU A 103 34.380 33.023 54.799 1.00 0.00 C ATOM 1621 CD GLU A 103 35.637 32.390 55.399 1.00 0.00 C ATOM 1622 OE1 GLU A 103 35.923 32.667 56.552 1.00 0.00 O ATOM 1623 OE2 GLU A 103 36.293 31.639 54.696 1.00 0.00 O ATOM 0 H GLU A 103 30.857 31.567 55.406 1.00 0.00 H new ATOM 0 HA GLU A 103 32.053 33.201 53.521 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.666 32.438 55.979 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.503 31.094 55.229 1.00 0.00 H new ATOM 0 HG2 GLU A 103 34.508 33.165 53.726 1.00 0.00 H new ATOM 0 HG3 GLU A 103 34.214 34.009 55.233 1.00 0.00 H new ATOM 1630 N ALA A 104 32.823 30.091 52.774 1.00 0.00 N ATOM 1631 CA ALA A 104 33.369 29.284 51.642 1.00 0.00 C ATOM 1632 C ALA A 104 32.501 29.501 50.396 1.00 0.00 C ATOM 1633 O ALA A 104 33.008 29.689 49.289 1.00 0.00 O ATOM 1634 CB ALA A 104 33.286 27.830 52.111 1.00 0.00 C ATOM 0 H ALA A 104 32.500 29.550 53.576 1.00 0.00 H new ATOM 0 HA ALA A 104 34.390 29.562 51.381 1.00 0.00 H new ATOM 0 HB1 ALA A 104 33.670 27.173 51.330 1.00 0.00 H new ATOM 0 HB2 ALA A 104 33.881 27.705 53.016 1.00 0.00 H new ATOM 0 HB3 ALA A 104 32.248 27.574 52.321 1.00 0.00 H new ATOM 1640 N LEU A 105 31.198 29.491 50.555 1.00 0.00 N ATOM 1641 CA LEU A 105 30.303 29.708 49.379 1.00 0.00 C ATOM 1642 C LEU A 105 30.416 31.158 48.905 1.00 0.00 C ATOM 1643 O LEU A 105 30.425 31.442 47.708 1.00 0.00 O ATOM 1644 CB LEU A 105 28.883 29.414 49.877 1.00 0.00 C ATOM 1645 CG LEU A 105 28.180 28.454 48.906 1.00 0.00 C ATOM 1646 CD1 LEU A 105 27.363 27.432 49.699 1.00 0.00 C ATOM 1647 CD2 LEU A 105 27.244 29.243 47.977 1.00 0.00 C ATOM 0 H LEU A 105 30.720 29.343 51.444 1.00 0.00 H new ATOM 0 HA LEU A 105 30.568 29.068 48.538 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.921 28.975 50.874 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.317 30.342 49.959 1.00 0.00 H new ATOM 0 HG LEU A 105 28.931 27.938 48.308 1.00 0.00 H new ATOM 0 HD11 LEU A 105 26.864 26.751 49.009 1.00 0.00 H new ATOM 0 HD12 LEU A 105 28.026 26.865 50.353 1.00 0.00 H new ATOM 0 HD13 LEU A 105 26.616 27.951 50.300 1.00 0.00 H new ATOM 0 HD21 LEU A 105 26.749 28.556 47.291 1.00 0.00 H new ATOM 0 HD22 LEU A 105 26.495 29.764 48.573 1.00 0.00 H new ATOM 0 HD23 LEU A 105 27.824 29.969 47.408 1.00 0.00 H new ATOM 1659 N ALA A 106 30.509 32.081 49.821 1.00 0.00 N ATOM 1660 CA ALA A 106 30.627 33.516 49.436 1.00 0.00 C ATOM 1661 C ALA A 106 31.944 33.759 48.693 1.00 0.00 C ATOM 1662 O ALA A 106 31.986 34.454 47.678 1.00 0.00 O ATOM 1663 CB ALA A 106 30.608 34.282 50.760 1.00 0.00 C ATOM 0 H ALA A 106 30.508 31.903 50.825 1.00 0.00 H new ATOM 0 HA ALA A 106 29.825 33.833 48.769 1.00 0.00 H new ATOM 0 HB1 ALA A 106 30.691 35.351 50.563 1.00 0.00 H new ATOM 0 HB2 ALA A 106 29.673 34.081 51.283 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.446 33.961 51.378 1.00 0.00 H new ATOM 1669 N ASP A 107 33.018 33.195 49.176 1.00 0.00 N ATOM 1670 CA ASP A 107 34.329 33.381 48.511 1.00 0.00 C ATOM 1671 C ASP A 107 34.355 32.669 47.153 1.00 0.00 C ATOM 1672 O ASP A 107 35.012 33.114 46.215 1.00 0.00 O ATOM 1673 CB ASP A 107 35.320 32.745 49.479 1.00 0.00 C ATOM 1674 CG ASP A 107 35.818 33.797 50.471 1.00 0.00 C ATOM 1675 OD1 ASP A 107 36.050 34.918 50.048 1.00 0.00 O ATOM 1676 OD2 ASP A 107 35.960 33.464 51.635 1.00 0.00 O ATOM 0 H ASP A 107 33.038 32.609 50.011 1.00 0.00 H new ATOM 0 HA ASP A 107 34.555 34.427 48.305 1.00 0.00 H new ATOM 0 HB2 ASP A 107 34.844 31.923 50.014 1.00 0.00 H new ATOM 0 HB3 ASP A 107 36.161 32.323 48.929 1.00 0.00 H new ATOM 1681 N GLN A 108 33.656 31.569 47.032 1.00 0.00 N ATOM 1682 CA GLN A 108 33.646 30.830 45.735 1.00 0.00 C ATOM 1683 C GLN A 108 32.860 31.607 44.672 1.00 0.00 C ATOM 1684 O GLN A 108 33.261 31.679 43.512 1.00 0.00 O ATOM 1685 CB GLN A 108 32.957 29.499 46.044 1.00 0.00 C ATOM 1686 CG GLN A 108 33.033 28.588 44.817 1.00 0.00 C ATOM 1687 CD GLN A 108 31.761 27.742 44.728 1.00 0.00 C ATOM 1688 OE1 GLN A 108 31.564 26.823 45.519 1.00 0.00 O ATOM 1689 NE2 GLN A 108 30.881 28.005 43.800 1.00 0.00 N ATOM 0 H GLN A 108 33.093 31.152 47.774 1.00 0.00 H new ATOM 0 HA GLN A 108 34.652 30.691 45.338 1.00 0.00 H new ATOM 0 HB2 GLN A 108 33.436 29.019 46.897 1.00 0.00 H new ATOM 0 HB3 GLN A 108 31.916 29.671 46.318 1.00 0.00 H new ATOM 0 HG2 GLN A 108 33.148 29.187 43.913 1.00 0.00 H new ATOM 0 HG3 GLN A 108 33.908 27.942 44.885 1.00 0.00 H new ATOM 0 HE21 GLN A 108 31.045 