USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=26 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 111 MET CE :methyl -145:sc= -0.219 (180deg=-1.06) USER MOD Set 1.2: A 115 HIS :FLIP no HD1:sc= -0.293 F(o=-1.9,f=-0.51) USER MOD Set 2.1: A 91 CYS SG : rot 81:sc= -7.37! USER MOD Set 2.2: A 132 GLN :FLIP amide:sc= -8.18! C(o=-17!,f=-16!) USER MOD Set 3.1: A 42 CYS SG : rot 72:sc= 0.572 USER MOD Set 3.2: A 69 CYS SG : rot -135:sc= 0.625 USER MOD Set 3.3: A 72 CYS SG : rot -20:sc= -1.59 USER MOD Set 4.1: A 53 SER OG : rot 180:sc= -0.381 USER MOD Set 4.2: A 55 TYR OH : rot 30:sc=-0.00821 USER MOD Single : A 8 THR OG1 : rot 34:sc= 0.0454 USER MOD Single : A 11 GLN : amide:sc= -0.204 K(o=-0.2,f=-1.5!) USER MOD Single : A 14 GLN : amide:sc= -0.469 X(o=-0.47,f=0) USER MOD Single : A 15 SER OG : rot 150:sc= -0.606 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.592 F(o=-2.1!,f=-0.59) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -36:sc= 0.52 USER MOD Single : A 41 SER OG : rot 180:sc=-0.00439 USER MOD Single : A 46 HIS :FLIP no HE2:sc= -3.09 F(o=-5.6!,f=-3.1) USER MOD Single : A 51 ASN : amide:sc= -2.55 X(o=-2.5,f=-2.3) USER MOD Single : A 57 ASN : amide:sc= -4.06! C(o=-4.1!,f=-18!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -0.104 X(o=-0.1,f=-0.021) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -13.8! C(o=-14!,f=-15!) USER MOD Single : A 81 GLN : amide:sc= -0.208 X(o=-0.21,f=-0.37) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0778 USER MOD Single : A 89 HIS : no HD1:sc= -0.0149 X(o=-0.015,f=-0.21) 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 -100:sc= -2.26! USER MOD Single : A 108 GLN : amide:sc= -0.468 K(o=-0.47,f=-2.9!) USER MOD Single : A 112 SER OG : rot 180:sc= 0.113 USER MOD Single : A 117 HIS : no HE2:sc= -9.3! C(o=-9.3!,f=-18!) USER MOD Single : A 121 LYS NZ :NH3+ -143:sc= -0.793 (180deg=-3.19!) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.136 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot -54:sc= -0.538! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= -0.318 X(o=-0.32,f=-0.028) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 8.165 14.561 19.773 1.00 0.00 N ATOM 119 CA THR A 8 7.142 15.334 19.086 1.00 0.00 C ATOM 120 C THR A 8 7.567 16.790 19.153 1.00 0.00 C ATOM 121 O THR A 8 6.929 17.627 19.793 1.00 0.00 O ATOM 122 CB THR A 8 5.870 15.066 19.900 1.00 0.00 C ATOM 123 OG1 THR A 8 5.454 13.721 19.693 1.00 0.00 O ATOM 124 CG2 THR A 8 4.747 16.015 19.494 1.00 0.00 C ATOM 0 HA THR A 8 6.988 15.081 18.037 1.00 0.00 H new ATOM 0 HB THR A 8 6.093 15.232 20.954 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.241 13.151 19.568 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.858 15.802 20.088 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.060 17.045 19.667 1.00 0.00 H new ATOM 0 HG23 THR A 8 4.519 15.878 18.437 1.00 0.00 H new ATOM 132 N ASP A 9 8.669 17.085 18.517 1.00 0.00 N ATOM 133 CA ASP A 9 9.206 18.483 18.525 1.00 0.00 C ATOM 134 C ASP A 9 8.058 19.491 18.410 1.00 0.00 C ATOM 135 O ASP A 9 8.137 20.602 18.927 1.00 0.00 O ATOM 136 CB ASP A 9 10.124 18.589 17.303 1.00 0.00 C ATOM 137 CG ASP A 9 9.399 18.076 16.057 1.00 0.00 C ATOM 138 OD1 ASP A 9 9.354 16.869 15.877 1.00 0.00 O ATOM 139 OD2 ASP A 9 8.902 18.897 15.304 1.00 0.00 O ATOM 0 H ASP A 9 9.226 16.415 17.988 1.00 0.00 H new ATOM 0 HA ASP A 9 9.741 18.700 19.449 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.429 19.625 17.156 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.033 18.010 17.469 1.00 0.00 H new ATOM 144 N ASP A 10 6.975 19.111 17.780 1.00 0.00 N ATOM 145 CA ASP A 10 5.818 20.012 17.680 1.00 0.00 C ATOM 146 C ASP A 10 5.457 20.506 19.076 1.00 0.00 C ATOM 147 O ASP A 10 5.325 21.710 19.319 1.00 0.00 O ATOM 148 CB ASP A 10 4.728 19.119 17.105 1.00 0.00 C ATOM 149 CG ASP A 10 4.907 18.992 15.591 1.00 0.00 C ATOM 150 OD1 ASP A 10 5.985 18.605 15.171 1.00 0.00 O ATOM 151 OD2 ASP A 10 3.960 19.284 14.878 1.00 0.00 O ATOM 0 H ASP A 10 6.855 18.203 17.331 1.00 0.00 H new ATOM 0 HA ASP A 10 5.986 20.898 17.067 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.770 18.134 17.569 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.747 19.536 17.331 1.00 0.00 H new ATOM 156 N GLN A 11 5.344 19.616 20.027 1.00 0.00 N ATOM 157 CA GLN A 11 5.045 20.112 21.385 1.00 0.00 C ATOM 158 C GLN A 11 6.322 20.648 21.997 1.00 0.00 C ATOM 159 O GLN A 11 6.279 21.581 22.786 1.00 0.00 O ATOM 160 CB GLN A 11 4.495 18.977 22.226 1.00 0.00 C ATOM 161 CG GLN A 11 4.156 19.572 23.597 1.00 0.00 C ATOM 162 CD GLN A 11 2.638 19.694 23.758 1.00 0.00 C ATOM 163 OE1 GLN A 11 1.902 19.702 22.773 1.00 0.00 O ATOM 164 NE2 GLN A 11 2.126 19.796 24.955 1.00 0.00 N ATOM 0 H GLN A 11 5.443 18.606 19.922 1.00 0.00 H new ATOM 0 HA GLN A 11 4.301 20.908 21.342 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.609 18.545 21.761 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.228 18.176 22.322 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.564 18.941 24.387 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.620 20.553 23.701 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.736 19.789 25.773 1.00 0.00 H new ATOM 0 HE22 GLN A 11 1.116 19.882 25.072 1.00 0.00 H new ATOM 173 N ARG A 12 7.474 20.123 21.638 1.00 0.00 N ATOM 174 CA ARG A 12 8.708 20.707 22.204 1.00 0.00 C ATOM 175 C ARG A 12 8.601 22.195 21.963 1.00 0.00 C ATOM 176 O ARG A 12 8.873 23.014 22.837 1.00 0.00 O ATOM 177 CB ARG A 12 9.856 20.134 21.392 1.00 0.00 C ATOM 178 CG ARG A 12 10.224 18.709 21.855 1.00 0.00 C ATOM 179 CD ARG A 12 8.991 17.909 22.303 1.00 0.00 C ATOM 180 NE ARG A 12 9.543 16.795 23.129 1.00 0.00 N ATOM 181 CZ ARG A 12 8.799 16.196 24.029 1.00 0.00 C ATOM 182 NH1 ARG A 12 7.556 16.560 24.224 1.00 0.00 N ATOM 183 NH2 ARG A 12 9.303 15.225 24.741 1.00 0.00 N ATOM 0 H ARG A 12 7.600 19.340 20.997 1.00 0.00 H new ATOM 0 HA ARG A 12 8.855 20.498 23.264 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.582 20.115 20.337 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.727 20.783 21.484 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.722 18.181 21.041 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.936 18.769 22.679 1.00 0.00 H new ATOM 0 HD2 ARG A 12 8.305 18.529 22.881 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.433 17.529 21.447 1.00 0.00 H new ATOM 0 HE ARG A 12 10.509 16.496 22.993 1.00 0.00 H new ATOM 0 HH11 ARG A 12 7.154 17.318 23.673 1.00 0.00 H new ATOM 0 HH12 ARG A 12 6.990 16.085 24.927 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.270 14.936 24.596 1.00 0.00 H new ATOM 0 HH22 ARG A 12 8.730 14.756 25.442 1.00 0.00 H new ATOM 197 N TRP A 13 8.138 22.549 20.784 1.00 0.00 N ATOM 198 CA TRP A 13 7.946 23.973 20.483 1.00 0.00 C ATOM 199 C TRP A 13 6.915 24.517 21.450 1.00 0.00 C ATOM 200 O TRP A 13 7.070 25.600 22.006 1.00 0.00 O ATOM 201 CB TRP A 13 7.396 24.057 19.063 1.00 0.00 C ATOM 202 CG TRP A 13 7.268 25.504 18.720 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.159 26.109 18.242 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.268 26.543 18.874 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.420 27.460 18.088 1.00 0.00 N ATOM 206 CE2 TRP A 13 7.710 27.775 18.467 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.596 26.531 19.322 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.445 28.959 18.509 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.342 27.716 19.364 1.00 0.00 C ATOM 210 CH2 TRP A 13 9.771 28.931 18.963 1.00 0.00 C ATOM 0 H TRP A 13 7.891 21.904 20.033 1.00 0.00 H new ATOM 0 HA TRP A 13 8.873 24.539 20.572 1.00 0.00 H new ATOM 0 HB2 TRP A 13 8.063 23.554 18.363 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.429 23.559 18.996 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.223 25.620 18.017 1.00 0.00 H new ATOM 0 HE1 TRP A 13 5.743 28.138 17.738 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.047 25.602 19.637 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 7.997 29.890 18.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.365 27.693 19.708 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.350 29.842 19.003 1.00 0.00 H new ATOM 221 N GLN A 14 5.881 23.753 21.710 1.00 0.00 N ATOM 222 CA GLN A 14 4.878 24.232 22.694 1.00 0.00 C ATOM 223 C GLN A 14 5.606 24.408 24.032 1.00 0.00 C ATOM 224 O GLN A 14 5.285 25.283 24.828 1.00 0.00 O ATOM 225 CB GLN A 14 3.806 23.135 22.755 1.00 0.00 C ATOM 226 CG GLN A 14 2.840 23.414 23.910 1.00 0.00 C ATOM 227 CD GLN A 14 1.546 24.013 23.357 1.00 0.00 C ATOM 228 OE1 GLN A 14 0.457 23.513 23.630 1.00 0.00 O ATOM 229 NE2 GLN A 14 1.607 25.064 22.587 1.00 0.00 N ATOM 0 H GLN A 14 5.696 22.841 21.292 1.00 0.00 H new ATOM 0 HA GLN A 14 4.412 25.183 22.437 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.259 23.096 21.813 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.277 22.161 22.890 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.625 22.492 24.450 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.296 24.101 24.622 1.00 0.00 H new ATOM 0 HE21 GLN A 14 2.511 25.479 22.361 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.751 25.471 22.211 1.00 0.00 H new ATOM 238 N SER A 15 6.626 23.616 24.252 1.00 0.00 N ATOM 239 CA SER A 15 7.439 23.743 25.487 1.00 0.00 C ATOM 240 C SER A 15 8.323 24.973 25.352 1.00 0.00 C ATOM 241 O SER A 15 8.669 25.640 26.329 1.00 0.00 O ATOM 242 CB SER A 15 8.289 22.472 25.542 1.00 0.00 C ATOM 243 OG SER A 15 7.959 21.737 26.714 1.00 0.00 O ATOM 0 H SER A 15 6.929 22.879 23.616 1.00 0.00 H new ATOM 0 HA SER A 15 6.838 23.853 26.390 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.112 21.863 24.655 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.348 22.729 25.546 1.00 0.00 H new ATOM 0 HG SER A 15 8.091 20.780 26.548 1.00 0.00 H new ATOM 249 N VAL A 16 8.692 25.278 24.143 1.00 0.00 N ATOM 250 CA VAL A 16 9.565 26.447 23.902 1.00 0.00 C ATOM 251 C VAL A 16 8.803 27.735 24.032 1.00 0.00 C ATOM 252 O VAL A 16 9.342 28.784 24.379 1.00 0.00 O ATOM 253 CB VAL A 16 10.079 26.290 22.477 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.086 27.386 22.196 1.00 0.00 C ATOM 255 CG2 VAL A 16 10.756 24.936 22.307 1.00 0.00 C ATOM 0 H VAL A 16 8.422 24.761 23.306 1.00 0.00 H new ATOM 0 HA VAL A 16 10.374 26.485 24.632 1.00 0.00 H new ATOM 0 HB VAL A 16 9.241 26.358 21.783 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.461 27.283 21.178 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.607 28.358 22.310 1.00 0.00 H new ATOM 0 HG13 VAL A 16 11.916 27.306 22.898 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.119 24.837 21.284 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.595 24.859 22.999 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.039 24.142 22.517 1.00 0.00 H new ATOM 265 N LEU A 17 7.576 27.671 23.744 1.00 0.00 N ATOM 266 CA LEU A 17 6.737 28.861 23.823 1.00 0.00 C ATOM 267 C LEU A 17 6.079 28.899 25.191 1.00 0.00 C ATOM 268 O LEU A 17 5.836 29.955 25.772 1.00 0.00 O ATOM 269 CB LEU A 17 5.735 28.622 22.718 1.00 0.00 C ATOM 270 CG LEU A 17 6.442 28.407 21.363 1.00 0.00 C ATOM 271 CD1 LEU A 17 5.619 29.060 20.270 1.00 0.00 C ATOM 272 CD2 LEU A 17 7.855 29.020 21.337 1.00 0.00 C ATOM 0 H LEU A 17 7.094 26.823 23.447 1.00 0.00 H new ATOM 0 HA LEU A 17 7.259 29.811 23.708 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.127 27.749 22.957 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.057 29.473 22.647 1.00 0.00 H new ATOM 0 HG LEU A 17 6.535 27.332 21.207 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.110 28.914 19.308 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.627 28.609 20.243 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.527 30.127 20.472 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.311 28.842 20.363 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.789 30.093 21.517 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.466 28.559 22.113 1.00 0.00 H new ATOM 284 N ALA A 18 5.821 27.744 25.714 1.00 0.00 N ATOM 285 CA ALA A 18 5.208 27.645 27.069 1.00 0.00 C ATOM 286 C ALA A 18 6.275 27.910 28.132 1.00 0.00 C ATOM 287 O ALA A 18 5.961 28.160 29.287 1.00 0.00 O ATOM 288 CB ALA A 18 4.696 26.211 27.196 1.00 0.00 C ATOM 0 H ALA A 18 6.008 26.850 25.261 1.00 0.00 H new ATOM 0 HA ALA A 18 4.405 28.370 27.205 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.233 26.075 28.173 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.960 26.017 26.416 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.529 25.516 27.089 1.00 0.00 H new ATOM 294 N ARG A 19 7.527 27.828 27.747 1.00 0.00 N ATOM 295 CA ARG A 19 8.667 28.043 28.692 1.00 0.00 C ATOM 296 C ARG A 19 8.713 26.920 29.713 1.00 0.00 C ATOM 297 O ARG A 19 9.024 27.118 30.885 1.00 0.00 O ATOM 298 CB ARG A 19 8.496 29.440 29.335 1.00 0.00 C ATOM 299 CG ARG A 19 7.575 29.409 30.569 1.00 0.00 C ATOM 300 CD ARG A 19 8.302 30.018 31.775 1.00 0.00 C ATOM 301 NE ARG A 19 7.676 31.360 31.968 1.00 0.00 N ATOM 302 CZ ARG A 19 7.883 32.042 33.070 1.00 0.00 C ATOM 303 NH1 ARG A 19 8.641 31.562 34.023 1.00 0.00 N ATOM 304 NH2 ARG A 19 7.326 33.212 33.216 1.00 0.00 N ATOM 0 H ARG A 19 7.812 27.615 26.791 1.00 0.00 H new ATOM 0 HA ARG A 19 9.625 28.021 28.173 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.473 29.826 29.624 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.087 30.129 28.597 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.660 29.965 30.365 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.282 28.383 30.790 1.00 0.00 H new ATOM 0 HD2 ARG A 19 8.183 29.396 32.662 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.372 30.105 31.588 1.00 0.00 H new ATOM 0 HE ARG A 19 7.082 31.750 31.236 1.00 0.00 H new ATOM 0 HH11 ARG A 19 9.079 30.647 33.914 1.00 0.00 H new ATOM 0 HH12 ARG A 19 8.794 32.103 34.874 1.00 0.00 H new ATOM 0 HH21 ARG A 19 6.734 33.591 32.477 1.00 0.00 H new ATOM 0 HH22 ARG A 19 7.482 33.748 34.070 1.00 0.00 H new ATOM 318 N ASP A 20 8.435 25.733 29.264 1.00 0.00 N ATOM 319 CA ASP A 20 8.477 24.561 30.167 1.00 0.00 C ATOM 320 C ASP A 20 9.937 24.260 30.544 1.00 0.00 C ATOM 321 O ASP A 20 10.711 23.802 29.707 1.00 0.00 O ATOM 322 CB ASP A 20 7.876 23.417 29.345 1.00 0.00 C ATOM 323 CG ASP A 20 7.628 22.203 30.242 1.00 0.00 C ATOM 324 OD1 ASP A 20 7.412 22.398 31.427 1.00 0.00 O ATOM 325 OD2 ASP A 20 7.654 21.097 29.725 1.00 0.00 O ATOM 0 H ASP A 20 8.178 25.525 28.299 1.00 0.00 H new ATOM 0 HA ASP A 20 7.931 24.717 31.098 1.00 0.00 H new ATOM 0 HB2 ASP A 20 6.940 23.739 28.888 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.551 23.148 28.533 1.00 0.00 H new ATOM 330 N PRO A 21 10.278 24.504 31.788 1.00 0.00 N ATOM 331 CA PRO A 21 11.663 24.238 32.277 1.00 0.00 C ATOM 332 C PRO A 21 11.961 22.734 32.249 1.00 0.00 C ATOM 333 O PRO A 21 12.995 22.278 32.734 1.00 0.00 O ATOM 334 CB PRO A 21 11.650 24.771 33.710 1.00 0.00 C ATOM 335 CG PRO A 21 10.213 24.732 34.110 1.00 0.00 C ATOM 336 CD PRO A 21 9.427 25.037 32.864 1.00 0.00 C ATOM 0 HA PRO A 21 12.432 24.708 31.664 1.00 0.00 H new ATOM 0 HB2 PRO A 21 12.262 24.155 34.368 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.049 25.784 33.760 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.946 23.754 34.510 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.005 25.463 34.891 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.448 24.557 32.878 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.255 26.107 32.748 1.00 0.00 H new ATOM 344 N ASN A 22 11.064 