USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=25 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 117 HIS : no HE2:sc= -13.8! C(o=-16!,f=-19!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -155:sc= -0.959! (180deg=0) USER MOD Set 1.3: A 132 GLN : amide:sc= -0.882 K(o=-16,f=-19!) USER MOD Set 2.1: A 42 CYS SG : rot 180:sc= 0.784 USER MOD Set 2.2: A 69 CYS SG : rot -132:sc= 0.855 USER MOD Set 2.3: A 72 CYS SG : rot 122:sc= 0.0593 USER MOD Single : A 8 THR OG1 : rot 34:sc= 0.432 USER MOD Single : A 11 GLN : amide:sc= -0.293 K(o=-0.29,f=-3.3!) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 SER OG : rot 100:sc= -3.31 USER MOD Single : A 22 ASN : amide:sc= -1.89! K(o=-1.9!,f=-0.55) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -23:sc= 0.14 USER MOD Single : A 41 SER OG : rot -115:sc= 0.449 USER MOD Single : A 46 HIS : no HE2:sc= -2.99! K(o=-3!,f=-1.8) USER MOD Single : A 51 ASN : amide:sc= -2.13 X(o=-2.1,f=-2.1) USER MOD Single : A 53 SER OG : rot 141:sc= -1.85! USER MOD Single : A 55 TYR OH : rot -172:sc= -1.21 USER MOD Single : A 57 ASN : amide:sc= -5.13! C(o=-5.1!,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= -0.966 K(o=-0.97,f=-5.4!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -10.9! C(o=-11!,f=-8!) USER MOD Single : A 81 GLN : amide:sc= -0.708 K(o=-0.71,f=-6.7!) USER MOD Single : A 82 HIS : no HD1:sc= -0.192 X(o=-0.19,f=-0.41) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0795 USER MOD Single : A 89 HIS : no HD1:sc= -0.244 X(o=-0.24,f=-0.41) USER MOD Single : A 91 CYS SG : rot 124:sc= -4.2! USER MOD Single : A 96 GLN : amide:sc=-0.00504 X(o=-0.005,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -113:sc= -1.19! USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0.15) USER MOD Single : A 111 MET CE :methyl 166:sc= -15! (180deg=-15.2!) USER MOD Single : A 112 SER OG : rot 180:sc= 0.00159 USER MOD Single : A 115 HIS : no HE2:sc= -0.488 K(o=-0.49,f=-1.8) USER MOD Single : A 121 LYS NZ :NH3+ 135:sc= -0.0338 (180deg=-1.88) USER MOD Single : A 123 THR OG1 : rot -150:sc= -0.568 USER MOD Single : A 124 THR OG1 : rot 140: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= -0.641! USER MOD Single : A 133 GLN : amide:sc= -0.0552 K(o=-0.055,f=-1) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 7.737 16.316 16.942 1.00 0.00 N ATOM 119 CA THR A 8 6.620 17.257 16.987 1.00 0.00 C ATOM 120 C THR A 8 7.198 18.654 17.154 1.00 0.00 C ATOM 121 O THR A 8 6.959 19.331 18.149 1.00 0.00 O ATOM 122 CB THR A 8 5.799 16.859 18.213 1.00 0.00 C ATOM 123 OG1 THR A 8 5.545 15.462 18.178 1.00 0.00 O ATOM 124 CG2 THR A 8 4.470 17.617 18.213 1.00 0.00 C ATOM 0 HA THR A 8 6.002 17.243 16.090 1.00 0.00 H new ATOM 0 HB THR A 8 6.356 17.108 19.116 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.309 15.001 17.774 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.888 17.330 19.089 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.663 18.689 18.241 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.911 17.372 17.310 1.00 0.00 H new ATOM 132 N ASP A 9 7.946 19.106 16.181 1.00 0.00 N ATOM 133 CA ASP A 9 8.532 20.476 16.264 1.00 0.00 C ATOM 134 C ASP A 9 7.405 21.468 16.520 1.00 0.00 C ATOM 135 O ASP A 9 7.597 22.522 17.125 1.00 