28.768 43.143 1.00 0.00 H new ATOM 0 HE22 GLN A 108 30.030 27.447 43.732 1.00 0.00 H new ATOM 1698 N VAL A 109 31.745 32.182 45.041 1.00 0.00 N ATOM 1699 CA VAL A 109 30.936 32.944 44.046 1.00 0.00 C ATOM 1700 C VAL A 109 31.389 34.408 43.982 1.00 0.00 C ATOM 1701 O VAL A 109 30.998 35.146 43.082 1.00 0.00 O ATOM 1702 CB VAL A 109 29.486 32.859 44.532 1.00 0.00 C ATOM 1703 CG1 VAL A 109 28.552 33.273 43.392 1.00 0.00 C ATOM 1704 CG2 VAL A 109 29.156 31.423 44.958 1.00 0.00 C ATOM 0 H VAL A 109 31.361 32.157 45.986 1.00 0.00 H new ATOM 0 HA VAL A 109 31.052 32.531 43.044 1.00 0.00 H new ATOM 0 HB VAL A 109 29.354 33.523 45.386 1.00 0.00 H new ATOM 0 HG11 VAL A 109 27.517 33.215 43.730 1.00 0.00 H new ATOM 0 HG12 VAL A 109 28.778 34.295 43.089 1.00 0.00 H new ATOM 0 HG13 VAL A 109 28.694 32.604 42.544 1.00 0.00 H new ATOM 0 HG21 VAL A 109 28.123 31.374 45.302 1.00 0.00 H new ATOM 0 HG22 VAL A 109 29.288 30.752 44.109 1.00 0.00 H new ATOM 0 HG23 VAL A 109 29.822 31.121 45.766 1.00 0.00 H new ATOM 1714 N ALA A 110 32.201 34.841 44.921 1.00 0.00 N ATOM 1715 CA ALA A 110 32.692 36.261 44.928 1.00 0.00 C ATOM 1716 C ALA A 110 31.618 37.191 45.501 1.00 0.00 C ATOM 1717 O ALA A 110 31.523 38.361 45.135 1.00 0.00 O ATOM 1718 CB ALA A 110 33.004 36.623 43.470 1.00 0.00 C ATOM 0 H ALA A 110 32.548 34.267 45.689 1.00 0.00 H new ATOM 0 HA ALA A 110 33.579 36.371 45.553 1.00 0.00 H new ATOM 0 HB1 ALA A 110 33.366 37.650 43.420 1.00 0.00 H new ATOM 0 HB2 ALA A 110 33.769 35.949 43.083 1.00 0.00 H new ATOM 0 HB3 ALA A 110 32.099 36.528 42.870 1.00 0.00 H new ATOM 1724 N MET A 111 30.806 36.688 46.397 1.00 0.00 N ATOM 1725 CA MET A 111 29.736 37.539 47.000 1.00 0.00 C ATOM 1726 C MET A 111 29.592 37.252 48.503 1.00 0.00 C ATOM 1727 O MET A 111 30.103 36.260 49.017 1.00 0.00 O ATOM 1728 CB MET A 111 28.455 37.161 46.251 1.00 0.00 C ATOM 1729 CG MET A 111 28.326 35.636 46.170 1.00 0.00 C ATOM 1730 SD MET A 111 26.646 35.144 46.622 1.00 0.00 S ATOM 1731 CE MET A 111 26.413 33.888 45.342 1.00 0.00 C ATOM 0 H MET A 111 30.838 35.727 46.736 1.00 0.00 H new ATOM 0 HA MET A 111 29.963 38.601 46.910 1.00 0.00 H new ATOM 0 HB2 MET A 111 27.588 37.581 46.761 1.00 0.00 H new ATOM 0 HB3 MET A 111 28.471 37.587 45.248 1.00 0.00 H new ATOM 0 HG2 MET A 111 28.557 35.295 45.161 1.00 0.00 H new ATOM 0 HG3 MET A 111 29.046 35.164 46.838 1.00 0.00 H new ATOM 0 HE1 MET A 111 25.386 33.524 45.372 1.00 0.00 H new ATOM 0 HE2 MET A 111 26.615 34.324 44.364 1.00 0.00 H new ATOM 0 HE3 MET A 111 27.097 33.058 45.518 1.00 0.00 H new ATOM 1741 N SER A 112 28.907 38.114 49.209 1.00 0.00 N ATOM 1742 CA SER A 112 28.713 37.927 50.683 1.00 0.00 C ATOM 1743 C SER A 112 27.714 36.790 50.969 1.00 0.00 C ATOM 1744 O SER A 112 27.068 36.285 50.054 1.00 0.00 O ATOM 1745 CB SER A 112 28.171 39.272 51.179 1.00 0.00 C ATOM 1746 OG SER A 112 26.760 39.190 51.340 1.00 0.00 O ATOM 0 H SER A 112 28.468 38.950 48.824 1.00 0.00 H new ATOM 0 HA SER A 112 29.638 37.647 51.186 1.00 0.00 H new ATOM 0 HB2 SER A 112 28.640 39.537 52.127 1.00 0.00 H new ATOM 0 HB3 SER A 112 28.421 40.060 50.468 1.00 0.00 H new ATOM 0 HG SER A 112 26.417 40.051 51.659 1.00 0.00 H new ATOM 1752 N PRO A 113 27.616 36.417 52.228 1.00 0.00 N ATOM 1753 CA PRO A 113 26.685 35.329 52.632 1.00 0.00 C ATOM 1754 C PRO A 113 25.246 35.747 52.356 1.00 0.00 C ATOM 1755 O PRO A 113 24.410 34.921 51.978 1.00 0.00 O ATOM 1756 CB PRO A 113 26.957 35.159 54.126 1.00 0.00 C ATOM 1757 CG PRO A 113 27.529 36.469 54.554 1.00 0.00 C ATOM 1758 CD PRO A 113 28.331 36.973 53.384 1.00 0.00 C ATOM 0 HA PRO A 113 26.832 34.398 52.085 1.00 0.00 H new ATOM 0 HB2 PRO A 113 26.042 34.928 54.672 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.654 34.342 54.312 1.00 0.00 H new ATOM 0 HG2 PRO A 113 26.739 37.172 54.818 1.00 0.00 H new ATOM 0 HG3 PRO A 113 28.158 36.351 55.436 1.00 0.00 H new ATOM 0 HD2 PRO A 113 28.360 38.062 53.354 1.00 0.00 H new ATOM 0 HD3 PRO A 113 29.364 36.627 53.424 1.00 0.00 H new ATOM 1766 N PHE A 114 24.933 37.012 52.477 1.00 0.00 N ATOM 1767 CA PHE A 114 23.547 37.426 52.155 1.00 0.00 C ATOM 1768 C PHE A 114 23.324 37.305 50.656 1.00 0.00 C ATOM 1769 O PHE A 114 22.253 36.872 50.232 1.00 0.00 O ATOM 1770 CB PHE A 114 23.349 38.858 52.632 1.00 0.00 C ATOM 1771 CG PHE A 114 23.291 38.909 54.144 1.00 0.00 C ATOM 1772 CD1 PHE A 114 23.657 37.802 54.922 1.00 0.00 C ATOM 1773 CD2 PHE A 114 22.870 40.083 