21.957 31.706 1.00 0.00 N ATOM 345 CA ASN A 22 11.245 20.500 31.650 1.00 0.00 C ATOM 346 C ASN A 22 11.726 20.111 30.269 1.00 0.00 C ATOM 347 O ASN A 22 12.177 18.993 30.029 1.00 0.00 O ATOM 348 CB ASN A 22 9.829 20.023 31.870 1.00 0.00 C ATOM 349 CG ASN A 22 9.739 18.531 31.624 1.00 0.00 C ATOM 350 OD1 ASN A 22 9.720 18.119 30.395 1.00 0.00 O flip ATOM 351 ND2 ASN A 22 9.681 17.730 32.556 1.00 0.00 N flip ATOM 0 H ASN A 22 10.194 22.292 31.291 1.00 0.00 H new ATOM 0 HA ASN A 22 11.967 20.093 32.358 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.514 20.251 32.888 1.00 0.00 H new ATOM 0 HB3 ASN A 22 9.151 20.552 31.200 1.00 0.00 H new ATOM 0 HD21 ASN A 22 9.697 18.066 33.519 1.00 0.00 H new ATOM 0 HD22 ASN A 22 9.617 16.730 32.366 1.00 0.00 H new ATOM 358 N ALA A 23 11.672 21.036 29.369 1.00 0.00 N ATOM 359 CA ALA A 23 12.165 20.750 28.006 1.00 0.00 C ATOM 360 C ALA A 23 13.541 21.373 27.832 1.00 0.00 C ATOM 361 O ALA A 23 14.222 21.178 26.823 1.00 0.00 O ATOM 362 CB ALA A 23 11.189 21.431 27.063 1.00 0.00 C ATOM 0 H ALA A 23 11.308 21.978 29.516 1.00 0.00 H new ATOM 0 HA ALA A 23 12.238 19.679 27.816 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.498 21.257 26.032 1.00 0.00 H new ATOM 0 HB2 ALA A 23 10.190 21.023 27.216 1.00 0.00 H new ATOM 0 HB3 ALA A 23 11.178 22.502 27.263 1.00 0.00 H new ATOM 368 N ASP A 24 13.960 22.113 28.814 1.00 0.00 N ATOM 369 CA ASP A 24 15.280 22.756 28.747 1.00 0.00 C ATOM 370 C ASP A 24 16.303 21.702 29.115 1.00 0.00 C ATOM 371 O ASP A 24 16.153 21.037 30.111 1.00 0.00 O ATOM 372 CB ASP A 24 15.207 23.866 29.796 1.00 0.00 C ATOM 373 CG ASP A 24 16.269 24.912 29.502 1.00 0.00 C ATOM 374 OD1 ASP A 24 16.941 24.768 28.498 1.00 0.00 O ATOM 375 OD2 ASP A 24 16.390 25.844 30.280 1.00 0.00 O ATOM 0 H ASP A 24 13.432 22.297 29.667 1.00 0.00 H new ATOM 0 HA ASP A 24 15.550 23.163 27.773 1.00 0.00 H new ATOM 0 HB2 ASP A 24 14.218 24.324 29.788 1.00 0.00 H new ATOM 0 HB3 ASP A 24 15.357 23.450 30.792 1.00 0.00 H new ATOM 380 N GLY A 25 17.301 21.493 28.314 1.00 0.00 N ATOM 381 CA GLY A 25 18.294 20.401 28.622 1.00 0.00 C ATOM 382 C GLY A 25 17.903 19.235 27.727 1.00 0.00 C ATOM 383 O GLY A 25 18.743 18.542 27.155 1.00 0.00 O ATOM 0 H GLY A 25 17.484 22.020 27.460 1.00 0.00 H new ATOM 0 HA2 GLY A 25 19.314 20.728 28.418 1.00 0.00 H new ATOM 0 HA3 GLY A 25 18.254 20.119 29.674 1.00 0.00 H new ATOM 387 N GLU A 26 16.617 19.045 27.565 1.00 0.00 N ATOM 388 CA GLU A 26 16.117 17.982 26.681 1.00 0.00 C ATOM 389 C GLU A 26 16.338 18.426 25.239 1.00 0.00 C ATOM 390 O GLU A 26 16.687 17.629 24.369 1.00 0.00 O ATOM 391 CB GLU A 26 14.622 17.870 26.987 1.00 0.00 C ATOM 392 CG GLU A 26 14.106 16.509 26.519 1.00 0.00 C ATOM 393 CD GLU A 26 13.428 16.658 25.155 1.00 0.00 C ATOM 394 OE1 GLU A 26 14.137 16.821 24.177 1.00 0.00 O ATOM 395 OE2 GLU A 26 12.209 16.602 25.112 1.00 0.00 O ATOM 0 H GLU A 26 15.892 19.598 28.022 1.00 0.00 H new ATOM 0 HA GLU A 26 16.617 17.025 26.828 1.00 0.00 H new ATOM 0 HB2 GLU A 26 14.449 17.988 28.057 1.00 0.00 H new ATOM 0 HB3 GLU A 26 14.076 18.670 26.486 1.00 0.00 H new ATOM 0 HG2 GLU A 26 14.931 15.800 26.451 1.00 0.00 H new ATOM 0 HG3 GLU A 26 13.400 16.107 27.245 1.00 0.00 H new ATOM 402 N PHE A 27 16.159 19.699 24.974 1.00 0.00 N ATOM 403 CA PHE A 27 16.381 20.206 23.595 1.00 0.00 C ATOM 404 C PHE A 27 16.537 21.711 23.589 1.00 0.00 C ATOM 405 O PHE A 27 16.266 22.407 24.566 1.00 0.00 O ATOM 406 CB PHE A 27 15.149 19.833 22.761 1.00 0.00 C ATOM 407 CG PHE A 27 13.953 20.709 23.120 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.908 22.069 22.744 1.00 0.00 C ATOM 409 CD2 PHE A 27 12.883 20.150 23.817 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.789 22.849 23.081 1.00 0.00 C ATOM 411 CE2 PHE A 27 11.762 20.933 24.150 1.00 0.00 C ATOM 412 CZ PHE A 27 11.719 22.279 23.784 1.00 0.00 C ATOM 0 H PHE A 27 15.870 20.401 25.655 1.00 0.00 H new ATOM 0 HA PHE A 27 17.291 19.766 23.187 1.00 0.00 H new ATOM 0 HB2 PHE A 27 15.378 19.942 21.701 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.898 18.785 22.927 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.731 22.508 22.199 1.00 0.00 H new ATOM 0 HD2 PHE A 27 12.914 19.109 24.103 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.753 23.891 22.798 1.00 0.00 H new ATOM 0 HE2 PHE A 27 10.936 20.493 24.688 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.861 22.882 24.043 1.00 0.00 H new ATOM 422 N VAL A 28 16.917 22.208 22.469 1.00 0.00 N ATOM 423 CA VAL A 28 17.053 23.669 22.283 1.00 0.00 C ATOM 424 C VAL A 28 16.301 24.010 21.032 1.00 0.00 C ATOM 425 O VAL A 28 15.852 23.123 20.309 1.00 0.00 O ATOM 426 CB VAL A 28 18.540 23.961 22.074 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.362 22.785 22.553 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.847 24.169 20.595 1.00 0.00 C ATOM 0 H VAL A 28 17.148 21.652 21.645 1.00 0.00 H new ATOM 0 HA VAL A 28 16.674 24.240 23.131 1.00 0.00 H new ATOM 0 HB VAL A 28 18.786 24.863 22.634 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.421 22.996 22.403 1.00 0.00 H new ATOM 0 HG12 VAL A 28 19.172 22.616 23.613 1.00 0.00 H new ATOM 0 HG13 VAL A 28 19.086 21.894 21.989 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.910 24.375 20.470 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.584 23.269 20.039 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.267 25.011 20.218 1.00 0.00 H new ATOM 438 N PHE A 29 16.208 25.247 20.712 1.00 0.00 N ATOM 439 CA PHE A 29 15.542 25.576 19.446 1.00 0.00 C ATOM 440 C PHE A 29 16.320 26.665 18.745 1.00 0.00 C ATOM 441 O PHE A 29 16.564 27.742 19.278 1.00 0.00 O ATOM 442 CB PHE A 29 14.093 25.919 19.775 1.00 0.00 C ATOM 443 CG PHE A 29 13.838 27.414 19.910 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.589 28.195 18.773 1.00 0.00 C ATOM 445 CD2 PHE A 29 13.776 28.004 21.181 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.290 29.560 18.910 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.467 29.367 21.311 1.00 0.00 C ATOM 448 CZ PHE A 29 13.226 30.141 20.176 1.00 0.00 C ATOM 0 H PHE A 29 16.556 26.035 21.258 1.00 0.00 H new ATOM 0 HA PHE A 29 15.521 24.746 18.740 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.447 25.517 18.995 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.813 25.425 20.706 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.627 27.747 17.791 1.00 0.00 H new ATOM 0 HD2 PHE A 29 13.966 27.408 22.061 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.109 30.162 18.032 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.416 29.817 22.291 1.00 0.00 H new ATOM 0 HZ PHE A 29 12.990 31.190 20.278 1.00 0.00 H new ATOM 458 N ALA A 30 16.772 26.343 17.575 1.00 0.00 N ATOM 459 CA ALA A 30 17.633 27.284 16.805 1.00 0.00 C ATOM 460 C ALA A 30 16.867 28.087 15.768 1.00 0.00 C ATOM 461 O ALA A 30 16.387 27.565 14.764 1.00 0.00 O ATOM 462 CB ALA A 30 18.673 26.398 16.121 1.00 0.00 C ATOM 0 H ALA A 30 16.582 25.456 17.108 1.00 0.00 H new ATOM 0 HA ALA A 30 18.070 28.027 17.473 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.348 27.018 15.531 1.00 0.00 H new ATOM 0 HB2 ALA A 30 19.243 25.857 16.876 1.00 0.00 H new ATOM 0 HB3 ALA A 30 18.170 25.686 15.467 1.00 0.00 H new ATOM 468 N VAL A 31 16.794 29.365 15.982 1.00 0.00 N ATOM 469 CA VAL A 31 16.118 30.258 15.016 1.00 0.00 C ATOM 470 C VAL A 31 17.163 30.667 13.966 1.00 0.00 C ATOM 471 O VAL A 31 18.002 31.540 14.203 1.00 0.00 O ATOM 472 CB VAL A 31 15.674 31.470 15.837 1.00 0.00 C ATOM 473 CG1 VAL A 31 14.554 32.202 15.110 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.166 31.021 17.201 1.00 0.00 C ATOM 0 H VAL A 31 17.181 29.835 16.800 1.00 0.00 H new ATOM 0 HA VAL A 31 15.268 29.802 14.508 1.00 0.00 H new ATOM 0 HB VAL A 31 16.528 32.135 15.967 1.00 0.00 H new ATOM 0 HG11 VAL A 31 14.241 33.064 15.698 1.00 0.00 H new ATOM 0 HG12 VAL A 31 14.911 32.537 14.136 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.707 31.529 14.974 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.853 31.892 17.777 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.319 30.348 17.070 1.00 0.00 H new ATOM 0 HG23 VAL A 31 15.963 30.502 17.733 1.00 0.00 H new ATOM 484 N ARG A 32 17.141 30.032 12.829 1.00 0.00 N ATOM 485 CA ARG A 32 18.126 30.340 11.752 1.00 0.00 C ATOM 486 C ARG A 32 17.995 31.785 11.286 1.00 0.00 C ATOM 487 O ARG A 32 18.905 32.362 10.695 1.00 0.00 O ATOM 488 CB ARG A 32 17.689 29.444 10.613 1.00 0.00 C ATOM 489 CG ARG A 32 18.217 28.024 10.820 1.00 0.00 C ATOM 490 CD ARG A 32 17.419 27.045 9.953 1.00 0.00 C ATOM 491 NE ARG A 32 18.403 26.515 8.963 1.00 0.00 N ATOM 492 CZ ARG A 32 18.683 27.183 7.867 1.00 0.00 C ATOM 493 NH1 ARG A 32 18.108 28.330 7.614 1.00 0.00 N ATOM 494 NH2 ARG A 32 19.548 26.696 7.019 1.00 0.00 N ATOM 0 H ARG A 32 16.471 29.299 12.595 1.00 0.00 H new ATOM 0 HA ARG A 32 19.153 30.191 12.086 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.601 29.429 10.551 1.00 0.00 H new ATOM 0 HB3 ARG A 32 18.057 29.842 9.667 1.00 0.00 H new ATOM 0 HG2 ARG A 32 19.274 27.977 10.559 1.00 0.00 H new ATOM 0 HG3 ARG A 32 18.135 27.745 11.870 1.00 0.00 H new ATOM 0 HD2 ARG A 32 16.993 26.242 10.555 1.00 0.00 H new ATOM 0 HD3 ARG A 32 16.589 27.545 9.455 1.00 0.00 H new ATOM 0 HE ARG A 32 18.864 25.622 9.140 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.432 28.718 8.272 1.00 0.00 H new ATOM 0 HH12 ARG A 32 18.336 28.837 6.759 1.00 0.00 H new ATOM 0 HH21 ARG A 32 20.001 25.802 7.210 1.00 0.00 H new ATOM 0 HH22 ARG A 32 19.770 27.209 6.166 1.00 0.00 H new ATOM 508 N THR A 33 16.873 32.367 11.553 1.00 0.00 N ATOM 509 CA THR A 33 16.635 33.782 11.146 1.00 0.00 C ATOM 510 C THR A 33 17.612 34.679 11.893 1.00 0.00 C ATOM 511 O THR A 33 18.056 35.712 11.395 1.00 0.00 O ATOM 512 CB THR A 33 15.188 34.080 11.557 1.00 0.00 C ATOM 513 OG1 THR A 33 14.709 35.197 10.822 1.00 0.00 O ATOM 514 CG2 THR A 33 15.111 34.396 13.055 1.00 0.00 C ATOM 0 H THR A 33 16.095 31.924 12.042 1.00 0.00 H new ATOM 0 HA THR A 33 16.782 33.953 10.080 1.00 0.00 H new ATOM 0 HB THR A 33 14.577 33.203 11.346 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.784 35.388 11.082 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.077 34.605 13.330 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.473 33.541 13.626 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.728 35.267 13.275 1.00 0.00 H new ATOM 522 N THR A 34 17.958 34.283 13.084 1.00 0.00 N ATOM 523 CA THR A 34 18.922 35.091 13.888 1.00 0.00 C ATOM 524 C THR A 34 20.166 34.258 14.209 1.00 0.00 C ATOM 525 O THR A 34 21.071 34.706 14.911 1.00 0.00 O ATOM 526 CB THR A 34 18.172 35.457 15.170 1.00 0.00 C ATOM 527 OG1 THR A 34 19.019 36.235 16.007 1.00 0.00 O ATOM 528 CG2 THR A 34 17.752 34.188 15.909 1.00 0.00 C ATOM 0 H THR A 34 17.617 33.436 13.538 1.00 0.00 H new ATOM 0 HA THR A 34 19.261 35.978 13.354 1.00 0.00 H new ATOM 0 HB THR A 34 17.282 36.031 14.913 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.943 35.919 15.922 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.219 34.457 16.821 1.00 0.00 H new ATOM 0 HG22 THR A 34 17.100 33.593 15.269 1.00 0.00 H new ATOM 0 HG23 THR A 34 18.637 33.606 16.165 1.00 0.00 H new ATOM 536 N GLY A 35 20.230 33.052 13.708 1.00 0.00 N ATOM 537 CA GLY A 35 21.410 32.190 13.980 1.00 0.00 C ATOM 538 C GLY A 35 21.534 31.951 15.484 1.00 0.00 C ATOM 539 O GLY A 35 22.636 31.866 16.020 1.00 0.00 O ATOM 0 H GLY A 35 19.512 32.629 13.121 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.306 31.239 13.458 1.00 0.00 H new ATOM 0 HA3 GLY A 35 22.315 32.665 13.601 1.00 0.00 H new ATOM 543 N ILE A 36 20.432 31.828 16.180 1.00 0.00 N ATOM 544 CA ILE A 36 20.520 31.580 17.654 1.00 0.00 C ATOM 545 C ILE A 36 19.753 30.313 17.991 1.00 0.00 C ATOM 546 O ILE A 36 18.910 29.860 17.228 1.00 0.00 O ATOM 547 CB ILE A 36 19.787 32.742 18.346 1.00 0.00 C ATOM 548 CG1 ILE A 36 20.548 34.052 18.194 1.00 0.00 C ATOM 549 CG2 ILE A 36 19.657 32.450 19.858 1.00 0.00 C ATOM 550 CD1 ILE A 36 19.744 35.142 18.907 1.00 0.00 C ATOM 0 H ILE A 36 19.487 31.887 15.800 1.00 0.00 H new ATOM 0 HA ILE A 36 21.561 31.493 17.967 1.00 0.00 H new ATOM 0 HB ILE A 36 18.808 32.834 17.876 1.00 0.00 H new ATOM 0 HG12 ILE A 36 21.545 33.968 18.626 1.00 0.00 H new ATOM 0 HG13 ILE A 36 20.677 34.299 17.140 1.00 0.00 H new ATOM 0 HG21 ILE A 36 19.137 33.275 20.345 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.092 31.529 20.003 1.00 0.00 H new ATOM 0 HG23 ILE A 36 20.650 32.339 20.294 1.00 0.00 H new ATOM 0 HD11 ILE A 36 20.264 36.096 18.816 1.00 0.00 H new ATOM 0 HD12 ILE A 36 18.757 35.222 18.452 1.00 0.00 H new ATOM 0 HD13 ILE A 36 19.638 34.885 19.961 1.00 0.00 H new ATOM 562 N PHE A 37 19.969 29.792 19.156 1.00 0.00 N ATOM 563 CA PHE A 37 19.185 28.619 19.598 1.00 0.00 C ATOM 564 C PHE A 37 18.979 28.744 21.094 1.00 0.00 C ATOM 565 O PHE A 37 19.930 28.822 21.871 1.00 0.00 O ATOM 566 CB PHE A 37 19.957 27.358 19.201 1.00 0.00 C ATOM 567 CG PHE A 37 21.019 27.014 20.205 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.658 26.383 21.399 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.359 27.276 19.927 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.636 26.018 22.318 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.340 26.900 20.842 1.00 0.00 C ATOM 572 CZ PHE A 37 22.977 26.270 22.040 1.00 0.00 C ATOM 0 H PHE A 37 20.660 30.130 19.826 1.00 0.00 H new ATOM 0 HA PHE A 37 18.203 28.562 19.129 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.263 26.523 19.105 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.416 27.505 18.223 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.618 26.179 21.608 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.636 27.768 19.006 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.356 25.540 23.245 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.381 27.094 20.628 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.738 25.979 22.749 1.00 0.00 H new ATOM 596 N ARG A 39 16.512 28.039 24.817 1.00 0.00 N ATOM 597 CA ARG A 39 15.879 27.017 25.634 1.00 0.00 C ATOM 598 C ARG A 39 14.407 27.018 25.272 1.00 0.00 C ATOM 599 O ARG A 39 13.967 27.866 24.498 1.00 0.00 O ATOM 600 CB ARG A 39 16.028 27.628 27.010 1.00 0.00 C ATOM 601 CG ARG A 39 17.343 27.228 27.643 1.00 0.00 C ATOM 602 CD ARG A 39 17.502 28.046 28.915 1.00 0.00 C ATOM 603 NE ARG A 39 18.701 27.500 29.583 1.00 0.00 N ATOM 604 CZ ARG A 39 18.919 27.758 30.839 1.00 0.00 C ATOM 605 NH1 ARG A 39 18.091 28.503 31.530 1.00 0.00 N ATOM 606 NH2 ARG A 39 19.972 27.279 31.412 1.00 0.00 N ATOM 0 HA ARG A 39 16.277 26.007 25.535 1.00 0.00 H new ATOM 0 HB2 ARG A 39 15.971 28.714 26.937 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.202 27.307 27.645 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.352 26.162 27.869 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.171 27.416 26.960 1.00 0.00 H new ATOM 0 HD2 ARG A 39 17.626 29.105 28.689 1.00 0.00 H new ATOM 0 HD3 ARG A 39 16.622 27.957 29.552 1.00 0.00 H new ATOM 0 HE ARG A 39 19.358 26.921 29.060 1.00 0.00 H new ATOM 0 HH11 ARG A 39 17.260 28.891 31.084 1.00 0.00 H new ATOM 0 HH12 ARG A 39 18.278 28.695 32.514 1.00 0.00 H new ATOM 0 HH21 ARG A 39 20.625 26.703 30.880 1.00 0.00 H new ATOM 0 HH22 ARG A 39 20.151 27.476 32.397 1.00 0.00 H new ATOM 620 N PRO A 40 13.664 26.147 25.865 1.00 0.00 N ATOM 621 CA PRO A 40 12.222 26.161 25.613 1.00 0.00 C ATOM 622 C PRO A 40 11.608 27.331 26.395 1.00 0.00 C ATOM 623 O PRO A 40 10.488 27.757 26.139 1.00 0.00 O ATOM 624 CB