0.00 O ATOM 136 CB ASP A 9 9.181 20.728 14.896 1.00 0.00 C ATOM 137 CG ASP A 9 8.140 20.584 13.778 1.00 0.00 C ATOM 138 OD1 ASP A 9 7.143 19.915 13.997 1.00 0.00 O ATOM 139 OD2 ASP A 9 8.361 21.147 12.718 1.00 0.00 O ATOM 0 H ASP A 9 8.176 18.586 15.334 1.00 0.00 H new ATOM 0 HA ASP A 9 9.263 20.582 17.066 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.616 21.727 14.871 1.00 0.00 H new ATOM 0 HB3 ASP A 9 9.996 20.022 14.737 1.00 0.00 H new ATOM 144 N ASP A 10 6.220 21.126 16.092 1.00 0.00 N ATOM 145 CA ASP A 10 5.065 21.991 16.315 1.00 0.00 C ATOM 146 C ASP A 10 4.860 22.186 17.812 1.00 0.00 C ATOM 147 O ASP A 10 4.697 23.313 18.296 1.00 0.00 O ATOM 148 CB ASP A 10 3.919 21.208 15.692 1.00 0.00 C ATOM 149 CG ASP A 10 3.925 21.408 14.175 1.00 0.00 C ATOM 150 OD1 ASP A 10 4.588 20.639 13.498 1.00 0.00 O ATOM 151 OD2 ASP A 10 3.268 22.327 13.716 1.00 0.00 O ATOM 0 H ASP A 10 6.017 20.262 15.589 1.00 0.00 H new ATOM 0 HA ASP A 10 5.164 22.988 15.887 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.018 20.149 15.930 1.00 0.00 H new ATOM 0 HB3 ASP A 10 2.969 21.541 16.109 1.00 0.00 H new ATOM 156 N GLN A 11 4.899 21.130 18.584 1.00 0.00 N ATOM 157 CA GLN A 11 4.724 21.355 20.034 1.00 0.00 C ATOM 158 C GLN A 11 6.060 21.668 20.670 1.00 0.00 C ATOM 159 O GLN A 11 6.121 22.446 21.612 1.00 0.00 O ATOM 160 CB GLN A 11 4.122 20.118 20.659 1.00 0.00 C ATOM 161 CG GLN A 11 3.876 20.458 22.127 1.00 0.00 C ATOM 162 CD GLN A 11 2.387 20.334 22.461 1.00 0.00 C ATOM 163 OE1 GLN A 11 1.554 20.160 21.573 1.00 0.00 O ATOM 164 NE2 GLN A 11 2.005 20.416 23.706 1.00 0.00 N ATOM 0 H GLN A 11 5.038 20.165 18.284 1.00 0.00 H new ATOM 0 HA GLN A 11 4.056 22.201 20.197 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.191 19.844 20.162 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.796 19.267 20.564 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.455 19.789 22.764 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.219 21.472 22.335 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.695 20.560 24.443 1.00 0.00 H new ATOM 0 HE22 GLN A 11 1.016 20.336 23.942 1.00 0.00 H new ATOM 173 N ARG A 12 7.144 21.129 20.166 1.00 0.00 N ATOM 174 CA ARG A 12 8.445 21.496 20.754 1.00 0.00 C ATOM 175 C ARG A 12 8.466 23.006 20.756 1.00 0.00 C ATOM 176 O ARG A 12 8.864 23.655 21.718 1.00 0.00 O ATOM 177 CB ARG A 12 9.502 20.955 19.802 1.00 0.00 C ATOM 178 CG ARG A 12 9.623 19.432 19.926 1.00 0.00 C ATOM 179 CD ARG A 12 9.654 19.009 21.402 1.00 0.00 C ATOM 180 NE ARG A 12 10.028 17.563 21.383 1.00 0.00 N ATOM 181 CZ ARG A 12 11.250 17.192 21.081 1.00 0.00 C ATOM 182 NH1 ARG A 12 12.165 18.079 20.790 1.00 0.00 N ATOM 183 NH2 ARG A 12 11.556 15.924 21.071 1.00 0.00 N ATOM 0 H ARG A 12 7.174 20.467 19.391 1.00 0.00 H new ATOM 0 HA ARG A 12 8.616 21.108 21.758 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.244 21.221 18.777 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.464 21.419 20.019 1.00 0.00 H new ATOM 0 HG2 ARG A 12 8.783 18.953 19.423 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.530 19.092 19.426 1.00 0.00 H new ATOM 0 HD2 ARG A 12 10.379 19.597 21.966 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.684 19.159 21.876 1.00 0.00 H new ATOM 0 HE ARG A 12 