54.765 1.00 0.00 C ATOM 1774 CE1 PHE A 114 23.608 37.880 56.317 1.00 0.00 C ATOM 1775 CE2 PHE A 114 22.815 40.162 56.158 1.00 0.00 C ATOM 1776 CZ PHE A 114 23.189 39.062 56.936 1.00 0.00 C ATOM 0 H PHE A 114 25.564 37.755 52.778 1.00 0.00 H new ATOM 0 HA PHE A 114 22.822 36.785 52.657 1.00 0.00 H new ATOM 0 HB2 PHE A 114 24.166 39.484 52.272 1.00 0.00 H new ATOM 0 HB3 PHE A 114 22.428 39.263 52.213 1.00 0.00 H new ATOM 0 HD1 PHE A 114 23.977 36.888 54.444 1.00 0.00 H new ATOM 0 HD2 PHE A 114 22.585 40.936 54.166 1.00 0.00 H new ATOM 0 HE1 PHE A 114 23.894 37.028 56.916 1.00 0.00 H new ATOM 0 HE2 PHE A 114 22.484 41.073 56.635 1.00 0.00 H new ATOM 0 HZ PHE A 114 23.154 39.125 58.014 1.00 0.00 H new ATOM 1786 N HIS A 115 24.286 37.634 49.816 1.00 0.00 N ATOM 1787 CA HIS A 115 23.990 37.449 48.377 1.00 0.00 C ATOM 1788 C HIS A 115 23.935 35.944 48.026 1.00 0.00 C ATOM 1789 O HIS A 115 23.217 35.544 47.111 1.00 0.00 O ATOM 1790 CB HIS A 115 24.970 38.203 47.498 1.00 0.00 C ATOM 1791 CG HIS A 115 24.197 38.472 46.228 1.00 0.00 C ATOM 1792 ND1 HIS A 115 24.495 37.844 45.029 1.00 0.00 N ATOM 1793 CD2 HIS A 115 23.035 39.179 46.003 1.00 0.00 C ATOM 1794 CE1 HIS A 115 23.523 38.169 44.150 1.00 0.00 C ATOM 1795 NE2 HIS A 115 22.603 38.982 44.692 1.00 0.00 N ATOM 0 H HIS A 115 25.207 38.001 50.056 1.00 0.00 H new ATOM 0 HA HIS A 115 23.007 37.875 48.176 1.00 0.00 H new ATOM 0 HB2 HIS A 115 25.296 39.130 47.970 1.00 0.00 H new ATOM 0 HB3 HIS A 115 25.865 37.613 47.302 1.00 0.00 H new ATOM 0 HD2 HIS A 115 22.533 39.795 46.735 1.00 0.00 H new ATOM 0 HE1 HIS A 115 23.490 37.816 43.130 1.00 0.00 H new ATOM 0 HE2 HIS A 115 21.772 39.370 44.244 1.00 0.00 H new ATOM 1803 N LEU A 116 24.615 35.093 48.767 1.00 0.00 N ATOM 1804 CA LEU A 116 24.515 33.621 48.493 1.00 0.00 C ATOM 1805 C LEU A 116 23.059 33.230 48.737 1.00 0.00 C ATOM 1806 O LEU A 116 22.440 32.528 47.939 1.00 0.00 O ATOM 1807 CB LEU A 116 25.467 32.937 49.492 1.00 0.00 C ATOM 1808 CG LEU A 116 24.895 31.584 49.961 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.505 30.719 48.754 1.00 0.00 C ATOM 1810 CD2 LEU A 116 25.952 30.848 50.792 1.00 0.00 C ATOM 0 H LEU A 116 25.228 35.352 49.540 1.00 0.00 H new ATOM 0 HA LEU A 116 24.790 33.333 47.478 1.00 0.00 H new ATOM 0 HB2 LEU A 116 26.440 32.783 49.026 1.00 0.00 H new ATOM 0 HB3 LEU A 116 25.626 33.587 50.352 1.00 0.00 H new ATOM 0 HG LEU A 116 24.006 31.767 50.565 1.00 0.00 H new ATOM 0 HD11 LEU A 116 24.103 29.768 49.103 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.749 31.238 48.164 1.00 0.00 H new ATOM 0 HD13 LEU A 116 25.385 30.537 48.137 1.00 0.00 H new ATOM 0 HD21 LEU A 116 25.551 29.891 51.125 1.00 0.00 H new ATOM 0 HD22 LEU A 116 26.840 30.677 50.183 1.00 0.00 H new ATOM 0 HD23 LEU A 116 26.218 31.452 51.660 1.00 0.00 H new ATOM 1822 N HIS A 117 22.485 33.730 49.802 1.00 0.00 N ATOM 1823 CA HIS A 117 21.045 33.452 50.071 1.00 0.00 C ATOM 1824 C HIS A 117 20.239 33.969 48.866 1.00 0.00 C ATOM 1825 O HIS A 117 19.409 33.264 48.293 1.00 0.00 O ATOM 1826 CB HIS A 117 20.690 34.253 51.332 1.00 0.00 C ATOM 1827 CG HIS A 117 21.674 33.988 52.445 1.00 0.00 C ATOM 1828 ND1 HIS A 117 21.778 34.832 53.540 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.585 32.981 52.662 1.00 0.00 C ATOM 1830 CE1 HIS A 117 22.715 34.324 54.358 1.00 0.00 C ATOM 1831 NE2 HIS A 117 23.237 33.197 53.871 1.00 0.00 N ATOM 0 H HIS A 117 22.951 34.317 50.494 1.00 0.00 H new ATOM 0 HA HIS A 117 20.831 32.393 50.215 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.680 35.318 51.098 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.685 33.990 51.662 1.00 0.00 H new ATOM 0 HD1 HIS A 117 21.240 35.685 53.696 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.766 32.150 51.996 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.010 34.773 55.295 1.00 0.00 H new ATOM 1839 N ARG A 118 20.519 35.188 48.446 1.00 0.00 N ATOM 1840 CA ARG A 118 19.826 35.788 47.250 1.00 0.00 C ATOM 1841 C ARG A 118 19.981 34.861 46.020 1.00 0.00 C ATOM 1842 O ARG A 118 19.055 34.697 45.229 1.00 0.00 O ATOM 1843 CB ARG A 118 20.532 37.126 47.006 1.00 0.00 C ATOM 1844 CG ARG A 118 19.518 38.270 47.094 1.00 0.00 C ATOM 1845 CD ARG A 118 19.040 38.422 48.540 1.00 0.00 C ATOM 1846 NE ARG A 118 17.724 37.721 48.584 1.00 0.00 N ATOM 1847 CZ ARG A 118 16.627 38.319 48.182 1.00 0.00 C ATOM 1848 NH1 ARG A 118 16.658 39.542 47.731 1.00 0.00 N ATOM 1849 NH2 