PRO A 40 11.741 24.828 26.165 1.00 0.00 C ATOM 625 CG PRO A 40 12.755 24.454 27.198 1.00 0.00 C ATOM 626 CD PRO A 40 14.064 25.084 26.793 1.00 0.00 C ATOM 0 HA PRO A 40 11.952 26.286 24.564 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.746 24.916 26.601 1.00 0.00 H new ATOM 0 HB3 PRO A 40 11.679 24.074 25.380 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.448 24.806 28.183 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.854 23.371 27.264 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.599 25.484 27.654 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.725 24.362 26.314 1.00 0.00 H new ATOM 634 N SER A 41 12.313 27.828 27.378 1.00 0.00 N ATOM 635 CA SER A 41 11.779 28.922 28.202 1.00 0.00 C ATOM 636 C SER A 41 12.587 30.227 28.064 1.00 0.00 C ATOM 637 O SER A 41 12.654 31.014 29.007 1.00 0.00 O ATOM 638 CB SER A 41 11.838 28.343 29.614 1.00 0.00 C ATOM 639 OG SER A 41 13.113 28.606 30.185 1.00 0.00 O ATOM 0 H SER A 41 13.247 27.510 27.638 1.00 0.00 H new ATOM 0 HA SER A 41 10.774 29.222 27.904 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.054 28.783 30.231 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.656 27.269 29.585 1.00 0.00 H new ATOM 0 HG SER A 41 13.148 28.235 31.091 1.00 0.00 H new ATOM 645 N CYS A 42 13.190 30.496 26.918 1.00 0.00 N ATOM 646 CA CYS A 42 13.959 31.770 26.769 1.00 0.00 C ATOM 647 C CYS A 42 13.112 32.938 27.259 1.00 0.00 C ATOM 648 O CYS A 42 11.909 33.019 27.013 1.00 0.00 O ATOM 649 CB CYS A 42 14.255 31.953 25.284 1.00 0.00 C ATOM 650 SG CYS A 42 15.250 33.460 25.077 1.00 0.00 S ATOM 0 H CYS A 42 13.179 29.893 26.095 1.00 0.00 H new ATOM 0 HA CYS A 42 14.880 31.734 27.350 1.00 0.00 H new ATOM 0 HB2 CYS A 42 14.792 31.088 24.895 1.00 0.00 H new ATOM 0 HB3 CYS A 42 13.326 32.032 24.719 1.00 0.00 H new ATOM 0 HG CYS A 42 16.451 33.253 25.530 1.00 0.00 H new ATOM 655 N ARG A 43 13.727 33.825 27.953 1.00 0.00 N ATOM 656 CA ARG A 43 12.997 35.009 28.495 1.00 0.00 C ATOM 657 C ARG A 43 13.229 36.276 27.658 1.00 0.00 C ATOM 658 O ARG A 43 12.822 37.367 28.054 1.00 0.00 O ATOM 659 CB ARG A 43 13.514 35.198 29.933 1.00 0.00 C ATOM 660 CG ARG A 43 15.029 34.948 30.034 1.00 0.00 C ATOM 661 CD ARG A 43 15.778 35.766 28.980 1.00 0.00 C ATOM 662 NE ARG A 43 15.427 37.189 29.264 1.00 0.00 N ATOM 663 CZ ARG A 43 15.841 38.148 28.474 1.00 0.00 C ATOM 664 NH1 ARG A 43 16.569 37.881 27.422 1.00 0.00 N ATOM 665 NH2 ARG A 43 15.526 39.385 28.738 1.00 0.00 N ATOM 0 H ARG A 43 14.721 33.793 28.180 1.00 0.00 H new ATOM 0 HA ARG A 43 11.921 34.839 28.466 1.00 0.00 H new ATOM 0 HB2 ARG A 43 13.290 36.210 30.270 1.00 0.00 H new ATOM 0 HB3 ARG A 43 12.988 34.516 30.601 1.00 0.00 H new ATOM 0 HG2 ARG A 43 15.382 35.216 31.030 1.00 0.00 H new ATOM 0 HG3 ARG A 43 15.239 33.887 29.896 1.00 0.00 H new ATOM 0 HD2 ARG A 43 16.854 35.605 29.048 1.00 0.00 H new ATOM 0 HD3 ARG A 43 15.476 35.480 27.972 1.00 0.00 H new ATOM 0 HE ARG A 43 14.860 37.416 30.081 1.00 0.00 H new ATOM 0 HH11 ARG A 43 16.821 36.916 27.208 1.00 0.00 H new ATOM 0 HH12 ARG A 43 16.885 38.637 26.815 1.00 0.00 H new ATOM 0 HH21 ARG A 43 14.959 39.603 29.557 1.00 0.00 H new ATOM 0 HH22 ARG A 43 15.846 40.135 28.125 1.00 0.00 H new ATOM 679 N ALA A 44 13.900 36.179 26.536 1.00 0.00 N ATOM 680 CA ALA A 44 14.166 37.422 25.740 1.00 0.00 C ATOM 681 C ALA A 44 13.058 37.718 24.730 1.00 0.00 C ATOM 682 O ALA A 44 12.539 38.829 24.669 1.00 0.00 O ATOM 683 CB ALA A 44 15.478 37.136 25.005 1.00 0.00 C ATOM 0 H ALA A 44 14.269 35.314 26.142 1.00 0.00 H new ATOM 0 HA ALA A 44 14.214 38.296 26.389 1.00 0.00 H new ATOM 0 HB1 ALA A 44 15.749 37.998 24.395 1.00 0.00 H new ATOM 0 HB2 ALA A 44 16.267 36.943 25.731 1.00 0.00 H new ATOM 0 HB3 ALA A 44 15.353 36.263 24.364 1.00 0.00 H new ATOM 689 N ARG A 45 12.698 36.750 23.939 1.00 0.00 N ATOM 690 CA ARG A 45 11.630 36.945 22.895 1.00 0.00 C ATOM 691 C ARG A 45 11.616 35.682 22.005 1.00 0.00 C ATOM 692 O ARG A 45 12.440 34.789 22.193 1.00 0.00 O ATOM 693 CB ARG A 45 12.064 38.200 22.101 1.00 0.00 C ATOM 694 CG ARG A 45 10.872 38.823 21.358 1.00 0.00 C ATOM 695 CD ARG A 45 10.451 40.124 22.063 1.00 0.00 C ATOM 696 NE ARG A 45 11.089 41.235 21.282 1.00 0.00 N ATOM 697 CZ ARG A 45 10.553 41.659 20.161 1.00 0.00 C ATOM 698 NH1 ARG A 45 9.453 41.122 19.697 1.00 0.00 N ATOM 699 NH2 ARG A 45 11.125 42.627 19.500 1.00 0.00 N ATOM 0 H ARG A 45 13.099 35.813 23.964 1.00 0.00 H new ATOM 0 HA ARG A 45 10.628 37.084 23.300 1.00 0.00 H new ATOM 0 HB2 ARG A 45 12.496 38.934 22.782 1.00 0.00 H new ATOM 0 HB3 ARG A 45 12.842 37.931 21.386 1.00 0.00 H new ATOM 0 HG2 ARG A 45 11.143 39.029 20.323 1.00 0.00 H new ATOM 0 HG3 ARG A 45 10.037 38.122 21.336 1.00 0.00 H new ATOM 0 HD2 ARG A 45 9.366 40.228 22.077 1.00 0.00 H new ATOM 0 HD3 ARG A 45 10.785 40.133 23.100 1.00 0.00 H new ATOM 0 HE ARG A 45 11.948 41.665 21.625 1.00 0.00 H new ATOM 0 HH11 ARG A 45 9.001 40.364 20.208 1.00 0.00 H new ATOM 0 HH12 ARG A 45 9.048 41.462 18.825 1.00 0.00 H new ATOM 0 HH21 ARG A 45 11.983 43.049 19.855 1.00 0.00 H new ATOM 0 HH22 ARG A 45 10.714 42.962 18.628 1.00 0.00 H new ATOM 713 N HIS A 46 10.709 35.557 21.063 1.00 0.00 N ATOM 714 CA HIS A 46 10.689 34.315 20.222 1.00 0.00 C ATOM 715 C HIS A 46 10.476 34.576 18.743 1.00 0.00 C ATOM 716 O HIS A 46 9.903 35.576 18.337 1.00 0.00 O ATOM 717 CB HIS A 46 9.505 33.513 20.714 1.00 0.00 C ATOM 718 CG HIS A 46 9.942 32.592 21.792 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.167 32.766 23.129 1.00 0.00 N flip ATOM 720 CD2 HIS A 46 10.159 31.260 21.534 1.00 0.00 C flip ATOM 721 CE1 HIS A 46 10.508 31.546 23.699 1.00 0.00 C flip ATOM 722 NE2 HIS A 46 10.481 30.679 22.684 1.00 0.00 N flip ATOM 0 H HIS A 46 9.993 36.249 20.842 1.00 0.00 H new ATOM 0 HA HIS A 46 11.654 33.817 20.316 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.729 34.182 21.086 1.00 0.00 H new ATOM 0 HB3 HIS A 46 9.070 32.946 19.891 1.00 0.00 H new ATOM 0 HD1 HIS A 46 10.096 33.652 23.629 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.082 30.775 20.572 1.00 0.00 H new ATOM 0 HE1 HIS A 46 10.743 31.344 24.734 1.00 0.00 H new ATOM 730 N ALA A 47 10.878 33.625 17.949 1.00 0.00 N ATOM 731 CA ALA A 47 10.683 33.707 16.482 1.00 0.00 C ATOM 732 C ALA A 47 9.831 32.521 16.023 1.00 0.00 C ATOM 733 O ALA A 47 9.709 31.519 16.725 1.00 0.00 O ATOM 734 CB ALA A 47 12.085 33.646 15.878 1.00 0.00 C ATOM 0 H ALA A 47 11.344 32.775 18.267 1.00 0.00 H new ATOM 0 HA ALA A 47 10.168 34.617 16.174 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.016 33.702 14.792 1.00 0.00 H new ATOM 0 HB2 ALA A 47 12.677 34.483 16.247 1.00 0.00 H new ATOM 0 HB3 ALA A 47 12.564 32.709 16.163 1.00 0.00 H new ATOM 740 N LEU A 48 9.215 32.624 14.880 1.00 0.00 N ATOM 741 CA LEU A 48 8.347 31.529 14.391 1.00 0.00 C ATOM 742 C LEU A 48 9.074 30.178 14.359 1.00 0.00 C ATOM 743 O LEU A 48 10.299 30.104 14.303 1.00 0.00 O ATOM 744 CB LEU A 48 7.940 31.944 12.976 1.00 0.00 C ATOM 745 CG LEU A 48 7.157 33.257 13.030 1.00 0.00 C ATOM 746 CD1 LEU A 48 7.556 34.137 11.843 1.00 0.00 C ATOM 747 CD2 LEU A 48 5.657 32.963 12.961 1.00 0.00 C ATOM 0 H LEU A 48 9.279 33.431 14.260 1.00 0.00 H new ATOM 0 HA LEU A 48 7.493 31.389 15.053 1.00 0.00 H new ATOM 0 HB2 LEU A 48 8.826 32.063 12.352 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.331 31.164 12.519 1.00 0.00 H new ATOM 0 HG LEU A 48 7.383 33.775 13.962 1.00 0.00 H new ATOM 0 HD11 LEU A 48 6.999 35.073 11.880 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.624 34.349 11.890 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.330 33.617 10.912 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.101 33.899 13.000 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.430 32.444 12.029 1.00 0.00 H new ATOM 0 HD23 LEU A 48 5.370 32.335 13.805 1.00 0.00 H new ATOM 759 N ARG A 49 8.318 29.110 14.373 1.00 0.00 N ATOM 760 CA ARG A 49 8.916 27.740 14.323 1.00 0.00 C ATOM 761 C ARG A 49 9.654 27.567 13.007 1.00 0.00 C ATOM 762 O ARG A 49 10.638 26.839 12.888 1.00 0.00 O ATOM 763 CB ARG A 49 7.700 26.839 14.303 1.00 0.00 C ATOM 764 CG ARG A 49 8.083 25.431 14.758 1.00 0.00 C ATOM 765 CD ARG A 49 7.343 24.396 13.906 1.00 0.00 C ATOM 766 NE ARG A 49 8.000 23.100 14.232 1.00 0.00 N ATOM 767 CZ ARG A 49 7.780 22.510 15.381 1.00 0.00 C ATOM 768 NH1 ARG A 49 6.980 23.045 16.266 1.00 0.00 N ATOM 769 NH2 ARG A 49 8.366 21.377 15.644 1.00 0.00 N ATOM 0 H ARG A 49 7.299 29.129 14.417 1.00 0.00 H new ATOM 0 HA ARG A 49 9.609 27.540 15.140 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.927 27.243 14.957 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.280 26.803 13.298 1.00 0.00 H new ATOM 0 HG2 ARG A 49 9.160 25.289 14.667 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.832 25.297 15.810 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.280 24.373 14.146 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.425 24.626 12.844 1.00 0.00 H new ATOM 0 HE ARG A 49 8.627 22.667 13.554 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.518 23.932 16.066 1.00 0.00 H new ATOM 0 HH12 ARG A 49 6.817 22.575 17.157 1.00 0.00 H new ATOM 0 HH21 ARG A 49 8.991 20.955 14.958 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.200 20.912 16.536 1.00 0.00 H new ATOM 783 N GLU A 50 9.155 28.240 12.024 1.00 0.00 N ATOM 784 CA GLU A 50 9.715 28.210 10.656 1.00 0.00 C ATOM 785 C GLU A 50 11.236 28.219 10.662 1.00 0.00 C ATOM 786 O GLU A 50 11.895 27.282 10.215 1.00 0.00 O ATOM 787 CB GLU A 50 9.190 29.512 10.090 1.00 0.00 C ATOM 788 CG GLU A 50 9.329 29.502 8.597 1.00 0.00 C ATOM 789 CD GLU A 50 10.779 29.774 8.195 1.00 0.00 C ATOM 790 OE1 GLU A 50 11.134 30.935 8.085 1.00 0.00 O ATOM 791 OE2 GLU A 50 11.509 28.816 8.000 1.00 0.00 O ATOM 0 H GLU A 50 8.337 28.842 12.119 1.00 0.00 H new ATOM 0 HA GLU A 50 9.438 27.317 10.096 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.144 29.646 10.367 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.742 30.352 10.511 1.00 0.00 H new ATOM 0 HG2 GLU A 50 9.010 28.537 8.202 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.676 30.257 8.159 1.00 0.00 H new ATOM 798 N ASN A 51 11.792 29.265 11.178 1.00 0.00 N ATOM 799 CA ASN A 51 13.272 29.380 11.251 1.00 0.00 C ATOM 800 C ASN A 51 13.742 28.789 12.565 1.00 0.00 C ATOM 801 O ASN A 51 14.842 29.045 13.020 1.00 0.00 O ATOM 802 CB ASN A 51 13.540 30.883 11.251 1.00 0.00 C ATOM 803 CG ASN A 51 13.152 31.482 9.902 1.00 0.00 C ATOM 804 OD1 ASN A 51 13.696 31.107 8.867 1.00 0.00 O ATOM 805 ND2 ASN A 51 12.231 32.406 9.862 1.00 0.00 N ATOM 0 H ASN A 51 11.281 30.061 11.560 1.00 0.00 H new ATOM 0 HA ASN A 51 13.780 28.865 10.436 1.00 0.00 H new ATOM 0 HB2 ASN A 51 12.971 31.362 12.048 1.00 0.00 H new ATOM 0 HB3 ASN A 51 14.594 31.073 11.453 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.961 32.819 8.969 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.781 32.715 10.724 1.00 0.00 H new ATOM 812 N VAL A 52 12.910 28.020 13.188 1.00 0.00 N ATOM 813 CA VAL A 52 13.274 27.429 14.496 1.00 0.00 C ATOM 814 C VAL A 52 13.348 25.898 14.410 1.00 0.00 C ATOM 815 O VAL A 52 12.384 25.231 14.037 1.00 0.00 O ATOM 816 CB VAL A 52 12.130 27.876 15.407 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.884 26.846 16.507 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.483 29.217 16.046 1.00 0.00 C ATOM 0 H VAL A 52 11.982 27.771 12.845 1.00 0.00 H new ATOM 0 HA VAL A 52 14.254 27.746 14.852 1.00 0.00 H new ATOM 0 HB VAL A 52 11.226 27.974 14.807 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.066 27.183 17.144 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.623 25.888 16.057 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.787 26.731 17.106 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.668 29.536 16.696 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.395 29.111 16.633 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.638 29.962 15.266 1.00 0.00 H new ATOM 828 N SER A 53 14.464 25.336 14.780 1.00 0.00 N ATOM 829 CA SER A 53 14.607 23.857 14.761 1.00 0.00 C ATOM 830 C SER A 53 14.957 23.381 16.167 1.00 0.00 C ATOM 831 O SER A 53 15.124 24.187 17.074 1.00 0.00 O ATOM 832 CB SER A 53 15.743 23.571 13.781 1.00 0.00 C ATOM 833 OG SER A 53 16.774 24.536 13.951 1.00 0.00 O ATOM 0 H SER A 53 15.290 25.844 15.097 1.00 0.00 H new ATOM 0 HA SER A 53 13.696 23.342 14.457 1.00 0.00 H new ATOM 0 HB2 SER A 53 16.138 22.569 13.949 1.00 0.00 H new ATOM 0 HB3 SER A 53 15.370 23.599 12.757 1.00 0.00 H new ATOM 0 HG SER A 53 17.503 24.350 13.323 1.00 0.00 H new ATOM 839 N PHE A 54 15.031 22.100 16.382 1.00 0.00 N ATOM 840 CA PHE A 54 15.317 21.595 17.732 1.00 0.00 C ATOM 841 C PHE A 54 16.598 20.783 17.781 1.00 0.00 C ATOM 842 O PHE A 54 17.004 20.136 16.818 1.00 0.00 O ATOM 843 CB PHE A 54 14.121 20.727 18.040 1.00 0.00 C ATOM 844 CG PHE A 54 12.904 21.600 17.999 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.590 22.407 19.097 1.00 0.00 C ATOM 846 CD2 PHE A 54 12.117 21.637 16.847 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.479 23.249 19.041 1.00 0.00 C ATOM 848 CE2 PHE A 54 11.013 22.485 16.789 1.00 0.00 C ATOM 849 CZ PHE A 54 10.696 23.289 17.885 1.00 0.00 C ATOM 0 H PHE A 54 14.903 21.382 15.669 1.00 0.00 H new ATOM 0 HA PHE A 54 15.467 22.401 18.450 1.00 0.00 H new ATOM 0 HB2 PHE A 54 14.037 19.919 17.313 1.00 0.00 H new ATOM 0 HB3 PHE A 54 14.227 20.264 19.021 1.00 0.00 H new ATOM 0 HD1 PHE A 54 13.205 22.379 19.984 1.00 0.00 H new ATOM 0 HD2 PHE A 54 12.363 21.010 16.003 1.00 0.00 H new ATOM 0 HE1 PHE A 54 11.225 23.868 19.889 1.00 0.00 H new ATOM 0 HE2 PHE A 54 10.404 22.520 15.898 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.840 23.946 17.839 1.00 0.00 H new ATOM 859 N TYR A 55 17.229 20.814 18.909 1.00 0.00 N ATOM 860 CA TYR A 55 18.495 20.061 19.102 1.00 0.00 C ATOM 861 C TYR A 55 18.409 19.248 20.379 1.00 0.00 C ATOM 862 O TYR A 55 17.688 19.608 21.302 1.00 0.00 O ATOM 863 CB TYR A 55 19.561 21.140 19.262 1.00 0.00 C ATOM 864 CG TYR A 55 19.783 21.808 17.934 1.00 0.00 C ATOM 865 CD1 TYR A 55 18.836 22.711 17.446 1.00 0.00 C ATOM 866 CD2 TYR A 55 20.923 21.511 17.186 1.00 0.00 C ATOM 867 CE1 TYR A 55 19.033 23.322 16.205 1.00 0.00 C ATOM 868 CE2 TYR A 55 21.120 22.119 15.941 1.00 0.00 C ATOM 869 CZ TYR A 55 20.174 23.027 15.450 1.00 0.00 C ATOM 870 OH TYR A 55 20.366 23.632 14.224 1.00 0.00 O ATOM 0 H TYR A 55 16.918 21.339 19.726 1.00 0.00 H new ATOM 0 HA TYR A 55 18.706 19.378 18.279 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.246 21.873 20.005 1.00 0.00 H new ATOM 0 HB3 TYR A 55 20.491 20.700 19.623 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.954 22.936 18.026 1.00 0.00 H new ATOM 0 HD2 TYR A 55 21.653 20.812 17.568 1.00 0.00 H new ATOM 0 HE1 TYR A 55 18.303 24.023 15.828 1.00 0.00 H new ATOM 0 HE2 TYR A 55 22.000 21.888 15.360 1.00 0.00 H new ATOM 0 HH TYR A 55 19.948 24.518 14.227 1.00 0.00 H new ATOM 880 N ALA A 56 19.149 18.183 20.475 1.00 0.00 N ATOM 881 CA ALA A 56 19.116 17.395 21.731 1.00 0.00 C ATOM 882 C ALA A 56 19.777 18.232 22.819 1.00 0.00 C ATOM 883 O ALA A 56 19.317 18.288 23.956 1.00 0.00 O ATOM 884 CB ALA A 56 19.921 16.135 21.446 1.00 0.00 C ATOM 0 H ALA A 56 19.768 17.828 19.747 1.00 0.00 H new ATOM 0 HA ALA A 56 18.109 17.136 22.058 1.00 0.00 H new ATOM 0 HB1 ALA A 56 19.938 15.505 22.335 1.00 0.00 H new ATOM 0 HB2 ALA A 56 19.462 15.588 20.622 1.00 0.00 H new ATOM 0 HB3 ALA A 56 20.941 16.408 21.176 1.00 0.00 H new ATOM 890 N ASN A 57 20.846 18.907 22.476 1.00 0.00 N ATOM 891 CA ASN A 57 