9.327 16.857 21.607 1.00 0.00 H new ATOM 0 HH11 ARG A 12 11.933 19.072 20.796 1.00 0.00 H new ATOM 0 HH12 ARG A 12 13.111 17.778 20.557 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.847 15.226 21.297 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.504 15.630 20.837 1.00 0.00 H new ATOM 197 N TRP A 13 7.972 23.577 19.688 1.00 0.00 N ATOM 198 CA TRP A 13 7.901 25.041 19.625 1.00 0.00 C ATOM 199 C TRP A 13 6.927 25.526 20.684 1.00 0.00 C ATOM 200 O TRP A 13 7.183 26.504 21.379 1.00 0.00 O ATOM 201 CB TRP A 13 7.360 25.392 18.244 1.00 0.00 C ATOM 202 CG TRP A 13 7.445 26.873 18.095 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.443 27.683 17.684 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.575 27.735 18.391 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.893 28.992 17.708 1.00 0.00 N ATOM 206 CE2 TRP A 13 8.202 29.073 18.139 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.876 27.481 18.848 1.00 0.00 C ATOM 208 CZ2 TRP A 13 9.093 30.125 18.341 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.775 28.534 19.051 1.00 0.00 C ATOM 210 CH2 TRP A 13 10.386 29.853 18.803 1.00 0.00 C ATOM 0 H TRP A 13 7.620 23.084 18.868 1.00 0.00 H new ATOM 0 HA TRP A 13 8.874 25.501 19.795 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.940 24.894 17.467 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.329 25.054 18.138 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.456 27.362 17.386 1.00 0.00 H new ATOM 0 HE1 TRP A 13 6.327 29.797 17.440 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.186 26.465 19.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 8.788 31.142 18.143 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.775 28.326 19.401 1.00 0.00 H new ATOM 0 HH2 TRP A 13 11.082 30.662 18.968 1.00 0.00 H new ATOM 221 N GLN A 14 5.822 24.840 20.857 1.00 0.00 N ATOM 222 CA GLN A 14 4.876 25.280 21.913 1.00 0.00 C ATOM 223 C GLN A 14 5.604 25.192 23.257 1.00 0.00 C ATOM 224 O GLN A 14 5.355 25.967 24.176 1.00 0.00 O ATOM 225 CB GLN A 14 3.700 24.295 21.831 1.00 0.00 C ATOM 226 CG GLN A 14 2.782 24.473 23.045 1.00 0.00 C ATOM 227 CD GLN A 14 1.387 24.881 22.573 1.00 0.00 C ATOM 228 OE1 GLN A 14 1.124 26.059 22.342 1.00 0.00 O ATOM 229 NE2 GLN A 14 0.472 23.966 22.415 1.00 0.00 N ATOM 0 H GLN A 14 5.545 24.016 20.324 1.00 0.00 H new ATOM 0 HA GLN A 14 4.519 26.303 21.797 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.138 24.462 20.912 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.074 23.272 21.794 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.728 23.544 23.613 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.188 25.232 23.713 1.00 0.00 H new ATOM 0 HE21 GLN A 14 0.690 22.988 22.607 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -0.462 24.228 22.100 1.00 0.00 H new ATOM 238 N SER A 15 6.531 24.276 23.361 1.00 0.00 N ATOM 239 CA SER A 15 7.326 24.130 24.603 1.00 0.00 C ATOM 240 C SER A 15 8.377 25.230 24.654 1.00 0.00 C ATOM 241 O SER A 15 8.802 25.674 25.723 1.00 0.00 O ATOM 242 CB SER A 15 7.991 22.760 24.488 1.00 0.00 C ATOM 243 OG SER A 15 8.548 22.403 25.746 1.00 0.00 O ATOM 0 H SER A 15 6.770 23.615 22.622 1.00 0.00 H new ATOM 0 HA SER A 15 6.721 24.208 25.506 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.261 