ARG A 118 15.488 37.684 48.230 1.00 0.00 N ATOM 0 H ARG A 118 21.206 35.799 48.887 1.00 0.00 H new ATOM 0 HA ARG A 118 18.757 35.918 47.418 1.00 0.00 H new ATOM 0 HB2 ARG A 118 21.322 37.271 47.743 1.00 0.00 H new ATOM 0 HB3 ARG A 118 21.007 37.124 46.025 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.972 39.199 46.751 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.670 38.069 46.439 1.00 0.00 H new ATOM 0 HD2 ARG A 118 19.748 37.977 49.239 1.00 0.00 H new ATOM 0 HD3 ARG A 118 18.938 39.472 48.814 1.00 0.00 H new ATOM 0 HE ARG A 118 17.676 36.763 48.931 1.00 0.00 H new ATOM 0 HH11 ARG A 118 17.543 40.047 47.687 1.00 0.00 H new ATOM 0 HH12 ARG A 118 15.797 39.994 47.422 1.00 0.00 H new ATOM 0 HH21 ARG A 118 15.452 36.726 48.579 1.00 0.00 H new ATOM 0 HH22 ARG A 118 14.633 38.145 47.918 1.00 0.00 H new ATOM 1863 N LEU A 119 21.121 34.218 45.871 1.00 0.00 N ATOM 1864 CA LEU A 119 21.336 33.260 44.725 1.00 0.00 C ATOM 1865 C LEU A 119 20.454 32.003 44.946 1.00 0.00 C ATOM 1866 O LEU A 119 19.701 31.588 44.067 1.00 0.00 O ATOM 1867 CB LEU A 119 22.844 32.936 44.798 1.00 0.00 C ATOM 1868 CG LEU A 119 23.244 31.717 43.941 1.00 0.00 C ATOM 1869 CD1 LEU A 119 23.280 30.464 44.822 1.00 0.00 C ATOM 1870 CD2 LEU A 119 22.268 31.503 42.773 1.00 0.00 C ATOM 0 H LEU A 119 21.919 34.315 46.498 1.00 0.00 H new ATOM 0 HA LEU A 119 21.062 33.657 43.747 1.00 0.00 H new ATOM 0 HB2 LEU A 119 23.413 33.806 44.469 1.00 0.00 H new ATOM 0 HB3 LEU A 119 23.119 32.749 45.836 1.00 0.00 H new ATOM 0 HG LEU A 119 24.232 31.906 43.521 1.00 0.00 H new ATOM 0 HD11 LEU A 119 23.562 29.602 44.217 1.00 0.00 H new ATOM 0 HD12 LEU A 119 24.009 30.602 45.621 1.00 0.00 H new ATOM 0 HD13 LEU A 119 22.294 30.296 45.256 1.00 0.00 H new ATOM 0 HD21 LEU A 119 22.581 30.636 42.191 1.00 0.00 H new ATOM 0 HD22 LEU A 119 21.264 31.335 43.164 1.00 0.00 H new ATOM 0 HD23 LEU A 119 22.265 32.386 42.135 1.00 0.00 H new ATOM 1882 N PHE A 120 20.506 31.430 46.130 1.00 0.00 N ATOM 1883 CA PHE A 120 19.648 30.229 46.480 1.00 0.00 C ATOM 1884 C PHE A 120 18.164 30.536 46.103 1.00 0.00 C ATOM 1885 O PHE A 120 17.445 29.673 45.606 1.00 0.00 O ATOM 1886 CB PHE A 120 19.882 30.108 48.020 1.00 0.00 C ATOM 1887 CG PHE A 120 19.632 28.702 48.576 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.483 28.011 48.199 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.520 28.109 49.527 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.197 26.751 48.729 1.00 0.00 C ATOM 1891 CE2 PHE A 120 20.219 26.845 50.067 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.057 26.171 49.665 1.00 0.00 C ATOM 0 H PHE A 120 21.115 31.744 46.886 1.00 0.00 H new ATOM 0 HA PHE A 120 19.887 29.303 45.958 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.907 30.401 48.246 1.00 0.00 H new ATOM 0 HB3 PHE A 120 19.228 30.813 48.534 1.00 0.00 H new ATOM 0 HD1 PHE A 120 17.804 28.456 47.487 1.00 0.00 H new ATOM 0 HD2 PHE A 120 21.417 28.629 49.829 1.00 0.00 H new ATOM 0 HE1 PHE A 120 17.309 26.223 48.414 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.882 26.394 50.790 1.00 0.00 H new ATOM 0 HZ PHE A 120 18.826 25.201 50.080 1.00 0.00 H new ATOM 1902 N LYS A 121 17.718 31.762 46.298 1.00 0.00 N ATOM 1903 CA LYS A 121 16.310 32.170 45.924 1.00 0.00 C ATOM 1904 C LYS A 121 16.210 32.381 44.401 1.00 0.00 C ATOM 1905 O LYS A 121 15.206 32.059 43.774 1.00 0.00 O ATOM 1906 CB LYS A 121 16.108 33.510 46.640 1.00 0.00 C ATOM 1907 CG LYS A 121 14.779 34.153 46.218 1.00 0.00 C ATOM 1908 CD LYS A 121 15.009 35.631 45.888 1.00 0.00 C ATOM 1909 CE LYS A 121 15.544 35.765 44.459 1.00 0.00 C ATOM 1910 NZ LYS A 121 14.359 36.126 43.634 1.00 0.00 N ATOM 0 H LYS A 121 18.277 32.511 46.707 1.00 0.00 H new ATOM 0 HA LYS A 121 15.568 31.421 46.201 1.00 0.00 H new ATOM 0 HB2 LYS A 121 16.118 33.357 47.719 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.934 34.182 46.406 1.00 0.00 H new ATOM 0 HG2 LYS A 121 14.371 33.635 45.350 1.00 0.00 H new ATOM 0 HG3 LYS A 121 14.046 34.058 47.019 1.00 0.00 H new ATOM 0 HD2 LYS A 121 14.076 36.186 45.991 1.00 0.00 H new ATOM 0 HD3 LYS A 121 15.717 36.065 46.594 1.00 0.00 H new ATOM 0 HE2 LYS A 121 16.316 36.532 44.397 1.00 0.00 H new ATOM 0 HE3 LYS A 121 15.993 34.833 44.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 14.648 36.235 42.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 13.644 35.374 43.