21.531 19.762 23.461 1.00 0.00 C ATOM 892 C ASN A 57 22.000 21.056 22.815 1.00 0.00 C ATOM 893 O ASN A 57 22.019 21.216 21.588 1.00 0.00 O ATOM 894 CB ASN A 57 22.748 18.983 23.913 1.00 0.00 C ATOM 895 CG ASN A 57 23.591 18.608 22.703 1.00 0.00 C ATOM 896 OD1 ASN A 57 24.519 19.330 22.350 1.00 0.00 O ATOM 897 ND2 ASN A 57 23.312 17.524 22.041 1.00 0.00 N ATOM 0 H ASN A 57 21.267 18.895 21.547 1.00 0.00 H new ATOM 0 HA ASN A 57 20.861 20.014 24.283 1.00 0.00 H new ATOM 0 HB2 ASN A 57 23.337 19.581 24.609 1.00 0.00 H new ATOM 0 HB3 ASN A 57 22.440 18.084 24.447 1.00 0.00 H new ATOM 0 HD21 ASN A 57 23.866 17.269 21.223 1.00 0.00 H new ATOM 0 HD22 ASN A 57 22.540 16.929 22.340 1.00 0.00 H new ATOM 904 N ALA A 58 22.410 21.967 23.631 1.00 0.00 N ATOM 905 CA ALA A 58 22.916 23.251 23.116 1.00 0.00 C ATOM 906 C ALA A 58 24.194 23.027 22.310 1.00 0.00 C ATOM 907 O ALA A 58 24.511 23.814 21.435 1.00 0.00 O ATOM 908 CB ALA A 58 23.213 24.085 24.359 1.00 0.00 C ATOM 0 H ALA A 58 22.416 21.876 24.647 1.00 0.00 H new ATOM 0 HA ALA A 58 22.201 23.741 22.455 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.596 25.061 24.060 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.298 24.216 24.937 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.958 23.575 24.970 1.00 0.00 H new ATOM 914 N SER A 59 24.936 21.975 22.568 1.00 0.00 N ATOM 915 CA SER A 59 26.185 21.768 21.773 1.00 0.00 C ATOM 916 C SER A 59 25.809 21.394 20.345 1.00 0.00 C ATOM 917 O SER A 59 26.443 21.829 19.387 1.00 0.00 O ATOM 918 CB SER A 59 26.947 20.637 22.465 1.00 0.00 C ATOM 919 OG SER A 59 28.314 20.691 22.076 1.00 0.00 O ATOM 0 H SER A 59 24.737 21.268 23.276 1.00 0.00 H new ATOM 0 HA SER A 59 26.803 22.664 21.723 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.860 20.732 23.547 1.00 0.00 H new ATOM 0 HB3 SER A 59 26.517 19.673 22.194 1.00 0.00 H new ATOM 0 HG SER A 59 28.809 19.969 22.518 1.00 0.00 H new ATOM 925 N GLU A 60 24.764 20.631 20.178 1.00 0.00 N ATOM 926 CA GLU A 60 24.322 20.279 18.809 1.00 0.00 C ATOM 927 C GLU A 60 23.958 21.584 18.110 1.00 0.00 C ATOM 928 O GLU A 60 24.430 21.902 17.013 1.00 0.00 O ATOM 929 CB GLU A 60 23.096 19.386 19.011 1.00 0.00 C ATOM 930 CG GLU A 60 22.822 18.587 17.741 1.00 0.00 C ATOM 931 CD GLU A 60 24.012 17.674 17.438 1.00 0.00 C ATOM 932 OE1 GLU A 60 24.204 16.720 18.174 1.00 0.00 O ATOM 933 OE2 GLU A 60 24.712 17.943 16.475 1.00 0.00 O ATOM 0 H GLU A 60 24.201 20.239 20.933 1.00 0.00 H new ATOM 0 HA GLU A 60 25.070 19.764 18.206 1.00 0.00 H new ATOM 0 HB2 GLU A 60 23.262 18.709 19.849 1.00 0.00 H new ATOM 0 HB3 GLU A 60 22.228 19.996 19.262 1.00 0.00 H new ATOM 0 HG2 GLU A 60 21.917 17.992 17.863 1.00 0.00 H new ATOM 0 HG3 GLU A 60 22.649 19.264 16.904 1.00 0.00 H new ATOM 940 N ALA A 61 23.169 22.383 18.775 1.00 0.00 N ATOM 941 CA ALA A 61 22.807 23.711 18.212 1.00 0.00 C ATOM 942 C ALA A 61 24.087 24.496 17.984 1.00 0.00 C ATOM 943 O ALA A 61 24.294 25.119 16.945 1.00 0.00 O ATOM 944 CB ALA A 61 21.997 24.374 19.305 1.00 0.00 C ATOM 0 H ALA A 61 22.760 22.172 19.685 1.00 0.00 H new ATOM 0 HA ALA A 61 22.261 23.650 17.270 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.685 25.365 18.976 1.00 0.00 H new ATOM 0 HB2 ALA A 61 21.116 23.770 19.523 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.606 24.465 20.205 1.00 0.00 H new ATOM 950 N LEU A 62 24.956 24.445 18.950 1.00 0.00 N ATOM 951 CA LEU A 62 26.251 25.143 18.841 1.00 0.00 C ATOM 952 C LEU A 62 27.020 24.553 17.655 1.00 0.00 C ATOM 953 O LEU A 62 27.833 25.221 17.017 1.00 0.00 O ATOM 954 CB LEU A 62 26.945 24.830 20.171 1.00 0.00 C ATOM 955 CG LEU A 62 26.320 25.636 21.322 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.857 25.112 22.656 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.664 27.121 21.202 1.00 0.00 C ATOM 0 H LEU A 62 24.816 23.938 19.824 1.00 0.00 H new ATOM 0 HA LEU A 62 26.173 26.217 18.672 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.866 23.764 20.384 1.00 0.00 H new ATOM 0 HB3 LEU A 62 28.007 25.062 20.095 1.00 0.00 H new ATOM 0 HG LEU A 62 25.237 25.521 21.273 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.416 25.681 23.474 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.597 24.059 22.765 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.941 25.222 22.680 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.210 27.668 22.028 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.746 27.248 21.235 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.282 27.508 20.257 1.00 0.00 H new ATOM 969 N ALA A 63 26.762 23.305 17.346 1.00 0.00 N ATOM 970 CA ALA A 63 27.442 22.655 16.207 1.00 0.00 C ATOM 971 C ALA A 63 26.774 23.058 14.888 1.00 0.00 C ATOM 972 O ALA A 63 27.348 22.896 13.813 1.00 0.00 O ATOM 973 CB ALA A 63 27.294 21.152 16.452 1.00 0.00 C ATOM 0 H ALA A 63 26.100 22.711 17.846 1.00 0.00 H new ATOM 0 HA ALA A 63 28.489 22.950 16.133 1.00 0.00 H new ATOM 0 HB1 ALA A 63 27.776 20.602 15.644 1.00 0.00 H new ATOM 0 HB2 ALA A 63 27.764 20.890 17.400 1.00 0.00 H new ATOM 0 HB3 ALA A 63 26.236 20.891 16.487 1.00 0.00 H new ATOM 979 N ALA A 64 25.575 23.585 14.946 1.00 0.00 N ATOM 980 CA ALA A 64 24.890 24.001 13.677 1.00 0.00 C ATOM 981 C ALA A 64 25.425 25.341 13.200 1.00 0.00 C ATOM 982 O ALA A 64 25.007 25.881 12.178 1.00 0.00 O ATOM 983 CB ALA A 64 23.393 24.104 13.995 1.00 0.00 C ATOM 0 H ALA A 64 25.045 23.744 15.803 1.00 0.00 H new ATOM 0 HA ALA A 64 25.070 23.278 12.882 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.851 24.405 13.099 1.00 0.00 H new ATOM 0 HB2 ALA A 64 23.025 23.135 14.333 1.00 0.00 H new ATOM 0 HB3 ALA A 64 23.238 24.845 14.779 1.00 0.00 H new ATOM 989 N GLY A 65 26.339 25.872 13.928 1.00 0.00 N ATOM 990 CA GLY A 65 26.941 27.186 13.560 1.00 0.00 C ATOM 991 C GLY A 65 26.057 28.321 14.083 1.00 0.00 C ATOM 992 O GLY A 65 25.863 29.335 13.413 1.00 0.00 O ATOM 0 H GLY A 65 26.711 25.455 14.781 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.943 27.269 13.981 1.00 0.00 H new ATOM 0 HA3 GLY A 65 27.043 27.260 12.477 1.00 0.00 H new ATOM 996 N PHE A 66 25.525 28.177 15.268 1.00 0.00 N ATOM 997 CA PHE A 66 24.661 29.253 15.836 1.00 0.00 C ATOM 998 C PHE A 66 25.294 29.891 17.063 1.00 0.00 C ATOM 999 O PHE A 66 26.152 29.313 17.727 1.00 0.00 O ATOM 1000 CB PHE A 66 23.349 28.580 16.247 1.00 0.00 C ATOM 1001 CG PHE A 66 22.552 28.191 15.031 1.00 0.00 C ATOM 1002 CD1 PHE A 66 23.063 27.288 14.098 1.00 0.00 C ATOM 1003 CD2 PHE A 66 21.287 28.755 14.843 1.00 0.00 C ATOM 1004 CE1 PHE A 66 22.304 26.946 12.973 1.00 0.00 C ATOM 1005 CE2 PHE A 66 20.530 28.418 13.722 1.00 0.00 C ATOM 1006 CZ PHE A 66 21.037 27.514 12.787 1.00 0.00 C ATOM 0 H PHE A 66 25.651 27.361 15.867 1.00 0.00 H new ATOM 0 HA PHE A 66 24.514 30.041 15.097 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.560 27.696 16.849 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.765 29.258 16.870 1.00 0.00 H new ATOM 0 HD1 PHE A 66 24.041 26.854 14.244 1.00 0.00 H new ATOM 0 HD2 PHE A 66 20.895 29.453 15.568 1.00 0.00 H new ATOM 0 HE1 PHE A 66 22.694 26.245 12.250 1.00 0.00 H new ATOM 0 HE2 PHE A 66 19.553 28.855 13.577 1.00 0.00 H new ATOM 0 HZ PHE A 66 20.451 27.252 11.918 1.00 0.00 H new ATOM 1016 N ARG A 67 24.839 31.062 17.394 1.00 0.00 N ATOM 1017 CA ARG A 67 25.344 31.750 18.600 1.00 0.00 C ATOM 1018 C ARG A 67 24.313 31.528 19.706 1.00 0.00 C ATOM 1019 O ARG A 67 23.176 31.979 19.593 1.00 0.00 O ATOM 1020 CB ARG A 67 25.435 33.227 18.219 1.00 0.00 C ATOM 1021 CG ARG A 67 26.525 33.414 17.161 1.00 0.00 C ATOM 1022 CD ARG A 67 26.990 34.871 17.155 1.00 0.00 C ATOM 1023 NE ARG A 67 25.827 35.646 16.630 1.00 0.00 N ATOM 1024 CZ ARG A 67 25.820 36.955 16.686 1.00 0.00 C ATOM 1025 NH1 ARG A 67 26.829 37.608 17.203 1.00 0.00 N ATOM 1026 NH2 ARG A 67 24.794 37.614 16.222 1.00 0.00 N ATOM 0 H ARG A 67 24.129 31.575 16.871 1.00 0.00 H new ATOM 0 HA ARG A 67 26.313 31.390 18.946 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.476 33.574 17.834 1.00 0.00 H new ATOM 0 HB3 ARG A 67 25.661 33.828 19.100 1.00 0.00 H new ATOM 0 HG2 ARG A 67 27.367 32.754 17.371 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.142 33.140 16.178 1.00 0.00 H new ATOM 0 HD2 ARG A 67 27.265 35.202 18.157 1.00 0.00 H new ATOM 0 HD3 ARG A 67 27.869 35.002 16.524 1.00 0.00 H new ATOM 0 HE ARG A 67 25.032 35.153 16.225 1.00 0.00 H new ATOM 0 HH11 ARG A 67 27.633 37.098 17.568 1.00 0.00 H new ATOM 0 HH12 ARG A 67 26.811 38.627 17.241 1.00 0.00 H new ATOM 0 HH21 ARG A 67 24.004 37.110 15.819 1.00 0.00 H new ATOM 0 HH22 ARG A 67 24.782 38.633 16.262 1.00 0.00 H new ATOM 1040 N PRO A 68 24.709 30.815 20.722 1.00 0.00 N ATOM 1041 CA PRO A 68 23.771 30.510 21.825 1.00 0.00 C ATOM 1042 C PRO A 68 23.318 31.799 22.515 1.00 0.00 C ATOM 1043 O PRO A 68 24.096 32.728 22.716 1.00 0.00 O ATOM 1044 CB PRO A 68 24.581 29.585 22.735 1.00 0.00 C ATOM 1045 CG PRO A 68 26.010 29.884 22.416 1.00 0.00 C ATOM 1046 CD PRO A 68 26.043 30.249 20.958 1.00 0.00 C ATOM 0 HA PRO A 68 22.844 30.036 21.504 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.363 29.775 23.786 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.345 28.538 22.545 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.384 30.702 23.031 1.00 0.00 H new ATOM 0 HG3 PRO A 68 26.643 29.020 22.616 1.00 0.00 H new ATOM 0 HD2 PRO A 68 26.830 30.971 20.742 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.228 29.378 20.329 1.00 0.00 H new ATOM 1054 N CYS A 69 22.056 31.875 22.852 1.00 0.00 N ATOM 1055 CA CYS A 69 21.512 33.101 23.500 1.00 0.00 C ATOM 1056 C CYS A 69 22.280 33.383 24.795 1.00 0.00 C ATOM 1057 O CYS A 69 22.319 32.566 25.715 1.00 0.00 O ATOM 1058 CB CYS A 69 20.037 32.774 23.722 1.00 0.00 C ATOM 1059 SG CYS A 69 19.256 33.881 24.934 1.00 0.00 S ATOM 0 H CYS A 69 21.374 31.131 22.703 1.00 0.00 H new ATOM 0 HA CYS A 69 21.618 34.010 22.908 1.00 0.00 H new ATOM 0 HB2 CYS A 69 19.505 32.845 22.773 1.00 0.00 H new ATOM 0 HB3 CYS A 69 19.944 31.743 24.063 1.00 0.00 H new ATOM 0 HG CYS A 69 18.531 33.182 25.756 1.00 0.00 H new ATOM 1064 N LYS A 70 22.905 34.526 24.859 1.00 0.00 N ATOM 1065 CA LYS A 70 23.731 34.908 26.053 1.00 0.00 C ATOM 1066 C LYS A 70 22.982 34.723 27.374 1.00 0.00 C ATOM 1067 O LYS A 70 23.552 34.889 28.450 1.00 0.00 O ATOM 1068 CB LYS A 70 24.054 36.388 25.844 1.00 0.00 C ATOM 1069 CG LYS A 70 25.320 36.750 26.629 1.00 0.00 C ATOM 1070 CD LYS A 70 26.373 37.312 25.671 1.00 0.00 C ATOM 1071 CE LYS A 70 27.295 36.182 25.208 1.00 0.00 C ATOM 1072 NZ LYS A 70 26.865 35.884 23.813 1.00 0.00 N ATOM 0 H LYS A 70 22.881 35.230 24.121 1.00 0.00 H new ATOM 0 HA LYS A 70 24.616 34.275 26.126 1.00 0.00 H new ATOM 0 HB2 LYS A 70 24.200 36.593 24.783 1.00 0.00 H new ATOM 0 HB3 LYS A 70 23.218 37.004 26.176 1.00 0.00 H new ATOM 0 HG2 LYS A 70 25.085 37.485 27.399 1.00 0.00 H new ATOM 0 HG3 LYS A 70 25.710 35.868 27.138 1.00 0.00 H new ATOM 0 HD2 LYS A 70 25.888 37.776 24.812 1.00 0.00 H new ATOM 0 HD3 LYS A 70 26.954 38.090 26.167 1.00 0.00 H new ATOM 0 HE2 LYS A 70 28.341 36.486 25.243 1.00 0.00 H new ATOM 0 HE3 LYS A 70 27.197 35.305 25.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 27.451 35.118 23.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 25.867 35.591 23.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 26.976 36.735 23.226 1.00 0.00 H new ATOM 1086 N ARG A 71 21.728 34.405 27.323 1.00 0.00 N ATOM 1087 CA ARG A 71 20.958 34.235 28.580 1.00 0.00 C ATOM 1088 C ARG A 71 20.635 32.760 28.783 1.00 0.00 C ATOM 1089 O ARG A 71 20.638 32.235 29.897 1.00 0.00 O ATOM 1090 CB ARG A 71 19.682 35.006 28.314 1.00 0.00 C ATOM 1091 CG ARG A 71 19.151 35.591 29.625 1.00 0.00 C ATOM 1092 CD ARG A 71 18.711 37.043 29.393 1.00 0.00 C ATOM 1093 NE ARG A 71 19.796 37.879 29.984 1.00 0.00 N ATOM 1094 CZ ARG A 71 19.954 37.949 31.284 1.00 0.00 C ATOM 1095 NH1 ARG A 71 19.162 37.288 32.090 1.00 0.00 N ATOM 1096 NH2 ARG A 71 20.910 38.685 31.780 1.00 0.00 N ATOM 0 H ARG A 71 21.199 34.254 26.464 1.00 0.00 H new ATOM 0 HA ARG A 71 21.492 34.578 29.466 1.00 0.00 H new ATOM 0 HB2 ARG A 71 19.871 35.806 27.598 1.00 0.00 H new ATOM 0 HB3 ARG A 71 18.935 34.349 27.868 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.311 34.998 29.987 1.00 0.00 H new ATOM 0 HG3 ARG A 71 19.923 35.552 30.393 1.00 0.00 H new ATOM 0 HD2 ARG A 71 18.587 37.252 28.330 1.00 0.00 H new ATOM 0 HD3 ARG A 71 17.753 37.245 29.871 1.00 0.00 H new ATOM 0 HE ARG A 71 20.421 38.402 29.371 1.00 0.00 H new ATOM 0 HH11 ARG A 71 18.412 36.711 31.709 1.00 0.00 H new ATOM 0 HH12 ARG A 71 19.294 37.350 33.099 1.00 0.00 H new ATOM 0 HH21 ARG A 71 21.530 39.203 31.157 1.00 0.00 H new ATOM 0 HH22 ARG A 71 21.037 38.743 32.790 1.00 0.00 H new ATOM 1110 N CYS A 72 20.359 32.093 27.705 1.00 0.00 N ATOM 1111 CA CYS A 72 20.020 30.634 27.767 1.00 0.00 C ATOM 1112 C CYS A 72 21.292 29.782 27.714 1.00 0.00 C ATOM 1113 O CYS A 72 21.267 28.581 27.973 1.00 0.00 O ATOM 1114 CB CYS A 72 19.190 30.366 26.508 1.00 0.00 C ATOM 1115 SG CYS A 72 17.495 30.949 26.721 1.00 0.00 S ATOM 0 H CYS A 72 20.351 32.494 26.767 1.00 0.00 H new ATOM 0 HA CYS A 72 19.492 30.386 28.688 1.00 0.00 H new ATOM 0 HB2 CYS A 72 19.646 30.865 25.653 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.187 29.298 26.289 1.00 0.00 H new ATOM 0 HG CYS A 72 17.234 31.069 27.989 1.00 0.00 H new ATOM 1120 N GLN A 73 22.389 30.373 27.338 1.00 0.00 N ATOM 1121 CA GLN A 73 23.659 29.599 27.211 1.00 0.00 C ATOM 1122 C GLN A 73 24.472 29.527 28.527 1.00 0.00 C ATOM 1123 O GLN A 73 25.095 28.502 28.796 1.00 0.00 O ATOM 1124 CB GLN A 73 24.434 30.353 26.128 1.00 0.00 C ATOM 1125 CG GLN A 73 25.810 29.706 25.922 1.00 0.00 C ATOM 1126 CD GLN A 73 26.906 30.693 26.327 1.00 0.00 C ATOM 1127 OE1 GLN A 73 27.775 30.370 27.135 1.00 0.00 O ATOM 1128 NE2 GLN A 73 26.915 31.889 25.804 1.00 0.00 N ATOM 0 H GLN A 73 22.464 31.365 27.111 1.00 0.00 H new ATOM 0 HA GLN A 73 23.464 28.555 26.965 1.00 0.00 H new ATOM 0 HB2 GLN A 73 23.874 30.341 25.193 1.00 0.00 H new ATOM 0 HB3 GLN A 73 24.553 31.398 26.415 1.00 0.00 H new ATOM 0 HG2 GLN A 73 25.888 28.796 26.517 1.00 0.00 H new ATOM 0 HG3 GLN A 73 25.935 29.416 24.879 1.00 0.00 H new ATOM 0 HE21 GLN A 73 26.195 32.158 25.134 1.00 0.00 H new ATOM 0 HE22 GLN A 73 27.642 32.555 26.066 1.00 0.00 H new ATOM 1137 N PRO A 74 24.483 30.588 29.300 1.00 0.00 N ATOM 1138 CA PRO A 74 25.273 30.584 30.562 1.00 0.00 C ATOM 1139 C PRO A 74 24.635 29.695 31.639 1.00 0.00 C ATOM 1140 O PRO A 74 25.319 28.918 32.302 1.00 0.00 O ATOM 1141 CB PRO A 74 25.264 32.044 30.997 1.00 0.00 C ATOM 1142 CG PRO A 74 24.041 32.629 30.370 1.00 0.00 C ATOM 1143 CD PRO A 74 23.788 31.866 29.096 1.00 0.00 C ATOM 0 HA PRO A 74 26.275 30.182 30.415 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.231 32.132 32.083 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.164 32.560 30.663 1.00 0.00 H new ATOM 0 HG2 PRO A 74 23.187 32.549 31.043 1.00 0.00 H new ATOM 0 HG3 PRO A 74 24.184 33.689 30.162 1.00 0.00 H new ATOM 0 HD2 PRO A 74 22.722 31.717 28.926 1.00 0.00 H new ATOM 0 HD3 PRO A 74 24.178 32.398 28.228 1.00 0.00 H new ATOM 1151 N ASP A 75 23.349 29.802 31.843 1.00 0.00 N ATOM 1152 CA ASP A 75 22.688 28.971 32.900 1.00 0.00 C ATOM 1153 C ASP A 75 22.496 27.519 32.425 1.00 0.00 C ATOM 1154 O ASP A 75 22.847 27.160 31.303 1.00 0.00 O ATOM 1155 CB ASP A 75 21.338 29.653 33.164 1.00 0.00 C ATOM 1156 CG ASP A 75 20.551 29.788 31.858 1.00 0.00 C ATOM 1157 OD1 ASP A 75 21.032 29.308 30.845 1.00 0.00 O ATOM 1158 OD2 ASP A 75 19.462 30.341 31.898 1.00 0.00 O ATOM 0 H ASP A 75 22.727 30.425 31.328 1.00 0.00 H new ATOM 0 HA ASP A 75 23.293 28.911 33.805 1.00 0.00 H new ATOM 0 HB2 ASP A 75 20.763 29.072 33.885 1.00 0.00 H new ATOM 0 HB3 ASP A 75 21.499 30.637 33.604 1.00 0.00 H new ATOM 1163 N LYS A 76 21.959 26.675 33.276 1.00 0.00 N ATOM 1164 CA LYS A 76 21.750 25.237 32.915 1.00 0.00 C ATOM 1165 C LYS A 76 20.279 24.951 32.550 1.00 0.00 C ATOM 1166 O LYS A 76 19.356 25.483 33.159 1.00 0.00 O ATOM 1167 CB LYS A 76 22.146 24.475 34.177 1.00 0.00 C ATOM 1168 CG LYS A 76 23.645 24.651 34.427 1.00 0.00 C ATOM 1169 CD LYS A 76 24.436 23.735 33.486 1.00 0.00 C ATOM 1170 CE LYS A 76 25.459 24.563 32.703 1.00 0.00 C ATOM 1171 NZ LYS A 76 26.705 23.748 32.721 1.00 0.00 N ATOM 0 H LYS A 76 21.653 26.926 34.216 1.00 0.00 H new ATOM 0 HA LYS A 76 22.333 24.947 32.041 1.00 0.00 H new ATOM 0 HB2 LYS A 76 21.578 24.844 35.031 1.00 0.00 H new ATOM 0 HB3 LYS A 76 21.906 23.417 34.067 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.931 25.690 34.264 1.00 0.00 H new ATOM 0 HG3 LYS A 76 23.881 24.414 35.464 1.00 0.00 H new ATOM 0 HD2 LYS A 76 24.943 22.959 34.059 1.00 0.00 H new ATOM 0 HD3 LYS A 76 23.758 23.231 32.798 1.00 0.00 H new ATOM 0 HE2 LYS A 76 25.121 24.746 31.683 1.00 0.00 H new ATOM 0 HE3 LYS A 76 25.617 25.537 33.