22.013 24.175 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.770 22.783 23.726 1.00 0.00 H new ATOM 0 HG SER A 15 7.944 21.784 26.207 1.00 0.00 H new ATOM 249 N VAL A 16 8.807 25.675 23.507 1.00 0.00 N ATOM 250 CA VAL A 16 9.844 26.734 23.463 1.00 0.00 C ATOM 251 C VAL A 16 9.251 28.093 23.741 1.00 0.00 C ATOM 252 O VAL A 16 9.901 28.999 24.260 1.00 0.00 O ATOM 253 CB VAL A 16 10.418 26.678 22.045 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.421 27.799 21.858 1.00 0.00 C ATOM 255 CG2 VAL A 16 11.132 25.354 21.808 1.00 0.00 C ATOM 0 H VAL A 16 8.482 25.348 22.597 1.00 0.00 H new ATOM 0 HA VAL A 16 10.609 26.574 24.223 1.00 0.00 H new ATOM 0 HB VAL A 16 9.594 26.780 21.339 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.829 27.758 20.848 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.927 28.759 22.011 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.230 27.688 22.580 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.533 25.333 20.795 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.947 25.247 22.523 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.427 24.532 21.936 1.00 0.00 H new ATOM 265 N LEU A 17 8.041 28.242 23.394 1.00 0.00 N ATOM 266 CA LEU A 17 7.349 29.518 23.601 1.00 0.00 C ATOM 267 C LEU A 17 6.685 29.505 24.960 1.00 0.00 C ATOM 268 O LEU A 17 6.545 30.524 25.634 1.00 0.00 O ATOM 269 CB LEU A 17 6.326 29.510 22.488 1.00 0.00 C ATOM 270 CG LEU A 17 7.002 29.378 21.110 1.00 0.00 C ATOM 271 CD1 LEU A 17 6.262 30.253 20.117 1.00 0.00 C ATOM 272 CD2 LEU A 17 8.478 29.810 21.143 1.00 0.00 C ATOM 0 H LEU A 17 7.474 27.514 22.960 1.00 0.00 H new ATOM 0 HA LEU A 17 7.990 30.399 23.580 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.631 28.683 22.636 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.741 30.429 22.522 1.00 0.00 H new ATOM 0 HG LEU A 17 6.966 28.328 20.819 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.731 30.168 19.137 1.00 0.00 H new ATOM 0 HD12 LEU A 17 5.223 29.930 20.051 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.299 31.291 20.448 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.912 29.699 20.149 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.545 30.852 21.454 1.00 0.00 H new ATOM 0 HD23 LEU A 17 9.024 29.185 21.849 1.00 0.00 H new ATOM 284 N ALA A 18 6.284 28.348 25.366 1.00 0.00 N ATOM 285 CA ALA A 18 5.626 28.200 26.687 1.00 0.00 C ATOM 286 C ALA A 18 6.652 28.367 27.810 1.00 0.00 C ATOM 287 O ALA A 18 6.320 28.859 28.875 1.00 0.00 O ATOM 288 CB ALA A 18 5.053 26.784 26.695 1.00 0.00 C ATOM 0 H ALA A 18 6.383 27.483 24.835 1.00 0.00 H new ATOM 0 HA ALA A 18 4.853 28.952 26.846 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.549 26.601 27.644 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.339 26.676 25.878 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.861 26.064 26.568 1.00 0.00 H new ATOM 294 N ARG A 19 7.880 27.946 27.572 1.00 0.00 N ATOM 295 CA ARG A 19 8.992 28.027 28.595 1.00 0.00 C ATOM 296 C ARG A 19 8.966 26.756 29.425 1.00 0.00 C ATOM 297 O ARG A 19 9.312 26.746 30.603 1.00 0.00 O ATOM 298 CB ARG A 19 8.782 29.276 29.486 1.00 0.00 C ATOM 299 CG ARG A 19 7.847 28.974 30.671 1.00 0.00 C ATOM 300 CD ARG A 19 