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 13.956 37.021 43.978 1.00 0.00 H new ATOM 1924 N ALA A 122 17.250 32.911 43.803 1.00 0.00 N ATOM 1925 CA ALA A 122 17.249 33.139 42.325 1.00 0.00 C ATOM 1926 C ALA A 122 17.086 31.793 41.621 1.00 0.00 C ATOM 1927 O ALA A 122 16.192 31.601 40.799 1.00 0.00 O ATOM 1928 CB ALA A 122 18.613 33.752 42.010 1.00 0.00 C ATOM 0 H ALA A 122 18.105 33.197 44.280 1.00 0.00 H new ATOM 0 HA ALA A 122 16.440 33.790 41.994 1.00 0.00 H new ATOM 0 HB1 ALA A 122 18.686 33.947 40.940 1.00 0.00 H new ATOM 0 HB2 ALA A 122 18.727 34.687 42.558 1.00 0.00 H new ATOM 0 HB3 ALA A 122 19.401 33.059 42.307 1.00 0.00 H new ATOM 1934 N THR A 123 17.940 30.857 41.936 1.00 0.00 N ATOM 1935 CA THR A 123 17.841 29.505 41.290 1.00 0.00 C ATOM 1936 C THR A 123 16.566 28.771 41.776 1.00 0.00 C ATOM 1937 O THR A 123 15.671 28.484 40.985 1.00 0.00 O ATOM 1938 CB THR A 123 19.098 28.758 41.742 1.00 0.00 C ATOM 1939 OG1 THR A 123 20.232 29.598 41.578 1.00 0.00 O ATOM 1940 CG2 THR A 123 19.271 27.492 40.902 1.00 0.00 C ATOM 0 H THR A 123 18.700 30.963 42.608 1.00 0.00 H new ATOM 0 HA THR A 123 17.774 29.569 40.204 1.00 0.00 H new ATOM 0 HB THR A 123 19.000 28.483 42.792 1.00 0.00 H new ATOM 0 HG1 THR A 123 21.037 29.121 41.869 1.00 0.00 H new ATOM 0 HG21 THR A 123 20.166 26.961 41.225 1.00 0.00 H new ATOM 0 HG22 THR A 123 18.401 26.848 41.031 1.00 0.00 H new ATOM 0 HG23 THR A 123 19.369 27.763 39.851 1.00 0.00 H new ATOM 1948 N THR A 124 16.433 28.523 43.062 1.00 0.00 N ATOM 1949 CA THR A 124 15.174 27.878 43.601 1.00 0.00 C ATOM 1950 C THR A 124 13.967 28.671 43.093 1.00 0.00 C ATOM 1951 O THR A 124 12.892 28.130 42.844 1.00 0.00 O ATOM 1952 CB THR A 124 15.294 27.918 45.133 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.581 26.819 45.676 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.715 29.222 45.689 1.00 0.00 C ATOM 0 H THR A 124 17.139 28.738 43.766 1.00 0.00 H new ATOM 0 HA THR A 124 15.045 26.847 43.273 1.00 0.00 H new ATOM 0 HB THR A 124 16.347 27.862 45.408 1.00 0.00 H new ATOM 0 HG1 THR A 124 14.195 27.074 46.540 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.810 29.229 46.775 1.00 0.00 H new ATOM 0 HG22 THR A 124 15.260 30.069 45.272 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.662 29.298 45.417 1.00 0.00 H new ATOM 1962 N GLY A 125 14.152 29.960 42.928 1.00 0.00 N ATOM 1963 CA GLY A 125 13.062 30.845 42.425 1.00 0.00 C ATOM 1964 C GLY A 125 12.513 31.834 43.475 1.00 0.00 C ATOM 1965 O GLY A 125 12.270 32.984 43.114 1.00 0.00 O ATOM 0 H GLY A 125 15.030 30.441 43.125 1.00 0.00 H new ATOM 0 HA2 GLY A 125 13.434 31.410 41.570 1.00 0.00 H new ATOM 0 HA3 GLY A 125 12.242 30.224 42.064 1.00 0.00 H new ATOM 1969 N MET A 126 12.316 31.506 44.737 1.00 0.00 N ATOM 1970 CA MET A 126 11.786 32.596 45.640 1.00 0.00 C ATOM 1971 C MET A 126 12.009 32.373 47.150 1.00 0.00 C ATOM 1972 O MET A 126 11.088 32.573 47.942 1.00 0.00 O ATOM 1973 CB MET A 126 10.280 32.621 45.359 1.00 0.00 C ATOM 1974 CG MET A 126 9.989 33.502 44.143 1.00 0.00 C ATOM 1975 SD MET A 126 8.327 34.203 44.286 1.00 0.00 S ATOM 1976 CE MET A 126 7.928 34.189 42.522 1.00 0.00 C ATOM 0 H MET A 126 12.485 30.595 45.163 1.00 0.00 H new ATOM 0 HA MET A 126 12.318 33.523 45.424 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.918 31.608 45.180 1.00 0.00 H new ATOM 0 HB3 MET A 126 9.746 33.001 46.230 1.00 0.00 H new ATOM 0 HG2 MET A 126 10.727 34.301 44.075 1.00 0.00 H new ATOM 0 HG3 MET A 126 10.070 32.915 43.228 1.00 0.00 H new ATOM 0 HE1 MET A 126 6.925 34.588 42.373 1.00 0.00 H new ATOM 0 HE2 MET A 126 8.647 34.804 41.981 1.00 0.00 H new ATOM 0 HE3 MET A 126 7.971 33.166 42.147 1.00 0.00 H new ATOM 1986 N THR A 127 13.198 32.042 47.590 1.00 0.00 N ATOM 1987 CA THR A 127 13.433 31.894 49.057 1.00 0.00 C ATOM 1988 C THR A 127 14.934 31.731 49.347 1.00 0.00 C ATOM 1989 O THR A 127 15.442 30.618 49.323 1.00 0.00 O ATOM 1990 CB THR A 127 12.686 30.633 49.478 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.491 30.477 48.726 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.331 30.777 50.943 1.00 0.00 C ATOM 0 H THR A 127 14.011 31.869 46.999 1.00 0.00 H new ATOM 0 HA THR A 127 13.087 32.772 49.602 1.00 0.00 H new ATOM 0 HB THR A 127 13.315 29.760 49.304 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.949 31.290 48.800 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.794 29.889 51.276 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.243 