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 27.455 24.249 32.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 27.006 23.595 33.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 26.526 22.829 32.267 1.00 0.00 H new ATOM 1185 N ALA A 77 20.056 24.131 31.549 1.00 0.00 N ATOM 1186 CA ALA A 77 18.658 23.797 31.102 1.00 0.00 C ATOM 1187 C ALA A 77 18.034 22.723 32.030 1.00 0.00 C ATOM 1188 O ALA A 77 17.880 22.958 33.215 1.00 0.00 O ATOM 1189 CB ALA A 77 18.870 23.281 29.681 1.00 0.00 C ATOM 0 H ALA A 77 20.792 23.671 31.013 1.00 0.00 H new ATOM 0 HA ALA A 77 17.966 24.638 31.139 1.00 0.00 H new ATOM 0 HB1 ALA A 77 17.909 23.003 29.248 1.00 0.00 H new ATOM 0 HB2 ALA A 77 19.329 24.062 29.075 1.00 0.00 H new ATOM 0 HB3 ALA A 77 19.523 22.409 29.704 1.00 0.00 H new ATOM 1195 N ASN A 78 17.711 21.528 31.558 1.00 0.00 N ATOM 1196 CA ASN A 78 17.173 20.499 32.516 1.00 0.00 C ATOM 1197 C ASN A 78 18.208 20.265 33.597 1.00 0.00 C ATOM 1198 O ASN A 78 17.862 20.014 34.749 1.00 0.00 O ATOM 1199 CB ASN A 78 16.918 19.186 31.760 1.00 0.00 C ATOM 1200 CG ASN A 78 15.580 19.245 31.016 1.00 0.00 C ATOM 1201 OD1 ASN A 78 15.457 18.714 29.915 1.00 0.00 O ATOM 1202 ND2 ASN A 78 14.559 19.859 31.560 1.00 0.00 N ATOM 0 H ASN A 78 17.794 21.232 30.586 1.00 0.00 H new ATOM 0 HA ASN A 78 16.239 20.846 32.959 1.00 0.00 H new ATOM 0 HB2 ASN A 78 17.727 19.005 31.052 1.00 0.00 H new ATOM 0 HB3 ASN A 78 16.914 18.351 32.461 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.665 19.895 31.070 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.658 20.301 32.474 1.00 0.00 H new ATOM 1209 N PRO A 79 19.458 20.423 33.229 1.00 0.00 N ATOM 1210 CA PRO A 79 20.539 20.300 34.232 1.00 0.00 C ATOM 1211 C PRO A 79 20.282 21.370 35.313 1.00 0.00 C ATOM 1212 O PRO A 79 20.779 21.290 36.434 1.00 0.00 O ATOM 1213 CB PRO A 79 21.787 20.574 33.375 1.00 0.00 C ATOM 1214 CG PRO A 79 21.274 21.395 32.258 1.00 0.00 C ATOM 1215 CD PRO A 79 20.002 20.723 31.898 1.00 0.00 C ATOM 0 HA PRO A 79 20.624 19.352 34.762 1.00 0.00 H new ATOM 0 HB2 PRO A 79 22.553 21.103 33.942 1.00 0.00 H new ATOM 0 HB3 PRO A 79 22.238 19.648 33.017 1.00 0.00 H new ATOM 0 HG2 PRO A 79 21.111 22.429 32.561 1.00 0.00 H new ATOM 0 HG3 PRO A 79 21.970 21.414 31.420 1.00 0.00 H new ATOM 0 HD2 PRO A 79 19.343 21.370 31.319 1.00 0.00 H new ATOM 0 HD3 PRO A 79 20.164 19.822 31.306 1.00 0.00 H new ATOM 1223 N ARG A 80 19.470 22.363 34.980 1.00 0.00 N ATOM 1224 CA ARG A 80 19.124 23.427 35.944 1.00 0.00 C ATOM 1225 C ARG A 80 18.577 22.788 37.230 1.00 0.00 C ATOM 1226 O ARG A 80 19.205 22.846 38.291 1.00 0.00 O ATOM 1227 CB ARG A 80 18.033 24.280 35.300 1.00 0.00 C ATOM 1228 CG ARG A 80 17.985 25.647 35.985 1.00 0.00 C ATOM 1229 CD ARG A 80 16.544 26.163 35.995 1.00 0.00 C ATOM 1230 NE ARG A 80 16.659 27.643 35.838 1.00 0.00 N ATOM 1231 CZ ARG A 80 15.587 28.400 35.822 1.00 0.00 C ATOM 1232 NH1 ARG A 80 14.395 27.872 35.942 1.00 0.00 N ATOM 1233 NH2 ARG A 80 15.710 29.692 35.683 1.00 0.00 N ATOM 0 H ARG A 80 19.036 22.465 34.062 1.00 0.00 H new ATOM 0 HA ARG A 80 19.997 24.030 36.192 1.00 0.00 H new ATOM 0 HB2 ARG A 80 18.232 24.401 34.235 1.00 0.00 H new ATOM 0 HB3 ARG A 80 17.067 23.782 35.389 1.00 0.00 H new ATOM 0 HG2 ARG A 80 18.361 25.568 37.005 1.00 0.00 H new ATOM 0 HG3 ARG A 80 18.631 26.351 35.461 1.00 0.00 H new ATOM 0 HD2 ARG A 80 15.963 25.725 35.184 1.00 0.00 H new ATOM 0 HD3 ARG A 80 16.039 25.903 36.925 1.00 0.00 H new ATOM 0 HE ARG A 80 17.580 28.070 35.742 1.00 0.00 H new ATOM 0 HH11 ARG A 80 14.293 26.863 36.049 1.00 0.00 H new ATOM 0 HH12 ARG A 80 13.569 28.470 35.928 1.00 0.00 H new ATOM 0 HH21 ARG A 80 16.636 30.109 35.587 1.00 0.00 H new ATOM 0 HH22 ARG A 80 14.880 30.285 35.670 1.00 0.00 H new ATOM 1247 N GLN A 81 17.419 22.182 37.162 1.00 0.00 N ATOM 1248 CA GLN A 81 16.805 21.535 38.372 1.00 0.00 C ATOM 1249 C GLN A 81 17.803 20.616 39.114 1.00 0.00 C ATOM 1250 O GLN A 81 17.767 20.499 40.338 1.00 0.00 O ATOM 1251 CB GLN A 81 15.630 20.721 37.830 1.00 0.00 C ATOM 1252 CG GLN A 81 14.413 21.634 37.680 1.00 0.00 C ATOM 1253 CD GLN A 81 13.899 22.020 39.067 1.00 0.00 C ATOM 1254 OE1 GLN A 81 14.144 23.127 39.540 1.00 0.00 O ATOM 1255 NE2 GLN A 81 13.195 21.159 39.750 1.00 0.00 N ATOM 0 H GLN A 81 16.862 22.105 36.311 1.00 0.00 H new ATOM 0 HA GLN A 81 16.498 22.284 39.103 1.00 0.00 H new ATOM 0 HB2 GLN A 81 15.890 20.281 36.867 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.400 19.897 38.506 1.00 0.00 H new ATOM 0 HG2 GLN A 81 14.681 22.528 37.117 1.00 0.00 H new ATOM 0 HG3 GLN A 81 13.630 21.126 37.117 1.00 0.00 H new ATOM 0 HE21 GLN A 81 12.992 20.240 39.357 1.00 0.00 H new ATOM 0 HE22 GLN A 81 12.848 21.405 40.677 1.00 0.00 H new ATOM 1264 N HIS A 82 18.682 19.954 38.395 1.00 0.00 N ATOM 1265 CA HIS A 82 19.661 19.037 39.061 1.00 0.00 C ATOM 1266 C HIS A 82 20.657 19.876 39.877 1.00 0.00 C ATOM 1267 O HIS A 82 20.985 19.556 41.025 1.00 0.00 O ATOM 1268 CB HIS A 82 20.373 18.316 37.911 1.00 0.00 C ATOM 1269 CG HIS A 82 21.557 17.548 38.440 1.00 0.00 C ATOM 1270 ND1 HIS A 82 21.423 16.527 39.370 1.00 0.00 N ATOM 1271 CD2 HIS A 82 22.901 17.642 38.179 1.00 0.00 C ATOM 1272 CE1 HIS A 82 22.655 16.054 39.632 1.00 0.00 C ATOM 1273 NE2 HIS A 82 23.592 16.698 38.932 1.00 0.00 N ATOM 0 H HIS A 82 18.762 20.010 37.380 1.00 0.00 H new ATOM 0 HA HIS A 82 19.189 18.330 39.743 1.00 0.00 H new ATOM 0 HB2 HIS A 82 19.681 17.637 37.413 1.00 0.00 H new ATOM 0 HB3 HIS A 82 20.702 19.040 37.165 1.00 0.00 H new ATOM 0 HD2 HIS A 82 23.354 18.343 37.493 1.00 0.00 H new ATOM 0 HE1 HIS A 82 22.861 15.251 40.324 1.00 0.00 H new ATOM 0 HE2 HIS A 82 24.599 16.533 38.946 1.00 0.00 H new ATOM 1281 N ARG A 83 21.107 20.969 39.325 1.00 0.00 N ATOM 1282 CA ARG A 83 22.039 21.848 40.081 1.00 0.00 C ATOM 1283 C ARG A 83 21.275 22.467 41.254 1.00 0.00 C ATOM 1284 O ARG A 83 21.863 22.864 42.269 1.00 0.00 O ATOM 1285 CB ARG A 83 22.489 22.921 39.086 1.00 0.00 C ATOM 1286 CG ARG A 83 23.722 23.648 39.634 1.00 0.00 C ATOM 1287 CD ARG A 83 24.994 23.021 39.049 1.00 0.00 C ATOM 1288 NE ARG A 83 25.499 24.013 38.053 1.00 0.00 N ATOM 1289 CZ ARG A 83 26.538 23.736 37.298 1.00 0.00 C ATOM 1290 NH1 ARG A 83 27.154 22.586 37.398 1.00 0.00 N ATOM 1291 NH2 ARG A 83 26.960 24.620 36.434 1.00 0.00 N ATOM 0 H ARG A 83 20.870 21.290 38.386 1.00 0.00 H new ATOM 0 HA ARG A 83 22.900 21.316 40.486 1.00 0.00 H new ATOM 0 HB2 ARG A 83 22.722 22.464 38.124 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.682 23.633 38.914 1.00 0.00 H new ATOM 0 HG2 ARG A 83 23.676 24.706 39.378 1.00 0.00 H new ATOM 0 HG3 ARG A 83 23.740 23.584 40.722 1.00 0.00 H new ATOM 0 HD2 ARG A 83 25.734 22.833 39.827 1.00 0.00 H new ATOM 0 HD3 ARG A 83 24.779 22.063 38.576 1.00 0.00 H new ATOM 0 HE ARG A 83 25.032 24.915 37.958 1.00 0.00 H new ATOM 0 HH11 ARG A 83 26.829 21.890 38.069 1.00 0.00 H new ATOM 0 HH12 ARG A 83 27.959 22.386 36.805 1.00 0.00 H new ATOM 0 HH21 ARG A 83 26.484 25.518 36.349 1.00 0.00 H new ATOM 0 HH22 ARG A 83 27.766 24.412 35.844 1.00 0.00 H new ATOM 1305 N LEU A 84 19.963 22.528 41.161 1.00 0.00 N ATOM 1306 CA LEU A 84 19.200 23.090 42.279 1.00 0.00 C ATOM 1307 C LEU A 84 19.111 22.037 43.379 1.00 0.00 C ATOM 1308 O LEU A 84 19.159 22.352 44.573 1.00 0.00 O ATOM 1309 CB LEU A 84 17.820 23.446 41.747 1.00 0.00 C ATOM 1310 CG LEU A 84 17.702 24.969 41.635 1.00 0.00 C ATOM 1311 CD1 LEU A 84 18.104 25.661 42.960 1.00 0.00 C ATOM 1312 CD2 LEU A 84 18.623 25.437 40.518 1.00 0.00 C ATOM 0 H LEU A 84 19.412 22.213 40.363 1.00 0.00 H new ATOM 0 HA LEU A 84 19.672 23.981 42.694 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.662 22.984 40.772 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.049 23.057 42.412 1.00 0.00 H new ATOM 0 HG LEU A 84 16.666 25.233 41.421 1.00 0.00 H new ATOM 0 HD11 LEU A 84 18.010 26.741 42.849 1.00 0.00 H new ATOM 0 HD12 LEU A 84 17.449 25.320 43.762 1.00 0.00 H new ATOM 0 HD13 LEU A 84 19.136 25.410 43.203 1.00 0.00 H new ATOM 0 HD21 LEU A 84 18.555 26.520 40.420 1.00 0.00 H new ATOM 0 HD22 LEU A 84 19.650 25.158 40.752 1.00 0.00 H new ATOM 0 HD23 LEU A 84 18.325 24.969 39.580 1.00 0.00 H new ATOM 1324 N ASP A 85 19.050 20.782 43.011 1.00 0.00 N ATOM 1325 CA ASP A 85 19.034 19.719 44.056 1.00 0.00 C ATOM 1326 C ASP A 85 20.335 19.827 44.857 1.00 0.00 C ATOM 1327 O ASP A 85 20.372 19.672 46.087 1.00 0.00 O ATOM 1328 CB ASP A 85 19.001 18.407 43.278 1.00 0.00 C ATOM 1329 CG ASP A 85 17.551 17.989 43.028 1.00 0.00 C ATOM 1330 OD1 ASP A 85 16.811 18.790 42.480 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.206 16.875 43.387 1.00 0.00 O ATOM 0 H ASP A 85 19.011 20.453 42.046 1.00 0.00 H new ATOM 0 HA ASP A 85 18.193 19.796 44.746 1.00 0.00 H new ATOM 0 HB2 ASP A 85 19.524 18.523 42.329 1.00 0.00 H new ATOM 0 HB3 ASP A 85 19.522 17.629 43.836 1.00 0.00 H new ATOM 1336 N LYS A 86 21.404 20.129 44.170 1.00 0.00 N ATOM 1337 CA LYS A 86 22.725 20.289 44.852 1.00 0.00 C ATOM 1338 C LYS A 86 22.645 21.421 45.904 1.00 0.00 C ATOM 1339 O LYS A 86 23.049 21.252 47.058 1.00 0.00 O ATOM 1340 CB LYS A 86 23.704 20.645 43.730 1.00 0.00 C ATOM 1341 CG LYS A 86 25.143 20.464 44.222 1.00 0.00 C ATOM 1342 CD LYS A 86 25.720 21.817 44.641 1.00 0.00 C ATOM 1343 CE LYS A 86 26.704 21.608 45.795 1.00 0.00 C ATOM 1344 NZ LYS A 86 26.577 22.831 46.635 1.00 0.00 N ATOM 0 H LYS A 86 21.421 20.273 43.160 1.00 0.00 H new ATOM 0 HA LYS A 86 23.035 19.391 45.386 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.524 20.010 42.862 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.546 21.675 43.410 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.165 19.772 45.064 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.755 20.026 43.433 1.00 0.00 H new ATOM 0 HD2 LYS A 86 26.225 22.288 43.797 1.00 0.00 H new ATOM 0 HD3 LYS A 86 24.918 22.489 44.948 1.00 0.00 H new ATOM 0 HE2 LYS A 86 26.460 20.711 46.364 1.00 0.00 H new ATOM 0 HE3 LYS A 86 27.723 21.485 45.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 27.222 22.762 47.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 26.822 23.668 46.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 25.598 22.918 46.976 1.00 0.00 H new ATOM 1358 N ILE A 87 22.120 22.566 45.537 1.00 0.00 N ATOM 1359 CA ILE A 87 22.006 23.707 46.522 1.00 0.00 C ATOM 1360 C ILE A 87 21.195 23.263 47.764 1.00 0.00 C ATOM 1361 O ILE A 87 21.556 23.563 48.900 1.00 0.00 O ATOM 1362 CB ILE A 87 21.316 24.868 45.785 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.702 24.863 44.295 1.00 0.00 C ATOM 1364 CG2 ILE A 87 21.782 26.182 46.417 1.00 0.00 C ATOM 1365 CD1 ILE A 87 21.393 26.220 43.656 1.00 0.00 C ATOM 0 H ILE A 87 21.764 22.767 44.602 1.00 0.00 H new ATOM 0 HA ILE A 87 22.986 24.021 46.881 1.00 0.00 H new ATOM 0 HB ILE A 87 20.235 24.760 45.867 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.763 24.638 44.189 1.00 0.00 H new ATOM 0 HG13 ILE A 87 21.156 24.076 43.774 1.00 0.00 H new ATOM 0 HG21 ILE A 87 21.304 27.020 45.909 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.510 26.195 47.472 1.00 0.00 H new ATOM 0 HG23 ILE A 87 22.864 26.269 46.320 1.00 0.00 H new ATOM 0 HD11 ILE A 87 21.672 26.198 42.603 1.00 0.00 H new ATOM 0 HD12 ILE A 87 20.327 26.430 43.745 1.00 0.00 H new ATOM 0 HD13 ILE A 87 21.959 27.000 44.165 1.00 0.00 H new ATOM 1377 N THR A 88 20.130 22.520 47.585 1.00 0.00 N ATOM 1378 CA THR A 88 19.364 22.030 48.776 1.00 0.00 C ATOM 1379 C THR A 88 20.362 21.347 49.721 1.00 0.00 C ATOM 1380 O THR A 88 20.424 21.626 50.923 1.00 0.00 O ATOM 1381 CB THR A 88 18.355 21.020 48.227 1.00 0.00 C ATOM 1382 OG1 THR A 88 17.825 21.501 46.998 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.220 20.830 49.234 1.00 0.00 C ATOM 0 H THR A 88 19.761 22.234 46.678 1.00 0.00 H new ATOM 0 HA THR A 88 18.853 22.822 49.324 1.00 0.00 H new ATOM 0 HB THR A 88 18.852 20.065 48.059 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.180 20.854 46.644 1.00 0.00 H new ATOM 0 HG21 THR A 88 16.502 20.110 48.841 1.00 0.00 H new ATOM 0 HG22 THR A 88 17.627 20.460 50.175 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.721 21.784 49.404 1.00 0.00 H new ATOM 1391 N HIS A 89 21.190 20.487 49.175 1.00 0.00 N ATOM 1392 CA HIS A 89 22.234 19.826 50.016 1.00 0.00 C ATOM 1393 C HIS A 89 23.063 20.923 50.703 1.00 0.00 C ATOM 1394 O HIS A 89 23.449 20.804 51.864 1.00 0.00 O ATOM 1395 CB HIS A 89 23.091 19.019 49.041 1.00 0.00 C ATOM 1396 CG HIS A 89 23.640 17.811 49.749 1.00 0.00 C ATOM 1397 ND1 HIS A 89 22.819 16.810 50.245 1.00 0.00 N ATOM 1398 CD2 HIS A 89 24.922 17.433 50.057 1.00 0.00 C ATOM 1399 CE1 HIS A 89 23.610 15.886 50.819 1.00 0.00 C ATOM 1400 NE2 HIS A 89 24.901 16.216 50.733 1.00 0.00 N ATOM 0 H HIS A 89 21.187 20.217 48.191 1.00 0.00 H new ATOM 0 HA HIS A 89 21.821 19.180 50.791 1.00 0.00 H new ATOM 0 HB2 HIS A 89 22.495 18.712 48.182 1.00 0.00 H new ATOM 0 HB3 HIS A 89 23.906 19.634 48.660 1.00 0.00 H new ATOM 0 HD2 HIS A 89 25.812 17.994 49.812 1.00 0.00 H new ATOM 0 HE1 HIS A 89 23.245 14.986 51.292 1.00 0.00 H new ATOM 0 HE2 HIS A 89 25.700 15.690 51.087 1.00 0.00 H new ATOM 1408 N ALA A 90 23.298 22.016 50.007 1.00 0.00 N ATOM 1409 CA ALA A 90 24.050 23.163 50.606 1.00 0.00 C ATOM 1410 C ALA A 90 23.343 23.550 51.884 1.00 0.00 C ATOM 1411 O ALA A 90 23.974 23.857 52.892 1.00 0.00 O ATOM 1412 CB ALA A 90 23.959 24.325 49.584 1.00 0.00 C ATOM 0 H ALA A 90 22.997 22.160 49.043 1.00 0.00 H new ATOM 0 HA ALA A 90 25.091 22.921 50.822 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.493 25.193 49.971 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.406 24.015 48.640 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.913 24.586 49.422 1.00 0.00 H new ATOM 1418 N CYS A 91 22.032 23.506 51.880 1.00 0.00 N ATOM 1419 CA CYS A 91 21.323 23.859 53.133 1.00 0.00 C ATOM 1420 C CYS A 91 21.733 22.855 54.208 1.00 0.00 C ATOM 1421 O CYS A 91 22.106 23.223 55.324 1.00 0.00 O ATOM 1422 CB CYS A 91 19.821 23.732 52.902 1.00 0.00 C ATOM 1423 SG CYS A 91 19.006 23.940 54.516 1.00 0.00 S ATOM 0 H CYS A 91 21.444 23.249 51.087 1.00 0.00 H new ATOM 0 HA CYS A 91 21.570 24.876 53.437 1.00 0.00 H new ATOM 0 HB2 CYS A 91 19.475 24.488 52.197 