7.088 30.246 31.062 1.00 0.00 C ATOM 301 NE ARG A 19 6.807 30.095 32.519 1.00 0.00 N ATOM 302 CZ ARG A 19 6.545 31.143 33.266 1.00 0.00 C ATOM 303 NH1 ARG A 19 6.525 32.347 32.752 1.00 0.00 N ATOM 304 NH2 ARG A 19 6.304 30.984 34.538 1.00 0.00 N ATOM 0 H ARG A 19 8.168 27.536 26.683 1.00 0.00 H new ATOM 0 HA ARG A 19 9.962 28.119 28.107 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.745 29.623 29.861 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.363 30.085 28.887 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.143 28.187 30.401 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.425 28.608 31.519 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.684 31.137 30.865 1.00 0.00 H new ATOM 0 HD3 ARG A 19 6.165 30.347 30.490 1.00 0.00 H new ATOM 0 HE ARG A 19 6.818 29.166 32.941 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.714 32.481 31.759 1.00 0.00 H new ATOM 0 HH12 ARG A 19 6.320 33.151 33.345 1.00 0.00 H new ATOM 0 HH21 ARG A 19 6.320 30.050 34.947 1.00 0.00 H new ATOM 0 HH22 ARG A 19 6.100 31.794 35.124 1.00 0.00 H new ATOM 318 N ASP A 20 8.559 25.679 28.820 1.00 0.00 N ATOM 319 CA ASP A 20 8.492 24.394 29.551 1.00 0.00 C ATOM 320 C ASP A 20 9.884 23.977 30.033 1.00 0.00 C ATOM 321 O ASP A 20 10.727 23.574 29.235 1.00 0.00 O ATOM 322 CB ASP A 20 7.959 23.394 28.527 1.00 0.00 C ATOM 323 CG ASP A 20 7.610 22.081 29.226 1.00 0.00 C ATOM 324 OD1 ASP A 20 7.107 22.139 30.336 1.00 0.00 O ATOM 325 OD2 ASP A 20 7.852 21.037 28.641 1.00 0.00 O ATOM 0 H ASP A 20 8.268 25.637 27.843 1.00 0.00 H new ATOM 0 HA ASP A 20 7.860 24.455 30.437 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.077 23.800 28.032 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.706 23.218 27.753 1.00 0.00 H new ATOM 330 N PRO A 21 10.081 24.049 31.325 1.00 0.00 N ATOM 331 CA PRO A 21 11.373 23.636 31.918 1.00 0.00 C ATOM 332 C PRO A 21 11.448 22.106 31.922 1.00 0.00 C ATOM 333 O PRO A 21 12.361 21.508 32.487 1.00 0.00 O ATOM 334 CB PRO A 21 11.316 24.180 33.341 1.00 0.00 C ATOM 335 CG PRO A 21 9.859 24.286 33.657 1.00 0.00 C ATOM 336 CD PRO A 21 9.134 24.513 32.355 1.00 0.00 C ATOM 0 HA PRO A 21 12.245 24.003 31.376 1.00 0.00 H new ATOM 0 HB2 PRO A 21 11.824 23.514 34.039 1.00 0.00 H new ATOM 0 HB3 PRO A 21 11.807 25.151 33.412 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.504 23.377 34.141 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.674 25.108 34.348 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.199 23.953 32.317 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.881 25.565 32.218 1.00 0.00 H new ATOM 344 N ASN A 22 10.478 21.467 31.318 1.00 0.00 N ATOM 345 CA ASN A 22 10.433 19.998 31.287 1.00 0.00 C ATOM 346 C ASN A 22 10.859 19.513 29.917 1.00 0.00 C ATOM 347 O ASN A 22 11.160 18.340 29.707 1.00 0.00 O ATOM 348 CB ASN A 22 8.960 19.750 31.499 1.00 0.00 C ATOM 349 CG ASN A 22 8.650 18.284 31.273 1.00 0.00 C ATOM 350 OD1 ASN A 22 8.495 17.510 32.216 1.00 0.00 O ATOM 351 ND2 ASN A 22 8.556 17.866 30.049 1.00 0.00 N ATOM 0 H ASN A 22 9.703 21.925 30.838 1.00 0.00 H new ATOM 0 HA ASN A 22 11.079 19.498 32.009 1.00 0.00 H new ATOM 0 HB2 ASN A 22 8.675 20.040 32.510 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.376 20.365 30.814 1.00 