30.891 51.529 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.700 31.655 51.080 1.00 0.00 H new ATOM 2000 N PRO A 128 15.619 32.815 49.616 1.00 0.00 N ATOM 2001 CA PRO A 128 17.081 32.703 49.889 1.00 0.00 C ATOM 2002 C PRO A 128 17.413 31.939 51.184 1.00 0.00 C ATOM 2003 O PRO A 128 17.290 30.717 51.243 1.00 0.00 O ATOM 2004 CB PRO A 128 17.506 34.177 49.968 1.00 0.00 C ATOM 2005 CG PRO A 128 16.268 34.914 50.363 1.00 0.00 C ATOM 2006 CD PRO A 128 15.126 34.193 49.708 1.00 0.00 C ATOM 0 HA PRO A 128 17.605 32.125 49.128 1.00 0.00 H new ATOM 0 HB2 PRO A 128 18.301 34.320 50.700 1.00 0.00 H new ATOM 0 HB3 PRO A 128 17.887 34.530 49.010 1.00 0.00 H new ATOM 0 HG2 PRO A 128 16.151 34.926 51.447 1.00 0.00 H new ATOM 0 HG3 PRO A 128 16.312 35.953 50.036 1.00 0.00 H new ATOM 0 HD2 PRO A 128 14.214 34.257 50.301 1.00 0.00 H new ATOM 0 HD3 PRO A 128 14.897 34.607 48.726 1.00 0.00 H new ATOM 2014 N LYS A 129 17.865 32.623 52.214 1.00 0.00 N ATOM 2015 CA LYS A 129 18.238 31.920 53.477 1.00 0.00 C ATOM 2016 C LYS A 129 17.035 31.175 54.061 1.00 0.00 C ATOM 2017 O LYS A 129 17.188 30.215 54.815 1.00 0.00 O ATOM 2018 CB LYS A 129 18.736 33.015 54.428 1.00 0.00 C ATOM 2019 CG LYS A 129 18.852 32.469 55.859 1.00 0.00 C ATOM 2020 CD LYS A 129 19.785 31.254 55.881 1.00 0.00 C ATOM 2021 CE LYS A 129 21.214 31.698 55.564 1.00 0.00 C ATOM 2022 NZ LYS A 129 22.079 30.609 56.096 1.00 0.00 N ATOM 0 H LYS A 129 17.989 33.635 52.229 1.00 0.00 H new ATOM 0 HA LYS A 129 19.006 31.165 53.309 1.00 0.00 H new ATOM 0 HB2 LYS A 129 19.706 33.383 54.093 1.00 0.00 H new ATOM 0 HB3 LYS A 129 18.050 33.862 54.409 1.00 0.00 H new ATOM 0 HG2 LYS A 129 19.235 33.244 56.523 1.00 0.00 H new ATOM 0 HG3 LYS A 129 17.867 32.188 56.231 1.00 0.00 H new ATOM 0 HD2 LYS A 129 19.751 30.775 56.859 1.00 0.00 H new ATOM 0 HD3 LYS A 129 19.453 30.515 55.152 1.00 0.00 H new ATOM 0 HE2 LYS A 129 21.358 31.829 54.492 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.445 32.653 56.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 23.046 30.724 55.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 22.094 30.654 57.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 21.702 29.688 55.795 1.00 0.00 H new ATOM 2036 N ALA A 130 15.848 31.587 53.724 1.00 0.00 N ATOM 2037 CA ALA A 130 14.643 30.884 54.266 1.00 0.00 C ATOM 2038 C ALA A 130 14.555 29.479 53.649 1.00 0.00 C ATOM 2039 O ALA A 130 14.257 28.509 54.344 1.00 0.00 O ATOM 2040 CB ALA A 130 13.450 31.738 53.836 1.00 0.00 C ATOM 0 H ALA A 130 15.655 32.372 53.103 1.00 0.00 H new ATOM 0 HA ALA A 130 14.677 30.766 55.349 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.528 31.284 54.199 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.550 32.740 54.254 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.420 31.800 52.748 1.00 0.00 H new ATOM 2046 N TRP A 131 14.856 29.329 52.370 1.00 0.00 N ATOM 2047 CA TRP A 131 14.827 27.958 51.779 1.00 0.00 C ATOM 2048 C TRP A 131 15.904 27.120 52.441 1.00 0.00 C ATOM 2049 O TRP A 131 15.713 25.934 52.707 1.00 0.00 O ATOM 2050 CB TRP A 131 15.143 28.119 50.298 1.00 0.00 C ATOM 2051 CG TRP A 131 14.081 27.478 49.467 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.322 26.813 48.317 1.00 0.00 C ATOM 2053 CD2 TRP A 131 12.640 27.405 49.690 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.122 26.354 47.805 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.058 26.689 48.617 1.00 0.00 C ATOM 2056 CE3 TRP A 131 11.789 27.886 50.703 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 10.683 26.460 48.550 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.405 27.656 50.639 1.00 0.00 C ATOM 2059 CH2 TRP A 131 9.854 26.945 49.566 1.00 0.00 C ATOM 0 H TRP A 131 15.113 30.082 51.731 1.00 0.00 H new ATOM 0 HA TRP A 131 13.862 27.472 51.923 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.219 29.177 50.049 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.110 27.668 50.075 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.294 26.664 47.870 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.034 25.832 46.933 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.203 28.436 51.