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.579 22.760 52.472 1.00 0.00 H new ATOM 0 HG CYS A 91 18.911 25.206 54.794 1.00 0.00 H new ATOM 1429 N ARG A 92 21.681 21.589 53.889 1.00 0.00 N ATOM 1430 CA ARG A 92 22.078 20.549 54.889 1.00 0.00 C ATOM 1431 C ARG A 92 23.426 20.919 55.524 1.00 0.00 C ATOM 1432 O ARG A 92 23.551 21.017 56.738 1.00 0.00 O ATOM 1433 CB ARG A 92 22.200 19.254 54.088 1.00 0.00 C ATOM 1434 CG ARG A 92 21.869 18.062 54.987 1.00 0.00 C ATOM 1435 CD ARG A 92 21.232 16.956 54.145 1.00 0.00 C ATOM 1436 NE ARG A 92 21.253 15.745 55.016 1.00 0.00 N ATOM 1437 CZ ARG A 92 22.375 15.111 55.256 1.00 0.00 C ATOM 1438 NH1 ARG A 92 23.505 15.525 54.741 1.00 0.00 N ATOM 1439 NH2 ARG A 92 22.367 14.055 56.021 1.00 0.00 N ATOM 0 H ARG A 92 21.382 21.229 52.983 1.00 0.00 H new ATOM 0 HA ARG A 92 21.356 20.457 55.701 1.00 0.00 H new ATOM 0 HB2 ARG A 92 21.523 19.278 53.234 1.00 0.00 H new ATOM 0 HB3 ARG A 92 23.210 19.154 53.691 1.00 0.00 H new ATOM 0 HG2 ARG A 92 22.774 17.693 55.469 1.00 0.00 H new ATOM 0 HG3 ARG A 92 21.188 18.369 55.781 1.00 0.00 H new ATOM 0 HD2 ARG A 92 20.214 17.217 53.857 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.791 16.789 53.224 1.00 0.00 H new ATOM 0 HE ARG A 92 20.384 15.406 55.430 1.00 0.00 H new ATOM 0 HH11 ARG A 92 23.521 16.352 54.144 1.00 0.00 H new ATOM 0 HH12 ARG A 92 24.370 15.021 54.937 1.00 0.00 H new ATOM 0 HH21 ARG A 92 21.491 13.727 56.428 1.00 0.00 H new ATOM 0 HH22 ARG A 92 23.236 13.557 56.212 1.00 0.00 H new ATOM 1453 N LEU A 93 24.426 21.137 54.715 1.00 0.00 N ATOM 1454 CA LEU A 93 25.773 21.516 55.246 1.00 0.00 C ATOM 1455 C LEU A 93 25.682 22.773 56.127 1.00 0.00 C ATOM 1456 O LEU A 93 26.394 22.902 57.121 1.00 0.00 O ATOM 1457 CB LEU A 93 26.629 21.789 54.007 1.00 0.00 C ATOM 1458 CG LEU A 93 26.857 20.481 53.244 1.00 0.00 C ATOM 1459 CD1 LEU A 93 27.281 20.795 51.809 1.00 0.00 C ATOM 1460 CD2 LEU A 93 27.959 19.672 53.932 1.00 0.00 C ATOM 0 H LEU A 93 24.370 21.069 53.699 1.00 0.00 H new ATOM 0 HA LEU A 93 26.196 20.730 55.872 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.134 22.516 53.363 1.00 0.00 H new ATOM 0 HB3 LEU A 93 27.585 22.222 54.301 1.00 0.00 H new ATOM 0 HG LEU A 93 25.933 19.903 53.234 1.00 0.00 H new ATOM 0 HD11 LEU A 93 27.443 19.864 51.266 1.00 0.00 H new ATOM 0 HD12 LEU A 93 26.498 21.371 51.316 1.00 0.00 H new ATOM 0 HD13 LEU A 93 28.204 21.374 51.821 1.00 0.00 H new ATOM 0 HD21 LEU A 93 28.121 18.741 53.388 1.00 0.00 H new ATOM 0 HD22 LEU A 93 28.883 20.251 53.943 1.00 0.00 H new ATOM 0 HD23 LEU A 93 27.660 19.447 54.956 1.00 0.00 H new ATOM 1472 N LEU A 94 24.822 23.698 55.759 1.00 0.00 N ATOM 1473 CA LEU A 94 24.671 24.983 56.519 1.00 0.00 C ATOM 1474 C LEU A 94 24.047 24.704 57.900 1.00 0.00 C ATOM 1475 O LEU A 94 24.011 25.569 58.773 1.00 0.00 O ATOM 1476 CB LEU A 94 23.681 25.824 55.645 1.00 0.00 C ATOM 1477 CG LEU A 94 24.419 26.806 54.711 1.00 0.00 C ATOM 1478 CD1 LEU A 94 24.195 26.402 53.243 1.00 0.00 C ATOM 1479 CD2 LEU A 94 23.857 28.224 54.898 1.00 0.00 C ATOM 0 H LEU A 94 24.208 23.614 54.949 1.00 0.00 H new ATOM 0 HA LEU A 94 25.621 25.490 56.690 1.00 0.00 H new ATOM 0 HB2 LEU A 94 23.064 25.152 55.049 1.00 0.00 H new ATOM 0 HB3 LEU A 94 23.007 26.381 56.296 1.00 0.00 H new ATOM 0 HG LEU A 94 25.481 26.780 54.955 1.00 0.00 H new ATOM 0 HD11 LEU A 94 24.719 27.100 52.590 1.00 0.00 H new ATOM 0 HD12 LEU A 94 24.578 25.395 53.080 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.129 26.425 53.018 1.00 0.00 H new ATOM 0 HD21 LEU A 94 24.381 28.913 54.236 1.00 0.00 H new ATOM 0 HD22 LEU A 94 22.794 28.229 54.658 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.997 28.537 55.933 1.00 0.00 H new ATOM 1491 N GLU A 95 23.570 23.501 58.111 1.00 0.00 N ATOM 1492 CA GLU A 95 22.967 23.147 59.431 1.00 0.00 C ATOM 1493 C GLU A 95 23.530 21.812 59.944 1.00 0.00 C ATOM 1494 O GLU A 95 23.284 21.421 61.084 1.00 0.00 O ATOM 1495 CB GLU A 95 21.468 23.013 59.151 1.00 0.00 C ATOM 1496 CG GLU A 95 20.771 22.350 60.349 1.00 0.00 C ATOM 1497 CD GLU A 95 20.733 20.831 60.152 1.00 0.00 C ATOM 1498 OE1 GLU A 95 21.313 20.359 59.188 1.00 0.00 O ATOM 1499 OE2 GLU A 95 20.124 20.164 60.973 1.00 0.00 O ATOM 0 H GLU A 95 23.573 22.748 57.423 1.00 0.00 H new ATOM 0 HA GLU A 95 23.185 23.895 60.193 1.00 0.00 H new ATOM 0 HB2 GLU A 95 21.034 23.996 58.965 1.00 0.00 H new ATOM 0 HB3 GLU A 95 21.309 22.419 58.251 1.00 0.00 H new ATOM 0 HG2 GLU A 95 21.301 22.593 61.270 1.00 0.00 H new ATOM 0 HG3 GLU A 95 19.758 22.738 60.452 1.00 0.00 H new ATOM 1506 N GLN A 96 24.254 21.095 59.125 1.00 0.00 N ATOM 1507 CA GLN A 96 24.795 19.776 59.562 1.00 0.00 C ATOM 1508 C GLN A 96 26.179 19.915 60.203 1.00 0.00 C ATOM 1509 O GLN A 96 26.460 19.294 61.226 1.00 0.00 O ATOM 1510 CB GLN A 96 24.884 18.941 58.284 1.00 0.00 C ATOM 1511 CG GLN A 96 25.214 17.489 58.647 1.00 0.00 C ATOM 1512 CD GLN A 96 26.601 17.127 58.112 1.00 0.00 C ATOM 1513 OE1 GLN A 96 27.551 16.989 58.881 1.00 0.00 O ATOM 1514 NE2 GLN A 96 26.772 16.966 56.829 1.00 0.00 N ATOM 0 H GLN A 96 24.494 21.367 58.172 1.00 0.00 H new ATOM 0 HA GLN A 96 24.157 19.319 60.318 1.00 0.00 H new ATOM 0 HB2 GLN A 96 23.940 18.986 57.740 1.00 0.00 H new ATOM 0 HB3 GLN A 96 25.651 19.346 57.624 1.00 0.00 H new ATOM 0 HG2 GLN A 96 25.185 17.359 59.729 1.00 0.00 H new ATOM 0 HG3 GLN A 96 24.465 16.819 58.225 1.00 0.00 H new ATOM 0 HE21 GLN A 96 25.984 17.080 56.191 1.00 0.00 H new ATOM 0 HE22 GLN A 96 27.693 16.726 56.464 1.00 0.00 H new ATOM 1523 N GLU A 97 27.062 20.690 59.625 1.00 0.00 N ATOM 1524 CA GLU A 97 28.431 20.812 60.234 1.00 0.00 C ATOM 1525 C GLU A 97 28.484 21.914 61.305 1.00 0.00 C ATOM 1526 O GLU A 97 27.470 22.308 61.878 1.00 0.00 O ATOM 1527 CB GLU A 97 29.353 21.178 59.058 1.00 0.00 C ATOM 1528 CG GLU A 97 28.825 22.408 58.286 1.00 0.00 C ATOM 1529 CD GLU A 97 27.969 23.322 59.187 1.00 0.00 C ATOM 1530 OE1 GLU A 97 26.799 23.028 59.365 1.00 0.00 O ATOM 1531 OE2 GLU A 97 28.499 24.293 59.687 1.00 0.00 O ATOM 0 H GLU A 97 26.905 21.234 58.777 1.00 0.00 H new ATOM 0 HA GLU A 97 28.724 19.889 60.734 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.356 21.385 59.431 1.00 0.00 H new ATOM 0 HB3 GLU A 97 29.434 20.329 58.380 1.00 0.00 H new ATOM 0 HG2 GLU A 97 29.666 22.975 57.886 1.00 0.00 H new ATOM 0 HG3 GLU A 97 28.231 22.076 57.435 1.00 0.00 H new ATOM 1538 N THR A 98 29.659 22.445 61.545 1.00 0.00 N ATOM 1539 CA THR A 98 29.815 23.555 62.525 1.00 0.00 C ATOM 1540 C THR A 98 30.031 24.868 61.741 1.00 0.00 C ATOM 1541 O THR A 98 29.151 25.725 61.727 1.00 0.00 O ATOM 1542 CB THR A 98 31.023 23.168 63.394 1.00 0.00 C ATOM 1543 OG1 THR A 98 30.606 22.228 64.375 1.00 0.00 O ATOM 1544 CG2 THR A 98 31.602 24.406 64.086 1.00 0.00 C ATOM 0 H THR A 98 30.525 22.149 61.095 1.00 0.00 H new ATOM 0 HA THR A 98 28.944 23.711 63.162 1.00 0.00 H new ATOM 0 HB THR A 98 31.794 22.730 62.760 1.00 0.00 H new ATOM 0 HG1 THR A 98 31.372 21.975 64.932 1.00 0.00 H new ATOM 0 HG21 THR A 98 32.456 24.115 64.697 1.00 0.00 H new ATOM 0 HG22 THR A 98 31.923 25.127 63.334 1.00 0.00 H new ATOM 0 HG23 THR A 98 30.840 24.858 64.720 1.00 0.00 H new ATOM 1552 N PRO A 99 31.138 24.972 61.030 1.00 0.00 N ATOM 1553 CA PRO A 99 31.364 26.164 60.166 1.00 0.00 C ATOM 1554 C PRO A 99 30.313 26.136 59.044 1.00 0.00 C ATOM 1555 O PRO A 99 29.995 25.069 58.528 1.00 0.00 O ATOM 1556 CB PRO A 99 32.781 25.966 59.633 1.00 0.00 C ATOM 1557 CG PRO A 99 33.012 24.495 59.723 1.00 0.00 C ATOM 1558 CD PRO A 99 32.258 24.025 60.939 1.00 0.00 C ATOM 0 HA PRO A 99 31.270 27.125 60.671 1.00 0.00 H new ATOM 0 HB2 PRO A 99 32.872 26.320 58.606 1.00 0.00 H new ATOM 0 HB3 PRO A 99 33.509 26.519 60.226 1.00 0.00 H new ATOM 0 HG2 PRO A 99 32.657 23.989 58.825 1.00 0.00 H new ATOM 0 HG3 PRO A 99 34.075 24.273 59.814 1.00 0.00 H new ATOM 0 HD2 PRO A 99 31.909 22.999 60.824 1.00 0.00 H new ATOM 0 HD3 PRO A 99 32.881 24.051 61.833 1.00 0.00 H new ATOM 1566 N VAL A 100 29.750 27.249 58.657 1.00 0.00 N ATOM 1567 CA VAL A 100 28.694 27.196 57.589 1.00 0.00 C ATOM 1568 C VAL A 100 29.330 27.031 56.209 1.00 0.00 C ATOM 1569 O VAL A 100 30.470 27.427 55.979 1.00 0.00 O ATOM 1570 CB VAL A 100 27.957 28.532 57.675 1.00 0.00 C ATOM 1571 CG1 VAL A 100 26.714 28.485 56.786 1.00 0.00 C ATOM 1572 CG2 VAL A 100 27.534 28.802 59.123 1.00 0.00 C ATOM 0 H VAL A 100 29.965 28.177 59.021 1.00 0.00 H new ATOM 0 HA VAL A 100 28.022 26.350 57.733 1.00 0.00 H new ATOM 0 HB VAL A 100 28.620 29.329 57.339 1.00 0.00 H new ATOM 0 HG11 VAL A 100 26.187 29.437 56.846 1.00 0.00 H new ATOM 0 HG12 VAL A 100 27.012 28.300 55.754 1.00 0.00 H new ATOM 0 HG13 VAL A 100 26.056 27.684 57.123 1.00 0.00 H new ATOM 0 HG21 VAL A 100 27.009 29.756 59.177 1.00 0.00 H new ATOM 0 HG22 VAL A 100 26.873 28.005 59.464 1.00 0.00 H new ATOM 0 HG23 VAL A 100 28.418 28.838 59.760 1.00 0.00 H new ATOM 1582 N THR A 101 28.619 26.419 55.289 1.00 0.00 N ATOM 1583 CA THR A 101 29.201 26.198 53.933 1.00 0.00 C ATOM 1584 C THR A 101 28.486 27.022 52.858 1.00 0.00 C ATOM 1585 O THR A 101 27.442 26.653 52.324 1.00 0.00 O ATOM 1586 CB THR A 101 29.014 24.714 53.647 1.00 0.00 C ATOM 1587 OG1 THR A 101 28.262 24.114 54.694 1.00 0.00 O ATOM 1588 CG2 THR A 101 30.378 24.032 53.546 1.00 0.00 C ATOM 0 H THR A 101 27.670 26.068 55.420 1.00 0.00 H new ATOM 0 HA THR A 101 30.246 26.506 53.913 1.00 0.00 H new ATOM 0 HB THR A 101 28.480 24.597 52.704 1.00 0.00 H new ATOM 0 HG1 THR A 101 28.869 23.649 55.308 1.00 0.00 H new ATOM 0 HG21 THR A 101 30.240 22.970 53.341 1.00 0.00 H new ATOM 0 HG22 THR A 101 30.953 24.485 52.738 1.00 0.00 H new ATOM 0 HG23 THR A 101 30.916 24.153 54.486 1.00 0.00 H new ATOM 1596 N LEU A 102 29.089 28.107 52.524 1.00 0.00 N ATOM 1597 CA LEU A 102 28.592 29.013 51.476 1.00 0.00 C ATOM 1598 C LEU A 102 29.781 29.307 50.580 1.00 0.00 C ATOM 1599 O LEU A 102 29.664 29.424 49.363 1.00 0.00 O ATOM 1600 CB LEU A 102 28.121 30.272 52.205 1.00 0.00 C ATOM 1601 CG LEU A 102 26.628 30.154 52.514 1.00 0.00 C ATOM 1602 CD1 LEU A 102 26.246 31.174 53.588 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.823 30.429 51.242 1.00 0.00 C ATOM 0 H LEU A 102 29.956 28.421 52.960 1.00 0.00 H new ATOM 0 HA LEU A 102 27.776 28.610 50.876 1.00 0.00 H new ATOM 0 HB2 LEU A 102 28.685 30.403 53.128 1.00 0.00 H new ATOM 0 HB3 LEU A 102 28.307 31.152 51.590 1.00 0.00 H new ATOM 0 HG LEU A 102 26.410 29.149 52.874 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.182 31.090 53.808 1.00 0.00 H new ATOM 0 HD12 LEU A 102 26.820 30.981 54.494 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.463 32.180 53.228 1.00 0.00 H new ATOM 0 HD21 LEU A 102 24.758 30.345 51.460 1.00 0.00 H new ATOM 0 HD22 LEU A 102 26.042 31.435 50.883 1.00 0.00 H new ATOM 0 HD23 LEU A 102 26.094 29.703 50.476 1.00 0.00 H new ATOM 1615 N GLU A 103 30.948 29.414 51.189 1.00 0.00 N ATOM 1616 CA GLU A 103 32.207 29.696 50.438 1.00 0.00 C ATOM 1617 C GLU A 103 32.281 28.933 49.106 1.00 0.00 C ATOM 1618 O GLU A 103 32.655 29.506 48.087 1.00 0.00 O ATOM 1619 CB GLU A 103 33.327 29.235 51.371 1.00 0.00 C ATOM 1620 CG GLU A 103 34.633 29.945 50.998 1.00 0.00 C ATOM 1621 CD GLU A 103 35.649 28.918 50.489 1.00 0.00 C ATOM 1622 OE1 GLU A 103 35.430 28.382 49.415 1.00 0.00 O ATOM 1623 OE2 GLU A 103 36.627 28.688 51.180 1.00 0.00 O ATOM 0 H GLU A 103 31.074 29.314 52.196 1.00 0.00 H new ATOM 0 HA GLU A 103 32.274 30.751 50.174 1.00 0.00 H new ATOM 0 HB2 GLU A 103 33.065 29.454 52.406 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.454 28.155 51.297 1.00 0.00 H new ATOM 0 HG2 GLU A 103 34.444 30.696 50.231 1.00 0.00 H new ATOM 0 HG3 GLU A 103 35.034 30.469 51.865 1.00 0.00 H new ATOM 1630 N ALA A 104 31.954 27.662 49.077 1.00 0.00 N ATOM 1631 CA ALA A 104 32.044 26.920 47.781 1.00 0.00 C ATOM 1632 C ALA A 104 30.978 27.428 46.806 1.00 0.00 C ATOM 1633 O ALA A 104 31.231 27.590 45.611 1.00 0.00 O ATOM 1634 CB ALA A 104 31.782 25.457 48.141 1.00 0.00 C ATOM 0 H ALA A 104 31.635 27.116 49.878 1.00 0.00 H new ATOM 0 HA ALA A 104 33.011 27.054 47.296 1.00 0.00 H new ATOM 0 HB1 ALA A 104 31.831 24.846 47.240 1.00 0.00 H new ATOM 0 HB2 ALA A 104 32.535 25.117 48.852 1.00 0.00 H new ATOM 0 HB3 ALA A 104 30.793 25.364 48.589 1.00 0.00 H new ATOM 1640 N LEU A 105 29.790 27.688 47.287 1.00 0.00 N ATOM 1641 CA LEU A 105 28.716 28.183 46.378 1.00 0.00 C ATOM 1642 C LEU A 105 29.004 29.628 45.969 1.00 0.00 C ATOM 1643 O LEU A 105 28.998 29.965 44.789 1.00 0.00 O ATOM 1644 CB LEU A 105 27.418 28.093 47.183 1.00 0.00 C ATOM 1645 CG LEU A 105 26.524 27.003 46.582 1.00 0.00 C ATOM 1646 CD1 LEU A 105 25.854 26.215 47.705 1.00 0.00 C ATOM 1647 CD2 LEU A 105 25.449 27.648 45.703 1.00 0.00 C ATOM 0 H LEU A 105 29.519 27.580 48.264 1.00 0.00 H new ATOM 0 HA LEU A 105 28.653 27.597 45.461 1.00 0.00 H new ATOM 0 HB2 LEU A 105 27.638 27.865 48.226 1.00 0.00 H new ATOM 0 HB3 LEU A 105 26.901 29.052 47.169 1.00 0.00 H new ATOM 0 HG LEU A 105 27.133 26.330 45.978 1.00 0.00 H new ATOM 0 HD11 LEU A 105 25.218 25.440 47.277 1.00 0.00 H new ATOM 0 HD12 LEU A 105 26.617 25.753 48.331 1.00 0.00 H new ATOM 0 HD13 LEU A 105 25.247 26.888 48.310 1.00 0.00 H new ATOM 0 HD21 LEU A 105 24.814 26.872 45.276 1.00 0.00 H new ATOM 0 HD22 LEU A 105 24.842 28.322 46.307 1.00 0.00 H new ATOM 0 HD23 LEU A 105 25.925 28.210 44.899 1.00 0.00 H new ATOM 1659 N ALA A 106 29.266 30.485 46.918 1.00 0.00 N ATOM 1660 CA ALA A 106 29.564 31.908 46.580 1.00 0.00 C ATOM 1661 C ALA A 106 30.727 31.974 45.585 1.00 0.00 C ATOM 1662 O ALA A 106 30.713 32.762 44.640 1.00 0.00 O ATOM 1663 CB ALA A 106 29.957 32.559 47.906 1.00 0.00 C ATOM 0 H ALA A 106 29.287 30.262 47.913 1.00 0.00 H new ATOM 0 HA ALA A 106 28.715 32.412 46.118 1.00 0.00 H new ATOM 0 HB1 ALA A 106 30.192 33.610 47.740 1.00 0.00 H new ATOM 0 HB2 ALA A 106 29.129 32.479 48.610 1.00 0.00 H new ATOM 0 HB3 ALA A 106 30.831 32.052 48.315 1.00 0.00 H new ATOM 1669 N ASP A 107 31.729 31.157 45.779 1.00 0.00 N ATOM 1670 CA ASP A 107 32.893 31.155 44.859 1.00 0.00 C ATOM 1671 C ASP A 107 32.489 30.623 43.477 1.00 0.00 C ATOM 1672 O ASP A 107 32.987 31.083 42.451 1.00 0.00 O ATOM 1673 CB ASP A 107 33.883 30.212 45.530 1.00 0.00 C ATOM 1674 CG ASP A 107 34.795 31.003 46.471 1.00 0.00 C ATOM 1675 OD1 ASP A 107 34.340 32.002 47.003 1.00 0.00 O ATOM 1676 OD2 ASP A 107 35.931 30.596 46.642 1.00 0.00 O ATOM 0 H ASP A 107 31.786 30.486 46.545 1.00 0.00 H new ATOM 0 HA ASP A 107 33.304 32.151 44.693 1.00 0.00 H new ATOM 0 HB2 ASP A 107 33.347 29.444 46.088 1.00 0.00 H new ATOM 0 HB3 ASP A 107 34.480 29.700 44.776 1.00 0.00 H new ATOM 1681 N GLN A 108 31.609 29.656 43.430 1.00 0.00 N ATOM 1682 CA GLN A 108 31.188 29.090 42.110 1.00 0.00 C ATOM 1683 C GLN A 108 30.372 30.111 41.309 1.00 0.00 C ATOM 1684 O GLN A 108 30.518 30.222 40.094 1.00 0.00 O ATOM 1685 CB GLN A 108 30.328 27.873 42.453 1.00 0.00 C ATOM 1686 CG GLN A 108 30.176 26.987 41.212 1.00 0.00 C ATOM 1687 CD GLN A 108 28.789 27.193 40.596 1.00 0.00 C ATOM 1688 OE1 GLN A 108 28.471 28.280 40.118 1.00 0.00 O ATOM 1689 NE2 GLN A 108 27.943 26.200 40.579 1.00 0.00 N ATOM 0 H GLN A 108 31.164 29.234 44.245 1.00 0.00 H new ATOM 0 HA GLN A 108 32.048 28.828 41.493 1.00 0.00 H new ATOM 0 HB2 GLN A 108 30.788 27.307 43.263 1.00 0.00 H new ATOM 0 HB3 GLN A 108 29.348 28.195 42.805 1.00 0.00 H new ATOM 0 HG2 GLN A 108 30.948 27.231 40.482 1.00 0.00 H new ATOM 0 HG3 GLN A 108 30.312 25.940 41.482 1.00 0.00 H new ATOM 0 HE21 GLN A 108 28.207 25.298 40.976 1.00 0.00 H new ATOM 0 HE22 GLN A 108 27.017 26.325 40.169 1.00 0.00 