0.00 H new ATOM 0 HD21 ASN A 22 8.351 16.885 29.859 1.00 0.00 H new ATOM 0 HD22 ASN A 22 8.687 18.518 29.276 1.00 0.00 H new ATOM 358 N ALA A 23 10.946 20.420 29.005 1.00 0.00 N ATOM 359 CA ALA A 23 11.421 20.058 27.654 1.00 0.00 C ATOM 360 C ALA A 23 12.794 20.672 27.464 1.00 0.00 C ATOM 361 O ALA A 23 13.496 20.435 26.473 1.00 0.00 O ATOM 362 CB ALA A 23 10.446 20.689 26.682 1.00 0.00 C ATOM 0 H ALA A 23 10.708 21.403 29.135 1.00 0.00 H new ATOM 0 HA ALA A 23 11.481 18.980 27.505 1.00 0.00 H new ATOM 0 HB1 ALA A 23 10.747 20.455 25.661 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.445 20.297 26.864 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.443 21.770 26.820 1.00 0.00 H new ATOM 368 N ASP A 24 13.189 21.446 28.429 1.00 0.00 N ATOM 369 CA ASP A 24 14.503 22.090 28.389 1.00 0.00 C ATOM 370 C ASP A 24 15.505 21.007 28.759 1.00 0.00 C ATOM 371 O ASP A 24 15.322 20.309 29.733 1.00 0.00 O ATOM 372 CB ASP A 24 14.382 23.183 29.467 1.00 0.00 C ATOM 373 CG ASP A 24 15.417 24.280 29.254 1.00 0.00 C ATOM 374 OD1 ASP A 24 16.101 24.229 28.257 1.00 0.00 O ATOM 375 OD2 ASP A 24 15.498 25.162 30.094 1.00 0.00 O ATOM 0 H ASP A 24 12.635 21.658 29.259 1.00 0.00 H new ATOM 0 HA ASP A 24 14.814 22.523 27.438 1.00 0.00 H new ATOM 0 HB2 ASP A 24 13.381 23.613 29.442 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.514 22.741 30.454 1.00 0.00 H new ATOM 380 N GLY A 25 16.515 20.805 27.972 1.00 0.00 N ATOM 381 CA GLY A 25 17.483 19.690 28.263 1.00 0.00 C ATOM 382 C GLY A 25 17.104 18.539 27.324 1.00 0.00 C ATOM 383 O GLY A 25 17.929 17.705 26.956 1.00 0.00 O ATOM 0 H GLY A 25 16.723 21.355 27.139 1.00 0.00 H new ATOM 0 HA2 GLY A 25 18.510 20.011 28.090 1.00 0.00 H new ATOM 0 HA3 GLY A 25 17.417 19.380 29.306 1.00 0.00 H new ATOM 387 N GLU A 26 15.856 18.512 26.905 1.00 0.00 N ATOM 388 CA GLU A 26 15.384 17.469 25.970 1.00 0.00 C ATOM 389 C GLU A 26 15.648 17.927 24.530 1.00 0.00 C ATOM 390 O GLU A 26 16.144 17.165 23.707 1.00 0.00 O ATOM 391 CB GLU A 26 13.882 17.339 26.232 1.00 0.00 C ATOM 392 CG GLU A 26 13.387 15.990 25.706 1.00 0.00 C ATOM 393 CD GLU A 26 13.221 15.015 26.875 1.00 0.00 C ATOM 394 OE1 GLU A 26 14.226 14.631 27.449 1.00 0.00 O ATOM 395 OE2 GLU A 26 12.090 14.669 27.175 1.00 0.00 O ATOM 0 H GLU A 26 15.143 19.186 27.184 1.00 0.00 H new ATOM 0 HA GLU A 26 15.893 16.515 26.110 1.00 0.00 H new ATOM 0 HB2 GLU A 26 13.680 17.421 27.300 1.00 0.00 H new ATOM 0 HB3 GLU A 26 13.345 18.151 25.742 1.00 0.00 H new ATOM 0 HG2 GLU A 26 12.437 16.117 25.187 1.00 0.00 H new ATOM 0 HG3 GLU A 26 14.095 15.588 24.981 1.00 0.00 H new ATOM 402 N PHE A 27 15.344 19.168 24.216 1.00 0.00 N ATOM 403 CA PHE A 27 15.612 19.677 22.831 1.00 0.00 C ATOM 404 C PHE A 27 15.944 21.159 22.858 1.00 0.00 C ATOM 405 O PHE A 27 15.790 21.848 23.865 1.00 0.00 O ATOM 406 CB PHE A 27 14.355 19.452 21.989 1.00 0.00 C ATOM 407 CG PHE A 27 13.304 20.523 22.237 1.00 0.00 C ATOM 408 CD1 PHE A 27 12.517 20.473 23.390 1.00 0.00 C ATOM 409 CD2 PHE A 27 13.088 21.542 21.287 1.00 0.00 C ATOM 410 CE1 PHE A 27 11.511 21.430 23.599 1.00 0.00 C ATOM 411 CE2 PHE A 27 12.087 22.503 21.510 1.00 0.00 C ATOM 412 CZ PHE A 27 11.300 22.437 22.662 1.00 0.00 C ATOM 0 H PHE A 27 14.925 19.845 24.854 1.00 0.00 H