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 10.262 25.912 47.720 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 9.762 28.030 51.422 1.00 0.00 H new ATOM 0 HH2 TRP A 131 8.789 26.771 49.523 1.00 0.00 H new ATOM 2070 N GLN A 132 17.032 27.707 52.729 1.00 0.00 N ATOM 2071 CA GLN A 132 18.115 26.931 53.395 1.00 0.00 C ATOM 2072 C GLN A 132 17.624 26.453 54.767 1.00 0.00 C ATOM 2073 O GLN A 132 17.792 25.295 55.143 1.00 0.00 O ATOM 2074 CB GLN A 132 19.276 27.915 53.546 1.00 0.00 C ATOM 2075 CG GLN A 132 20.603 27.156 53.493 1.00 0.00 C ATOM 2076 CD GLN A 132 21.678 28.057 52.884 1.00 0.00 C ATOM 2077 OE1 GLN A 132 21.734 29.250 53.173 1.00 0.00 O ATOM 2078 NE2 GLN A 132 22.545 27.548 52.051 1.00 0.00 N ATOM 0 H GLN A 132 17.250 28.684 52.534 1.00 0.00 H new ATOM 0 HA GLN A 132 18.413 26.048 52.829 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.240 28.660 52.751 1.00 0.00 H new ATOM 0 HB3 GLN A 132 19.190 28.452 54.491 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.898 26.846 54.495 1.00 0.00 H new ATOM 0 HG3 GLN A 132 20.493 26.249 52.898 1.00 0.00 H new ATOM 0 HE21 GLN A 132 22.500 26.558 51.810 1.00 0.00 H new ATOM 0 HE22 GLN A 132 23.267 28.140 51.641 1.00 0.00 H new ATOM 2087 N GLN A 133 17.009 27.331 55.515 1.00 0.00 N ATOM 2088 CA GLN A 133 16.495 26.945 56.862 1.00 0.00 C ATOM 2089 C GLN A 133 15.383 25.901 56.729 1.00 0.00 C ATOM 2090 O GLN A 133 15.362 24.900 57.443 1.00 0.00 O ATOM 2091 CB GLN A 133 15.947 28.243 57.462 1.00 0.00 C ATOM 2092 CG GLN A 133 15.325 27.960 58.833 1.00 0.00 C ATOM 2093 CD GLN A 133 13.806 27.838 58.689 1.00 0.00 C ATOM 2094 OE1 GLN A 133 13.298 26.800 58.270 1.00 0.00 O ATOM 2095 NE2 GLN A 133 13.047 28.849 59.015 1.00 0.00 N ATOM 0 H GLN A 133 16.840 28.301 55.250 1.00 0.00 H new ATOM 0 HA GLN A 133 17.269 26.501 57.487 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.748 28.975 57.560 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.200 28.675 56.796 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.737 27.040 59.248 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.572 28.762 59.529 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.467 29.711 59.363 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.034 28.777 58.922 1.00 0.00 H new ATOM 2104 N ALA A 134 14.453 26.113 55.833 1.00 0.00 N ATOM 2105 CA ALA A 134 13.341 25.129 55.666 1.00 0.00 C ATOM 2106 C ALA A 134 13.902 23.752 55.327 1.00 0.00 C ATOM 2107 O ALA A 134 13.691 22.786 56.056 1.00 0.00 O ATOM 2108 CB ALA A 134 12.491 25.671 54.515 1.00 0.00 C ATOM 0 H ALA A 134 14.415 26.921 55.212 1.00 0.00 H new ATOM 0 HA ALA A 134 12.754 25.013 56.577 1.00 0.00 H new ATOM 0 HB1 ALA A 134 11.652 24.999 54.334 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.114 26.660 54.776 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.101 25.741 53.614 1.00 0.00 H new ATOM 2114 N TRP A 135 14.629 23.649 54.248 1.00 0.00 N ATOM 2115 CA TRP A 135 15.231 22.330 53.875 1.00 0.00 C ATOM 2116 C TRP A 135 15.890 21.701 55.102 1.00 0.00 C ATOM 2117 O TRP A 135 15.671 20.536 55.431 1.00 0.00 O ATOM 2118 CB TRP A 135 16.298 22.688 52.871 1.00 0.00 C ATOM 2119 CG TRP A 135 15.703 23.146 51.592 1.00 0.00 C ATOM 2120 CD1 TRP A 135 16.427 23.708 50.621 1.00 0.00 C ATOM 2121 CD2 TRP A 135 14.324 23.088 51.108 1.00 0.00 C ATOM 2122 NE1 TRP A 135 15.601 24.009 49.554 1.00 0.00 N ATOM 2123 CE2 TRP A 135 14.292 23.643 49.805 1.00 0.00 C ATOM 2124 CE3 TRP A 135 13.114 22.617 51.656 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 13.107 23.725 49.074 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 11.920 22.701 50.920 1.00 0.00 C ATOM 2127 CH2 TRP A 135 11.917 23.253 49.633 1.00 0.00 C ATOM 0 H TRP A 135 14.834 24.417 53.608 1.00 0.00 H new ATOM 0 HA TRP A 135 14.495 21.624 53.489 1.00 0.00 H new ATOM 0 HB2 TRP A 135 16.936 23.472 53.279 1.00 0.00 H new ATOM 0 HB3 TRP A 135 16.934 21.822 52.689 1.00 0.00 H new ATOM 0 HD1 TRP A 135 17.489 23.897 50.663 1.00 0.00 H new ATOM 0 HE1 TRP A 135 15.918 24.447 48.689 1.00 0.00 H new ATOM 0 HE3 TRP A 135 13.104 22.189 52.648 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 13.109 24.151 48.082 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 10.998 22.337 51.350 1.00 0.00 H new ATOM 0 HH2 TRP A 135 10.995 23.314 49.073 1.00 0.00 H new ATOM 2138 N ARG A 136 16.686 22.467 55.783 1.00 0.00 N ATOM 2139 CA ARG A 136 17.378 21.953 57.010 1.00 0.00 C ATOM 2140 C ARG A 136 16.345 21.515 58.070 1.00 0.00 C ATOM 2141 O ARG A 136 16.570 20.574 58.828 1.00 0.00 O ATOM 2142 CB ARG A 136 18.206 23.149 57.506 1.00 0.00 C ATOM 2143 CG ARG A 136 18.472 23.033 59.011 1.00 0.00 C ATOM 2144 CD ARG