H new ATOM 1698 N VAL A 109 29.513 30.851 41.958 1.00 0.00 N ATOM 1699 CA VAL A 109 28.685 31.855 41.220 1.00 0.00 C ATOM 1700 C VAL A 109 29.375 33.229 41.230 1.00 0.00 C ATOM 1701 O VAL A 109 29.059 34.103 40.426 1.00 0.00 O ATOM 1702 CB VAL A 109 27.337 31.917 41.952 1.00 0.00 C ATOM 1703 CG1 VAL A 109 26.234 32.271 40.952 1.00 0.00 C ATOM 1704 CG2 VAL A 109 27.010 30.563 42.590 1.00 0.00 C ATOM 0 H VAL A 109 29.348 30.806 42.963 1.00 0.00 H new ATOM 0 HA VAL A 109 28.552 31.574 40.175 1.00 0.00 H new ATOM 0 HB VAL A 109 27.398 32.675 42.733 1.00 0.00 H new ATOM 0 HG11 VAL A 109 25.275 32.316 41.469 1.00 0.00 H new ATOM 0 HG12 VAL A 109 26.449 33.240 40.501 1.00 0.00 H new ATOM 0 HG13 VAL A 109 26.191 31.510 40.173 1.00 0.00 H new ATOM 0 HG21 VAL A 109 26.051 30.625 43.105 1.00 0.00 H new ATOM 0 HG22 VAL A 109 26.957 29.799 41.815 1.00 0.00 H new ATOM 0 HG23 VAL A 109 27.789 30.300 43.305 1.00 0.00 H new ATOM 1714 N ALA A 110 30.330 33.418 42.116 1.00 0.00 N ATOM 1715 CA ALA A 110 31.093 34.713 42.197 1.00 0.00 C ATOM 1716 C ALA A 110 30.316 35.808 42.950 1.00 0.00 C ATOM 1717 O ALA A 110 30.374 36.980 42.584 1.00 0.00 O ATOM 1718 CB ALA A 110 31.352 35.142 40.748 1.00 0.00 C ATOM 0 H ALA A 110 30.618 32.717 42.799 1.00 0.00 H new ATOM 0 HA ALA A 110 32.018 34.570 42.756 1.00 0.00 H new ATOM 0 HB1 ALA A 110 31.905 36.081 40.740 1.00 0.00 H new ATOM 0 HB2 ALA A 110 31.934 34.373 40.239 1.00 0.00 H new ATOM 0 HB3 ALA A 110 30.401 35.277 40.233 1.00 0.00 H new ATOM 1724 N MET A 111 29.611 35.467 44.004 1.00 0.00 N ATOM 1725 CA MET A 111 28.868 36.528 44.771 1.00 0.00 C ATOM 1726 C MET A 111 28.936 36.303 46.292 1.00 0.00 C ATOM 1727 O MET A 111 29.242 35.215 46.775 1.00 0.00 O ATOM 1728 CB MET A 111 27.411 36.505 44.279 1.00 0.00 C ATOM 1729 CG MET A 111 26.993 35.105 43.816 1.00 0.00 C ATOM 1730 SD MET A 111 26.867 35.099 42.010 1.00 0.00 S ATOM 1731 CE MET A 111 25.439 36.200 41.877 1.00 0.00 C ATOM 0 H MET A 111 29.516 34.517 44.364 1.00 0.00 H new ATOM 0 HA MET A 111 29.328 37.500 44.593 1.00 0.00 H new ATOM 0 HB2 MET A 111 26.751 36.836 45.081 1.00 0.00 H new ATOM 0 HB3 MET A 111 27.293 37.211 43.457 1.00 0.00 H new ATOM 0 HG2 MET A 111 27.723 34.365 44.146 1.00 0.00 H new ATOM 0 HG3 MET A 111 26.037 34.830 44.262 1.00 0.00 H new ATOM 0 HE1 MET A 111 24.816 35.888 41.039 1.00 0.00 H new ATOM 0 HE2 MET A 111 24.857 36.154 42.798 1.00 0.00 H new ATOM 0 HE3 MET A 111 25.781 37.222 41.714 1.00 0.00 H new ATOM 1741 N SER A 112 28.647 37.339 47.047 1.00 0.00 N ATOM 1742 CA SER A 112 28.671 37.259 48.547 1.00 0.00 C ATOM 1743 C SER A 112 27.666 36.216 49.056 1.00 0.00 C ATOM 1744 O SER A 112 26.862 35.700 48.283 1.00 0.00 O ATOM 1745 CB SER A 112 28.275 38.660 49.022 1.00 0.00 C ATOM 1746 OG SER A 112 27.395 39.252 48.074 1.00 0.00 O ATOM 0 H SER A 112 28.390 38.255 46.680 1.00 0.00 H new ATOM 0 HA SER A 112 29.648 36.955 48.922 1.00 0.00 H new ATOM 0 HB2 SER A 112 27.790 38.602 49.997 1.00 0.00 H new ATOM 0 HB3 SER A 112 29.164 39.279 49.145 1.00 0.00 H new ATOM 0 HG SER A 112 27.140 40.148 48.379 1.00 0.00 H new ATOM 1752 N PRO A 113 27.732 35.921 50.340 1.00 0.00 N ATOM 1753 CA PRO A 113 26.804 34.913 50.932 1.00 0.00 C ATOM 1754 C PRO A 113 25.342 35.349 50.799 1.00 0.00 C ATOM 1755 O PRO A 113 24.466 34.529 50.511 1.00 0.00 O ATOM 1756 CB PRO A 113 27.252 34.835 52.393 1.00 0.00 C ATOM 1757 CG PRO A 113 27.939 36.139 52.642 1.00 0.00 C ATOM 1758 CD PRO A 113 28.633 36.487 51.352 1.00 0.00 C ATOM 0 HA PRO A 113 26.847 33.946 50.431 1.00 0.00 H new ATOM 0 HB2 PRO A 113 26.402 34.699 53.062 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.925 33.994 52.558 1.00 0.00 H new ATOM 0 HG2 PRO A 113 27.223 36.912 52.922 1.00 0.00 H new ATOM 0 HG3 PRO A 113 28.654 36.055 53.461 1.00 0.00 H new ATOM 0 HD2 PRO A 113 28.751 37.564 51.233 1.00 0.00 H new ATOM 0 HD3 PRO A 113 29.630 36.049 51.297 1.00 0.00 H new ATOM 1766 N PHE A 114 25.046 36.612 50.964 1.00 0.00 N ATOM 1767 CA PHE A 114 23.627 37.036 50.804 1.00 0.00 C ATOM 1768 C PHE A 114 23.214 36.932 49.346 1.00 0.00 C ATOM 1769 O PHE A 114 22.148 36.392 49.043 1.00 0.00 O ATOM 1770 CB PHE A 114 23.510 38.483 51.285 1.00 0.00 C ATOM 1771 CG PHE A 114 23.640 38.569 52.791 1.00 0.00 C ATOM 1772 CD1 PHE A 114 24.027 37.456 53.546 1.00 0.00 C ATOM 1773 CD2 PHE A 114 23.367 39.781 53.428 1.00 0.00 C ATOM 1774 CE1 PHE A 114 24.147 37.562 54.934 1.00 0.00 C ATOM 1775 CE2 PHE A 114 23.481 39.887 54.817 1.00 0.00 C ATOM 1776 CZ PHE A 114 23.875 38.778 55.571 1.00 0.00 C ATOM 0 H PHE A 114 25.709 37.351 51.197 1.00 0.00 H new ATOM 0 HA PHE A 114 22.970 36.392 51.389 1.00 0.00 H new ATOM 0 HB2 PHE A 114 24.284 39.089 50.815 1.00 0.00 H new ATOM 0 HB3 PHE A 114 22.550 38.896 50.976 1.00 0.00 H new ATOM 0 HD1 PHE A 114 24.233 36.516 53.056 1.00 0.00 H new ATOM 0 HD2 PHE A 114 23.067 40.639 52.846 1.00 0.00 H new ATOM 0 HE1 PHE A 114 24.450 36.704 55.516 1.00 0.00 H new ATOM 0 HE2 PHE A 114 23.265 40.825 55.307 1.00 0.00 H new ATOM 0 HZ PHE A 114 23.969 38.859 56.644 1.00 0.00 H new ATOM 1786 N HIS A 115 23.994 37.427 48.415 1.00 0.00 N ATOM 1787 CA HIS A 115 23.523 37.296 47.020 1.00 0.00 C ATOM 1788 C HIS A 115 23.595 35.820 46.562 1.00 0.00 C ATOM 1789 O HIS A 115 22.843 35.403 45.683 1.00 0.00 O ATOM 1790 CB HIS A 115 24.308 38.226 46.112 1.00 0.00 C ATOM 1791 CG HIS A 115 23.334 38.607 45.030 1.00 0.00 C ATOM 1792 ND1 HIS A 115 22.898 37.963 43.897 1.00 0.00 N flip ATOM 1793 CD2 HIS A 115 22.516 39.717 45.171 1.00 0.00 C flip ATOM 1794 CE1 HIS A 115 21.810 38.654 43.356 1.00 0.00 C flip ATOM 1795 NE2 HIS A 115 21.628 39.700 44.164 1.00 0.00 N flip ATOM 0 H HIS A 115 24.891 37.892 48.557 1.00 0.00 H new ATOM 0 HA HIS A 115 22.477 37.596 46.961 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.663 39.103 46.653 1.00 0.00 H new ATOM 0 HB3 HIS A 115 25.186 37.730 45.699 1.00 0.00 H new ATOM 0 HD2 HIS A 115 22.581 40.462 45.951 1.00 0.00 H new ATOM 0 HE1 HIS A 115 21.240 38.397 42.475 1.00 0.00 H new ATOM 0 HE2 HIS A 115 20.901 40.403 44.032 1.00 0.00 H new ATOM 1803 N LEU A 116 24.424 35.001 47.176 1.00 0.00 N ATOM 1804 CA LEU A 116 24.446 33.552 46.798 1.00 0.00 C ATOM 1805 C LEU A 116 23.084 32.975 47.175 1.00 0.00 C ATOM 1806 O LEU A 116 22.476 32.217 46.422 1.00 0.00 O ATOM 1807 CB LEU A 116 25.572 32.924 47.629 1.00 0.00 C ATOM 1808 CG LEU A 116 25.786 31.454 47.231 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.649 30.595 47.786 1.00 0.00 C ATOM 1810 CD2 LEU A 116 25.827 31.319 45.704 1.00 0.00 C ATOM 0 H LEU A 116 25.076 35.271 47.912 1.00 0.00 H new ATOM 0 HA LEU A 116 24.622 33.369 45.738 1.00 0.00 H new ATOM 0 HB2 LEU A 116 26.495 33.484 47.481 1.00 0.00 H new ATOM 0 HB3 LEU A 116 25.327 32.987 48.689 1.00 0.00 H new ATOM 0 HG LEU A 116 26.735 31.115 47.646 1.00 0.00 H new ATOM 0 HD11 LEU A 116 24.806 29.555 47.501 1.00 0.00 H new ATOM 0 HD12 LEU A 116 24.630 30.674 48.873 1.00 0.00 H new ATOM 0 HD13 LEU A 116 23.699 30.943 47.380 1.00 0.00 H new ATOM 0 HD21 LEU A 116 25.979 30.274 45.435 1.00 0.00 H new ATOM 0 HD22 LEU A 116 24.885 31.669 45.282 1.00 0.00 H new ATOM 0 HD23 LEU A 116 26.647 31.918 45.308 1.00 0.00 H new ATOM 1822 N HIS A 117 22.566 33.379 48.310 1.00 0.00 N ATOM 1823 CA HIS A 117 21.209 32.917 48.719 1.00 0.00 C ATOM 1824 C HIS A 117 20.204 33.414 47.663 1.00 0.00 C ATOM 1825 O HIS A 117 19.333 32.673 47.198 1.00 0.00 O ATOM 1826 CB HIS A 117 20.950 33.569 50.076 1.00 0.00 C ATOM 1827 CG HIS A 117 22.041 33.182 51.040 1.00 0.00 C ATOM 1828 ND1 HIS A 117 22.407 33.992 52.104 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.849 32.074 51.118 1.00 0.00 C ATOM 1830 CE1 HIS A 117 23.393 33.365 52.770 1.00 0.00 C ATOM 1831 NE2 HIS A 117 23.702 32.192 52.211 1.00 0.00 N ATOM 0 H HIS A 117 23.026 34.008 48.968 1.00 0.00 H new ATOM 0 HA HIS A 117 21.119 31.833 48.792 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.914 34.653 49.969 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.981 33.254 50.463 1.00 0.00 H new ATOM 0 HD1 HIS A 117 22.002 34.898 52.339 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.826 31.238 50.435 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.876 33.762 53.650 1.00 0.00 H new ATOM 1839 N ARG A 118 20.357 34.649 47.234 1.00 0.00 N ATOM 1840 CA ARG A 118 19.471 35.221 46.165 1.00 0.00 C ATOM 1841 C ARG A 118 19.567 34.357 44.891 1.00 0.00 C ATOM 1842 O ARG A 118 18.575 34.137 44.199 1.00 0.00 O ATOM 1843 CB ARG A 118 20.012 36.626 45.900 1.00 0.00 C ATOM 1844 CG ARG A 118 19.615 37.558 47.047 1.00 0.00 C ATOM 1845 CD ARG A 118 19.024 38.848 46.473 1.00 0.00 C ATOM 1846 NE ARG A 118 17.851 38.402 45.668 1.00 0.00 N ATOM 1847 CZ ARG A 118 16.749 38.003 46.255 1.00 0.00 C ATOM 1848 NH1 ARG A 118 16.654 37.987 47.561 1.00 0.00 N ATOM 1849 NH2 ARG A 118 15.736 37.617 45.530 1.00 0.00 N ATOM 0 H ARG A 118 21.067 35.292 47.584 1.00 0.00 H new ATOM 0 HA ARG A 118 18.423 35.244 46.464 1.00 0.00 H new ATOM 0 HB2 ARG A 118 21.097 36.596 45.803 1.00 0.00 H new ATOM 0 HB3 ARG A 118 19.618 37.006 44.957 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.887 37.068 47.693 1.00 0.00 H new ATOM 0 HG3 ARG A 118 20.485 37.786 47.663 1.00 0.00 H new ATOM 0 HD2 ARG A 118 18.723 39.533 47.266 1.00 0.00 H new ATOM 0 HD3 ARG A 118 19.751 39.376 45.855 1.00 0.00 H new ATOM 0 HE ARG A 118 17.907 38.407 44.650 1.00 0.00 H new ATOM 0 HH11 ARG A 118 17.443 38.287 48.133 1.00 0.00 H new ATOM 0 HH12 ARG A 118 15.791 37.674 48.006 1.00 0.00 H new ATOM 0 HH21 ARG A 118 15.804 37.627 44.512 1.00 0.00 H new ATOM 0 HH22 ARG A 118 14.876 37.305 45.981 1.00 0.00 H new ATOM 1863 N LEU A 119 20.735 33.819 44.591 1.00 0.00 N ATOM 1864 CA LEU A 119 20.889 32.916 43.391 1.00 0.00 C ATOM 1865 C LEU A 119 20.146 31.585 43.671 1.00 0.00 C ATOM 1866 O LEU A 119 19.394 31.085 42.838 1.00 0.00 O ATOM 1867 CB LEU A 119 22.402 32.691 43.248 1.00 0.00 C ATOM 1868 CG LEU A 119 22.707 31.756 42.064 1.00 0.00 C ATOM 1869 CD1 LEU A 119 22.549 30.301 42.506 1.00 0.00 C ATOM 1870 CD2 LEU A 119 21.754 32.042 40.896 1.00 0.00 C ATOM 0 H LEU A 119 21.590 33.967 45.127 1.00 0.00 H new ATOM 0 HA LEU A 119 20.471 33.338 42.477 1.00 0.00 H new ATOM 0 HB2 LEU A 119 22.904 33.647 43.100 1.00 0.00 H new ATOM 0 HB3 LEU A 119 22.799 32.261 44.168 1.00 0.00 H new ATOM 0 HG LEU A 119 23.731 31.931 41.734 1.00 0.00 H new ATOM 0 HD11 LEU A 119 22.765 29.640 41.667 1.00 0.00 H new ATOM 0 HD12 LEU A 119 23.242 30.091 43.321 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.527 30.133 42.846 1.00 0.00 H new ATOM 0 HD21 LEU A 119 21.983 31.372 40.067 1.00 0.00 H new ATOM 0 HD22 LEU A 119 20.725 31.882 41.218 1.00 0.00 H new ATOM 0 HD23 LEU A 119 21.876 33.076 40.572 1.00 0.00 H new ATOM 1882 N PHE A 120 20.322 31.037 44.861 1.00 0.00 N ATOM 1883 CA PHE A 120 19.611 29.762 45.273 1.00 0.00 C ATOM 1884 C PHE A 120 18.092 29.939 44.951 1.00 0.00 C ATOM 1885 O PHE A 120 17.450 29.032 44.431 1.00 0.00 O ATOM 1886 CB PHE A 120 19.925 29.687 46.824 1.00 0.00 C ATOM 1887 CG PHE A 120 19.811 28.275 47.464 1.00 0.00 C ATOM 1888 CD1 PHE A 120 19.035 27.285 46.854 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.436 27.975 48.729 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.872 26.031 47.451 1.00 0.00 C ATOM 1891 CE2 PHE A 120 20.249 26.714 49.327 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.466 25.747 48.683 1.00 0.00 C ATOM 0 H PHE A 120 20.937 31.423 45.577 1.00 0.00 H new ATOM 0 HA PHE A 120 19.919 28.847 44.767 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.935 30.062 46.991 1.00 0.00 H new ATOM 0 HB3 PHE A 120 19.245 30.360 47.347 1.00 0.00 H new ATOM 0 HD1 PHE A 120 18.555 27.491 45.909 1.00 0.00 H new ATOM 0 HD2 PHE A 120 21.048 28.718 49.218 1.00 0.00 H new ATOM 0 HE1 PHE A 120 18.281 25.275 46.955 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.708 26.493 50.279 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.321 24.779 49.140 1.00 0.00 H new ATOM 1902 N LYS A 121 17.532 31.112 45.201 1.00 0.00 N ATOM 1903 CA LYS A 121 16.078 31.374 44.865 1.00 0.00 C ATOM 1904 C LYS A 121 15.913 31.598 43.363 1.00 0.00 C ATOM 1905 O LYS A 121 14.970 31.117 42.741 1.00 0.00 O ATOM 1906 CB LYS A 121 15.723 32.679 45.568 1.00 0.00 C ATOM 1907 CG LYS A 121 14.355 33.189 45.080 1.00 0.00 C ATOM 1908 CD LYS A 121 14.476 34.652 44.640 1.00 0.00 C ATOM 1909 CE LYS A 121 13.243 35.438 45.104 1.00 0.00 C ATOM 1910 NZ LYS A 121 12.072 34.706 44.538 1.00 0.00 N ATOM 0 H LYS A 121 18.020 31.902 45.624 1.00 0.00 H new ATOM 0 HA LYS A 121 15.452 30.535 45.169 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.698 32.525 46.647 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.490 33.428 45.371 1.00 0.00 H new ATOM 0 HG2 LYS A 121 14.003 32.577 44.249 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.617 33.099 45.877 1.00 0.00 H new ATOM 0 HD2 LYS A 121 15.380 35.094 45.060 1.00 0.00 H new ATOM 0 HD3 LYS A 121 14.568 34.709 43.555 1.00 0.00 H new ATOM 0 HE2 LYS A 121 13.191 35.481 46.192 1.00 0.00 H new ATOM 0 HE3 LYS A 121 13.275 36.467 44.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.344 35.389 44.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 12.376 34.150 43.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.679 34.068 45.260 1.00 0.00 H new ATOM 1924 N ALA A 122 16.813 32.336 42.778 1.00 0.00 N ATOM 1925 CA ALA A 122 16.723 32.616 41.319 1.00 0.00 C ATOM 1926 C ALA A 122 16.682 31.299 40.548 1.00 0.00 C ATOM 1927 O ALA A 122 15.771 31.048 39.761 1.00 0.00 O ATOM 1928 CB ALA A 122 17.990 33.405 40.982 1.00 0.00 C ATOM 0 H ALA A 122 17.612 32.760 43.250 1.00 0.00 H new ATOM 0 HA ALA A 122 15.825 33.174 41.053 1.00 0.00 H new ATOM 0 HB1 ALA A 122 17.995 33.649 39.920 1.00 0.00 H new ATOM 0 HB2 ALA A 122 18.011 34.325 41.565 1.00 0.00 H new ATOM 0 HB3 ALA A 122 18.867 32.804 41.221 1.00 0.00 H new ATOM 1934 N THR A 123 17.665 30.465 40.742 1.00 0.00 N ATOM 1935 CA THR A 123 17.691 29.162 39.991 1.00 0.00 C ATOM 1936 C THR A 123 16.556 28.218 40.498 1.00 0.00 C ATOM 1937 O THR A 123 15.691 27.814 39.724 1.00 0.00 O ATOM 1938 CB THR A 123 19.089 28.591 40.254 1.00 0.00 C ATOM 1939 OG1 THR A 123 20.022 29.662 40.351 1.00 0.00 O ATOM 1940 CG2 THR A 123 19.502 27.715 39.069 1.00 0.00 C ATOM 0 H THR A 123 18.447 30.619 41.379 1.00 0.00 H new ATOM 0 HA THR A 123 17.511 29.281 38.923 1.00 0.00 H new ATOM 0 HB THR A 123 19.075 28.010 41.176 1.00 0.00 H new ATOM 0 HG1 THR A 123 20.917 29.302 40.521 1.00 0.00 H new ATOM 0 HG21 THR A 123 20.496 27.305 39.249 1.00 0.00 H new ATOM 0 HG22 THR A 123 18.788 26.899 38.953 1.00 0.00 H new ATOM 0 HG23 THR A 123 19.516 28.316 38.160 1.00 0.00 H new ATOM 1948 N THR A 124 16.496 27.921 41.786 1.00 0.00 N ATOM 1949 CA THR A 124 15.364 27.078 42.351 1.00 0.00 C ATOM 1950 C THR A 124 14.040 27.702 41.894 1.00 0.00 C ATOM 1951 O THR A 124 13.046 27.019 41.657 1.00 0.00 O ATOM 1952 CB THR A 124 15.522 27.115 43.880 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.923 25.954 44.439 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.848 28.359 44.463 1.00 0.00 C ATOM 0 H THR A 124 17.183 28.225 42.476 1.00 0.00 H new ATOM 0 HA THR A 124 15.381 26.043 42.010 1.00 0.00 H new ATOM 0 HB THR A 124 16.584 27.146 44.122 1.00 0.00 H new ATOM 0 HG1 THR A 124 15.022 25.972 45.414 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.971 28.366 45.546 1.00 0.00 H new ATOM 0 HG22 THR A 124 15.306 29.253 44.040 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.786 28.345 44.219 1.00 0.00 H new ATOM 1962 N GLY A 125 14.036 29.009 41.755 1.00 0.00 N ATOM 1963 CA GLY A 125 12.821 29.750 41.298 1.00 0.00 C ATOM 1964 C GLY A 125 12.163 30.644 42.375 1.00 0.00 C ATOM 1965 O GLY A 125 11.769 31.755 42.032 1.00 0.00 O ATOM 0 H GLY A 125 14.843 29.603 41.944 1.00 0.00 H new ATOM 0 HA2 GLY A 125 13.092 30.372 40.445 1.00 0.00 H new ATOM 0 HA3 GLY A 125 12.084 29.029 40.945 1.00 0.00 H new ATOM 1969 N MET A 126 12.030 30.287 43.640 1.00 0.00 N ATOM 1970 CA MET A 126 11.377 31.303 44.560 1.00 0.00 C ATOM 1971 C MET A 126 11.679 31.151 46.072 1.00 0.00 C ATOM 1972 O MET A 126 10.764 31.253 46.888 1.00 0.00 O ATOM 1973 CB MET A 126 9.866 31.103 44.345 1.00 0.00 C ATOM 1974 CG MET A 126 9.370 31.916 43.142 1.00 0.00 C ATOM 1975 SD MET A 126 9.068 30.815 41.734 1.00 0.00 S ATOM 1976 CE MET A 126 7.267 30.724 41.894 1.00 0.00 C ATOM 0 H MET A 126 12.320 29.403 44.058 1.00 0.00 H new ATOM 0 HA MET A 126 11.769 32.288 44.307 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.654 30.046 44.186 1.00 0.00 H new ATOM 0 HB3 MET A 126 9.324 31.405 45.241 1.00 0.00 H new ATOM 0 HG2 MET A 126 8.454 32.446 43.403 1.00 0.00 H new ATOM 0 HG3 MET A 126 10.109 32.671 42.873 1.00 0.00 H new ATOM 0 HE1 MET A 126 6.864 30.083 41.110 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.009 30.311 42.869 1.00 0.00 H new ATOM 0 HE3 MET A 126 6.842 31.723 41.800 1.00 0.00 H new ATOM 1986 N THR A 127 12.917 30.999 46.489 1.00 0.00 N ATOM 1987 CA THR A 127 13.206 30.939 47.958 1.00 0.00 C ATOM 1988 C THR A 127 14.721 30.975 48.225 1.00 0.00 C ATOM 1989 O THR A 127 15.337 29.920 48.341 1.00 0.00 O ATOM 1990 CB THR A 127 12.639 29.620 48.454 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.447 29.281 47.759 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.337 29.786 49.928 1.00 0.00 C ATOM 0 H THR A 127 13.732 30.915 45.881 1.00 0.00 H new ATOM 0 HA THR A 127 12.762 31.794 48.468 1.00 0.00 H new ATOM 0 HB THR A 127 13.359 28.820 48.283 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.813 30.027 47.814 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.927 28.856 50.322 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.255 30.033 50.462 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.612 30.589 50.063 1.00 0.00 H new ATOM 2000 N PRO A 128 15.311 32.140 48.322 1.00 0.00 N ATOM 2001 CA PRO A 128 16.781 32.172 48.536 1.00 0.00 C ATOM 2002 C PRO A 128 17.207 31.728 49.934 1.00 0.00 C ATOM 2003 O PRO A 128 16.990 30.584 50.326 1.00 0.00 O ATOM 2004 CB PRO A 128 17.121 33.643 48.262 1.00 0.00 C ATOM 2005 CG PRO A 128 15.863 34.408 48.540 1.00 0.00 C ATOM 2006 CD PRO A 128 14.704 33.479 48.285 1.00 0.00 C ATOM 0 HA PRO A 128 17.312 31.470 47.893 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.935 33.982 48.902 1.00 0.00 H new ATOM 0 HB3 PRO A 128 17.446 33.784 47.231 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.850 34.764 49.570 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.799 35.287 47.898 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.930 33.588 49.044 1.00 0.00 H new ATOM 0 HD3 PRO A 128 14.236 33.679 47.321 1.00 0.00 H new ATOM 2014 N LYS A 129 17.846 32.593 50.688 1.00 0.00 N ATOM 2015 CA LYS A 129 18.320 32.197 52.038 1.00 0.00 C ATOM 2016 C LYS A 129 17.167 31.613 52.877 1.00 0.00 C ATOM 2017 O LYS A 129 17.388 30.831 53.800 1.00 0.00 O ATOM 2018 CB LYS A 129 18.880 33.465 52.671 1.00 0.00 C ATOM 2019 CG LYS A 129 20.014 33.111 53.644 1.00 0.00 C ATOM 2020 CD LYS A 129 19.487 32.196 54.753 1.00 0.00 C ATOM 2021 CE LYS A 129 20.438 32.236 55.954 1.00 0.00 C ATOM 2022 NZ LYS A 129 19.870 33.264 56.869 1.00 0.00 N ATOM 0 H LYS A 129 18.056 33.554 50.420 1.00 0.00 H new ATOM 0 HA LYS A 129 19.079 31.417 51.983 1.00 0.00 H new ATOM 0 HB2 LYS A 129 19.251 34.135 51.895 1.00 0.00 H new ATOM 0 HB3 LYS A 129 18.089 33.997 53.200 1.00 0.00 H new ATOM 0 HG2 LYS A 129 20.823 32.616 53.107 1.00 0.00 H new ATOM 0 HG3 LYS A 129 20.429 34.021 54.078 1.00 0.00 H new ATOM 0 HD2 LYS A 129 18.490 32.514 55.056 1.00 0.00 H new ATOM 0 HD3 LYS A 129 19.397 31.175 54.383 1.00 0.00 H new ATOM 0 HE2 LYS A 129 20.496 31.263 56.443 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.450 32.499 55.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 20.470 33.346 57.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 19.833 34.181 56.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 18.909 32.984 57.152 1.00 0.00 H new ATOM 2036 N ALA A 130 15.943 31.949 52.563 1.00 0.00 N ATOM 2037 CA ALA A 130 14.795 31.376 53.344 1.00 0.00 C ATOM 2038 C ALA A 130 14.687 29.863 53.054 1.00 0.00 C ATOM 2039 O ALA A 130 14.450 29.075 53.968 1.00 0.00 O ATOM 2040 CB ALA A 130 13.551 32.111 52.836 1.00 0.00 C ATOM 0 H ALA A 130 15.685 32.587 51.810 1.00 0.00 H new ATOM 0 HA ALA A 130 14.917 31.499 54.420 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.671 31.743 53.363 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.661 33.180 53.016 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.434 31.933 51.767 1.00 0.00 H new ATOM 2046 N TRP A 131 14.919 29.413 51.820 1.00 0.00 N ATOM 2047 CA TRP A 131 14.882 27.934 51.585 1.00 0.00 C ATOM 2048 C TRP A 131 16.007 27.296 52.374 1.00 0.00 C ATOM 2049 O TRP A 131 15.871 26.185 52.894 1.00 0.00 O ATOM 2050 CB TRP A 131 15.138 27.719 50.098 1.00 0.00 C ATOM 2051 CG TRP A 131 14.069 26.876 49.468 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.280 26.113 48.373 1.00 0.00 C ATOM 2053 CD2 TRP A 131 12.668 26.665 49.851 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.105 25.466 48.040 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.085 25.770 48.918 1.00 0.00 C ATOM 2056 CE3 TRP A 131 11.847 27.154 50.889 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 10.748 25.377 49.012 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.503 26.758 50.985 1.00 0.00 C ATOM 2059 CH2 TRP A 131 9.955 25.873 50.049 1.00 0.00 C ATOM 0 H TRP A 131 15.123 29.991 51.005 1.00 0.00 H new ATOM 0 HA TRP A 131 13.929 27.501 51.889 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.185 28.684 49.593 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.107 27.240 49.961 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.217 26.023 47.843 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.004 24.839 47.242 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.256 27.839 51.617 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 10.330 24.694 48.287 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 9.888 27.139 51.787 1.00 0.00 H new ATOM 0 HH2 TRP A 131 8.920 25.574 50.129 1.00 0.00 H new ATOM 2070 N GLN A 132 17.111 27.974 52.499 1.00 0.00 N ATOM 2071 CA GLN A 132 18.241 27.400 53.286 1.00 0.00 C ATOM 2072 C GLN A 132 17.847 27.317 54.766 1.00 0.00 C ATOM 2073 O GLN A 132 18.053 26.307 55.433 1.00 0.00 O ATOM 2074 CB GLN A 132 19.396 28.385 53.091 1.00 0.00 C ATOM 2075 CG GLN A 132 20.707 27.727 53.518 1.00 0.00 C ATOM 2076 CD GLN A 132 20.886 27.880 55.028 1.00 0.00 C ATOM 2077 OE1 GLN A 132 20.843 26.822 55.789 1.00 0.00 O flip ATOM 2078 NE2 GLN A 132 21.067 28.989 55.528 1.00 0.00 N flip ATOM 0 H GLN A 132 17.282 28.895 52.094 1.00 0.00 H new ATOM 0 HA GLN A 132 18.509 26.393 52.966 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.454 28.691 52.046 1.00 0.00 H new ATOM 0 HB3 GLN A 132 19.222 29.287 53.678 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.702 26.671 53.247 1.00 0.00 H new ATOM 0 HG3 GLN A 132 21.545 28.187 52.993 1.00 0.00 H new ATOM 0 HE21 GLN A 132 21.101 29.817 54.933 1.00 0.00 H new ATOM 0 HE22 GLN A 132 21.183 29.081 56.537 1.00 0.00 H new ATOM 2087 N GLN A 133 17.280 28.367 55.288 1.00 0.00 N ATOM 2088 CA GLN A 133 16.868 28.366 56.721 1.00 0.00 C ATOM 2089 C GLN A 133 15.788 27.308 56.975 1.00 0.00 C ATOM 2090 O GLN A 133 15.880 26.512 57.911 1.00 0.00 O ATOM 2091 CB GLN A 133 16.308 29.769 56.963 1.00 0.00 C ATOM 2092 CG GLN A 133 16.395 30.109 58.451 1.00 0.00 C ATOM 2093 CD GLN A 133 15.437 31.258 58.766 1.00 0.00 C ATOM 2094 OE1 GLN A 133 15.833 32.260 59.359 1.00 0.00 O ATOM 2095 NE2 GLN A 133 14.188 31.168 58.399 1.00 0.00 N ATOM 0 H GLN A 133 17.083 29.231 54.783 1.00 0.00 H new ATOM 0 HA GLN A 133 17.698 28.128 57.387 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.868 30.500 56.380 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.272 29.820 56.628 1.00 0.00 H new ATOM 0 HG2 GLN A 133 16.141 29.235 59.051 1.00 0.00 H new ATOM 0 HG3 GLN A 133 17.415 30.390 58.712 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.860 30.337 57.907 1.00 0.00 H new ATOM 0 HE22 GLN A 133 13.540 31.929 58.604 1.00 0.00 H new ATOM 2104 N ALA A 134 14.759 27.292 56.170 1.00 0.00 N ATOM 2105 CA ALA A 134 13.663 26.298 56.375 1.00 0.00 C ATOM 2106 C ALA A 134 14.202 24.869 56.328 1.00 0.00 C ATOM 2107 O ALA A 134 14.095 24.120 57.298 1.00 0.00 O ATOM 2108 CB ALA A 134 12.686 26.539 55.223 1.00 0.00 C ATOM 0 H ALA A 134 14.629 27.924 55.380 1.00 0.00 H new ATOM 0 HA ALA A 134 13.189 26.417 57.349 1.00 0.00 H new ATOM 0 HB1 ALA A 134 11.850 25.844 55.304 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.314 27.562 55.270 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.197 26.382 54.273 1.00 0.00 H new ATOM 2114 N TRP A 135 14.787 24.476 55.231 1.00 0.00 N ATOM 2115 CA TRP A 135 15.348 23.090 55.132 1.00 0.00 C ATOM 2116 C TRP A 135 16.201 22.779 56.368 1.00 0.00 C ATOM 2117 O TRP A 135 16.100 21.721 56.968 1.00 0.00 O ATOM 2118 CB TRP A 135 16.215 23.166 53.908 1.00 0.00 C ATOM 2119 CG TRP A 135 15.393 23.293 52.685 1.00 0.00 C ATOM 2120 CD1 TRP A 135 15.921 23.590 51.498 1.00 0.00 C ATOM 2121 CD2 TRP A 135 13.959 23.115 52.478 1.00 0.00 C ATOM 2122 NE1 TRP A 135 14.913 23.631 50.551 1.00 0.00 N ATOM 2123 CE2 TRP A 135 13.682 23.337 51.108 1.00 0.00 C ATOM 2124 CE3 TRP A 135 12.881 22.793 53.328 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 12.386 23.241 50.599 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 11.578 22.696 52.818 1.00 0.00 C ATOM 2127 CH2 TRP A 135 11.331 22.918 51.456 1.00 0.00 C ATOM 0 H TRP A 135 14.903 25.051 54.396 1.00 0.00 H new ATOM 0 HA TRP A 135 14.585 22.313 55.075 1.00 0.00 H new ATOM 0 HB2 TRP A 135 16.889 24.019 53.988 1.00 0.00 H new ATOM 0 HB3 TRP A 135 16.837 22.273 53.842 1.00 0.00 H new ATOM 0 HD1 TRP A 135 16.968 23.770 51.306 1.00 0.00 H new ATOM 0 HE1 TRP A 135 15.060 23.851 49.566 1.00 0.00 H new ATOM 0 HE3 TRP A 135 13.060 22.620 54.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 12.200 23.415 49.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 10.760 22.449 53.479 1.00 0.00 H new ATOM 0 HH2 TRP A 135 10.326 22.839 51.069 1.00 0.00 H new ATOM 2138 N ARG A 136 17.026 23.704 56.746 1.00 0.00 N ATOM 2139 CA ARG A 136 17.905 23.533 57.960 1.00 0.00 C ATOM 2140 C ARG A 136 17.064 23.376 59.234 1.00 0.00 C ATOM 2141 O ARG A 136 17.488 22.755 60.207 1.00 0.00 O ATOM 2142 CB ARG A 136 18.705 24.846 57.998 1.00 0.00 C ATOM 2143 CG ARG A 136 19.064 25.234 59.440 1.00 0.00 C ATOM 2144 CD ARG A 136 20.140 26.319 59.414 1.00 0.00 C ATOM 2145 NE ARG A 136 19.865 27.173 60.607 1.00 0.00 N ATOM 2146 CZ ARG A 136 20.807 27.934 61.110 1.00 0.00 C ATOM 2147 NH1 ARG A 136 22.003 27.958 60.578 1.00 0.00 N ATOM 2148 NH2 ARG A 136 20.549 28.674 62.153 1.00 0.00 N ATOM 0 H ARG A 136 17.141 24.596 56.264 1.00 0.00 H new ATOM 0 HA ARG A 136 18.533 22.644 57.908 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.616 24.737 57.410 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.122 25.644 57.538 1.00 0.00 H new ATOM 0 HG2 ARG A 136 18.179 25.595 59.963 1.00 0.00 H new ATOM 0 HG3 ARG A 136 19.423 24.361 59.986 1.00 0.00 H new ATOM 0 HD2 ARG A 136 21.138 25.884 59.463 1.00 0.00 H new ATOM 0 HD3 ARG A 136 20.090 26.901 58.494 1.00 0.00 H new ATOM 0 HE ARG A 136 18.939 27.165 61.034 1.00 0.00 H new ATOM 0 HH11 ARG A 136 22.210 27.381 59.763 1.00 0.00 H new ATOM 0 HH12 ARG A 136 22.727 28.554 60.978 1.00 0.00 H new ATOM 0 HH21 ARG A 136 19.619 28.658 62.572 1.00 0.00 H new ATOM 0 HH22 ARG A 136 21.277 29.268 62.549 1.00 0.00 H new ATOM 2162 N ALA A 137 15.897 23.953 59.252 1.00 0.00 N ATOM 2163 CA ALA A 137 15.048 23.863 60.469 1.00 0.00 C ATOM 2164 C ALA A 137 14.258 22.556 60.471 1.00 0.00 C ATOM 2165 O ALA A 137 13.877 22.050 61.524 1.00 0.00 O ATOM 2166 CB ALA A 137 14.115 25.071 60.393 1.00 0.00 C ATOM 0 H ALA A 137 15.495 24.482 58.478 1.00 0.00 H new ATOM 0 HA ALA A 137 15.637 23.868 61.386 1.00 0.00 H new ATOM 0 HB1 ALA A 137 13.454 25.075 61.260 1.00 0.00 H new ATOM 0 HB2 ALA A 137 14.706 25.987 60.382 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.519 25.013 59.482 1.00 0.00 H new ATOM 2172 N ARG A 138 14.019 21.984 59.321 1.00 0.00 N ATOM 2173 CA ARG A 138 13.271 20.693 59.288 1.00 0.00 C ATOM 2174 C ARG A 138 14.258 19.543 59.109 1.00 0.00 C ATOM 2175 O ARG A 138 14.018 18.422 59.553 1.00 0.00 O ATOM 2176 CB ARG A 138 12.320 20.790 58.093 1.00 0.00 C ATOM 2177 CG ARG A 138 11.065 19.963 58.385 1.00 0.00 C ATOM 2178 CD ARG A 138 9.939 20.388 57.440 1.00 0.00 C ATOM 2179 NE ARG A 138 9.606 21.789 57.833 1.00 0.00 N ATOM 2180 CZ ARG A 138 8.668 22.041 58.717 1.00 0.00 C ATOM 2181 NH1 ARG A 138 7.995 21.071 59.284 1.00 0.00 N ATOM 2182 NH2 ARG A 138 8.401 23.278 59.037 1.00 0.00 N ATOM 0 H ARG A 138 14.305 22.349 58.413 1.00 0.00 H new ATOM 0 HA ARG A 138 12.718 20.509 60.209 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.051 21.830 57.910 1.00 0.00 H new ATOM 0 HB3 ARG A 138 12.810 20.424 57.191 1.00 0.00 H new ATOM 0 HG2 ARG A 138 11.279 18.902 58.258 1.00 0.00 H new ATOM 0 HG3 ARG A 138 10.757 20.104 59.421 1.00 0.00 H new ATOM 0 HD2 ARG A 138 10.258 20.336 56.399 1.00 0.00 H new ATOM 0 HD3 ARG A 138 9.073 19.734 57.541 1.00 0.00 H new ATOM 0 HE ARG A 138 10.116 22.564 57.408 1.00 0.00 H new ATOM 0 HH11 ARG A 138 8.196 20.101 59.041 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.270 21.286 59.969 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.919 24.041 58.601 1.00 0.00 H new ATOM 0 HH22 ARG A 138 7.674 23.482 59.723 1.00 0.00 H new ATOM 2196 N ARG A 139 15.365 19.798 58.470 1.00 0.00 N ATOM 2197 CA ARG A 139 16.381 18.725 58.263 1.00 0.00 C ATOM 2198 C ARG A 139 17.785 19.330 58.194 1.00 0.00 C ATOM 2199 O ARG A 139 18.572 19.056 59.086 1.00 0.00 O ATOM 2200 CB ARG A 139 15.999 18.071 56.935 1.00 0.00 C ATOM 2201 CG ARG A 139 16.606 16.665 56.865 1.00 0.00 C ATOM 2202 CD ARG A 139 15.709 15.752 56.024 1.00 0.00 C ATOM 2203 NE ARG A 139 15.118 14.798 57.009 1.00 0.00 N ATOM 2204 CZ ARG A 139 14.427 13.763 56.609 1.00 0.00 C ATOM 2205 NH1 ARG A 139 14.236 13.540 55.334 1.00 0.00 N ATOM 2206 NH2 ARG A 139 13.923 12.947 57.494 1.00 0.00 N ATOM 2207 OXT ARG A 139 18.050 20.057 57.251 1.00 0.00 O ATOM 0 H ARG A 139 15.612 20.707 58.080 1.00 0.00 H new ATOM 0 HA ARG A 139 16.395 18.002 59.079 1.00 0.00 H new ATOM 0 HB2 ARG A 139 14.914 18.015 56.843 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.359 18.676 56.103 1.00 0.00 H new ATOM 0 HG2 ARG A 139 17.604 16.711 56.429 1.00 0.00 H new ATOM 0 HG3 ARG A 139 16.716 16.256 57.869 1.00 0.00 H new ATOM 0 HD2 ARG A 139 14.935 16.321 55.509 1.00 0.00 H new ATOM 0 HD3 ARG A 139 16.282 15.228 55.259 1.00 0.00 H new ATOM 0 HE ARG A 139 15.255 14.956 58.007 1.00 0.00 H new ATOM 0 HH11 ARG A 139 14.628 14.177 54.641 1.00 0.00 H new ATOM 0 HH12 ARG A 139 13.695 12.729 55.034 1.00 0.00 H new ATOM 0 HH21 ARG A 139 14.070 13.119 58.489 1.00 0.00 H new ATOM 0 HH22 ARG A 139 13.382 12.137 57.191 1.00 0.00 H new