A 136 19.378 24.181 59.464 1.00 0.00 C ATOM 2145 NE ARG A 136 18.502 25.070 60.280 1.00 0.00 N ATOM 2146 CZ ARG A 136 19.021 26.003 61.039 1.00 0.00 C ATOM 2147 NH1 ARG A 136 20.318 26.174 61.094 1.00 0.00 N ATOM 2148 NH2 ARG A 136 18.238 26.770 61.747 1.00 0.00 N ATOM 0 H ARG A 136 16.895 23.437 55.547 1.00 0.00 H new ATOM 0 HA ARG A 136 17.997 21.078 56.810 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.152 23.192 56.966 1.00 0.00 H new ATOM 0 HB3 ARG A 136 17.676 24.078 57.295 1.00 0.00 H new ATOM 0 HG2 ARG A 136 17.531 23.061 59.560 1.00 0.00 H new ATOM 0 HG3 ARG A 136 18.943 22.075 59.234 1.00 0.00 H new ATOM 0 HD2 ARG A 136 20.219 23.811 60.050 1.00 0.00 H new ATOM 0 HD3 ARG A 136 19.795 24.715 58.610 1.00 0.00 H new ATOM 0 HE ARG A 136 17.490 24.951 60.247 1.00 0.00 H new ATOM 0 HH11 ARG A 136 20.935 25.578 60.542 1.00 0.00 H new ATOM 0 HH12 ARG A 136 20.711 26.904 61.688 1.00 0.00 H new ATOM 0 HH21 ARG A 136 17.227 26.642 61.708 1.00 0.00 H new ATOM 0 HH22 ARG A 136 18.637 27.498 62.340 1.00 0.00 H new ATOM 2162 N ALA A 137 15.227 22.192 58.139 1.00 0.00 N ATOM 2163 CA ALA A 137 14.182 21.834 59.151 1.00 0.00 C ATOM 2164 C ALA A 137 13.483 20.531 58.760 1.00 0.00 C ATOM 2165 O ALA A 137 13.017 19.774 59.610 1.00 0.00 O ATOM 2166 CB ALA A 137 13.192 22.999 59.125 1.00 0.00 C ATOM 0 H ALA A 137 14.990 22.980 57.537 1.00 0.00 H new ATOM 0 HA ALA A 137 14.607 21.678 60.142 1.00 0.00 H new ATOM 0 HB1 ALA A 137 12.392 22.813 59.842 1.00 0.00 H new ATOM 0 HB2 ALA A 137 13.709 23.922 59.389 1.00 0.00 H new ATOM 0 HB3 ALA A 137 12.768 23.094 58.125 1.00 0.00 H new ATOM 2172 N ARG A 138 13.428 20.247 57.490 1.00 0.00 N ATOM 2173 CA ARG A 138 12.794 18.983 57.030 1.00 0.00 C ATOM 2174 C ARG A 138 13.843 17.886 57.070 1.00 0.00 C ATOM 2175 O ARG A 138 13.517 16.701 57.107 1.00 0.00 O ATOM 2176 CB ARG A 138 12.365 19.259 55.587 1.00 0.00 C ATOM 2177 CG ARG A 138 11.708 18.009 54.996 1.00 0.00 C ATOM 2178 CD ARG A 138 11.961 17.968 53.486 1.00 0.00 C ATOM 2179 NE ARG A 138 13.295 17.312 53.344 1.00 0.00 N ATOM 2180 CZ ARG A 138 13.819 17.105 52.161 1.00 0.00 C ATOM 2181 NH1 ARG A 138 13.186 17.468 51.074 1.00 0.00 N ATOM 2182 NH2 ARG A 138 14.988 16.529 52.066 1.00 0.00 N ATOM 0 H ARG A 138 13.797 20.840 56.747 1.00 0.00 H new ATOM 0 HA ARG A 138 11.948 18.672 57.643 1.00 0.00 H new ATOM 0 HB2 ARG A 138 11.668 20.096 55.559 1.00 0.00 H new ATOM 0 HB3 ARG A 138 13.230 19.544 54.988 1.00 0.00 H new ATOM 0 HG2 ARG A 138 12.113 17.114 55.468 1.00 0.00 H new ATOM 0 HG3 ARG A 138 10.637 18.018 55.196 1.00 0.00 H new ATOM 0 HD2 ARG A 138 11.185 17.403 52.969 1.00 0.00 H new ATOM 0 HD3 ARG A 138 11.965 18.970 53.058 1.00 0.00 H new ATOM 0 HE ARG A 138 13.805 17.021 54.178 1.00 0.00 H new ATOM 0 HH11 ARG A 138 12.273 17.918 51.142 1.00 0.00 H new ATOM 0 HH12 ARG A 138 13.606 17.301 50.160 1.00 0.00 H new ATOM 0 HH21 ARG A 138 15.486 16.244 52.909 1.00 0.00 H new ATOM 0 HH22 ARG A 138 15.402 16.364 51.149 1.00 0.00 H new ATOM 2196 N ARG A 139 15.101 18.240 57.083 1.00 0.00 N ATOM 2197 CA ARG A 139 16.157 17.189 57.146 1.00 0.00 C ATOM 2198 C ARG A 139 16.354 16.741 58.600 1.00 0.00 C ATOM 2199 O ARG A 139 16.203 17.570 59.481 1.00 0.00 O ATOM 2200 CB ARG A 139 17.423 17.854 56.592 1.00 0.00 C ATOM 2201 CG ARG A 139 18.665 17.160 57.158 1.00 0.00 C ATOM 2202 CD ARG A 139 19.804 17.242 56.142 1.00 0.00 C ATOM 2203 NE ARG A 139 19.783 15.920 55.450 1.00 0.00 N ATOM 2204 CZ ARG A 139 20.169 14.833 56.074 1.00 0.00 C ATOM 2205 NH1 ARG A 139 20.583 14.885 57.314 1.00 0.00 N ATOM 2206 NH2 ARG A 139 20.143 13.687 55.450 1.00 0.00 N ATOM 2207 OXT ARG A 139 16.652 15.575 58.803 1.00 0.00 O ATOM 0 H ARG A 139 15.440 19.202 57.053 1.00 0.00 H new ATOM 0 HA ARG A 139 15.898 16.298 56.573 1.00 0.00 H new ATOM 0 HB2 ARG A 139 17.428 17.797 55.504 1.00 0.00 H new ATOM 0 HB3 ARG A 139 17.434 18.912 56.856 1.00 0.00 H new ATOM 0 HG2 ARG A 139 18.964 17.633 58.094 1.00 0.00 H new ATOM 0 HG3 ARG A 139 18.440 16.118 57.385 1.00 0.00 H new ATOM 0 HD2 ARG A 139 19.651 18.061 55.439 1.00 0.00 H new ATOM 0 HD3 ARG A 139 20.761 17.418 56.632 1.00 0.00 H new ATOM 0 HE ARG A 139 19.465 15.861 54.482 1.00 0.00 H new ATOM 0 HH11 ARG A 139 20.608 15.778 57.806 1.00 0.00 H new ATOM 0 HH12 ARG A 139 20.881 14.033 57.788 1.00 0.00 H new ATOM 0 HH21 ARG A 139 19.824 13.640 54.482 1.00 0.00 H new ATOM 0 HH22 ARG A 139 20.442 12.838 55.930 1.00 0.00 H new