new ATOM 0 HA PHE A 27 16.463 19.145 22.406 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.623 19.445 20.932 1.00 0.00 H new ATOM 0 HB3 PHE A 27 13.936 18.472 22.218 1.00 0.00 H new ATOM 0 HD1 PHE A 27 12.683 19.697 24.122 1.00 0.00 H new ATOM 0 HD2 PHE A 27 13.690 21.584 20.391 1.00 0.00 H new ATOM 0 HE1 PHE A 27 10.900 21.384 24.488 1.00 0.00 H new ATOM 0 HE2 PHE A 27 11.926 23.292 20.791 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.525 23.171 22.826 1.00 0.00 H new ATOM 422 N VAL A 28 16.376 21.645 21.748 1.00 0.00 N ATOM 423 CA VAL A 28 16.719 23.081 21.616 1.00 0.00 C ATOM 424 C VAL A 28 15.982 23.621 20.427 1.00 0.00 C ATOM 425 O VAL A 28 15.353 22.877 19.681 1.00 0.00 O ATOM 426 CB VAL A 28 18.227 23.173 21.360 1.00 0.00 C ATOM 427 CG1 VAL A 28 18.892 21.858 21.697 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.508 23.459 19.894 1.00 0.00 C ATOM 0 H VAL A 28 16.512 21.097 20.898 1.00 0.00 H new ATOM 0 HA VAL A 28 16.451 23.644 22.510 1.00 0.00 H new ATOM 0 HB VAL A 28 18.617 23.978 21.983 1.00 0.00 H new ATOM 0 HG11 VAL A 28 19.963 21.934 21.512 1.00 0.00 H new ATOM 0 HG12 VAL A 28 18.721 21.623 22.748 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.471 21.068 21.075 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.585 23.520 19.735 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.096 22.657 19.281 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.045 24.405 19.613 1.00 0.00 H new ATOM 438 N PHE A 29 16.094 24.876 20.195 1.00 0.00 N ATOM 439 CA PHE A 29 15.449 25.424 18.998 1.00 0.00 C ATOM 440 C PHE A 29 16.387 26.406 18.340 1.00 0.00 C ATOM 441 O PHE A 29 16.888 27.339 18.957 1.00 0.00 O ATOM 442 CB PHE A 29 14.110 26.003 19.438 1.00 0.00 C ATOM 443 CG PHE A 29 14.125 27.513 19.635 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.937 28.375 18.542 1.00 0.00 C ATOM 445 CD2 PHE A 29 14.243 28.048 20.925 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.879 29.764 18.745 1.00 0.00 C ATOM 447 CE2 PHE A 29 14.173 29.434 21.122 1.00 0.00 C ATOM 448 CZ PHE A 29 13.993 30.289 20.035 1.00 0.00 C ATOM 0 H PHE A 29 16.600 25.545 20.776 1.00 0.00 H new ATOM 0 HA PHE A 29 15.240 24.675 18.235 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.354 25.751 18.694 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.809 25.528 20.372 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.837 27.970 17.546 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.388 27.391 21.769 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.746 30.427 17.903 1.00 0.00 H new ATOM 0 HE2 PHE A 29 14.259 29.841 22.119 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.942 31.357 20.190 1.00 0.00 H new ATOM 458 N ALA A 30 16.681 26.143 17.110 1.00 0.00 N ATOM 459 CA ALA A 30 17.668 26.978 16.373 1.00 0.00 C ATOM 460 C ALA A 30 17.025 27.955 15.401 1.00 0.00 C ATOM 461 O ALA A 30 16.421 27.575 14.400 1.00 0.00 O ATOM 462 CB ALA A 30 18.526 25.974 15.607 1.00 0.00 C ATOM 0 H ALA A 30 16.278 25.377 16.571 1.00 0.00 H new ATOM 0 HA ALA A 30 18.233 27.599 17.069 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.284 26.507 15.033 1.00 0.00 H new ATOM 0 HB2 ALA A 30 19.012 25.299 16.311 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.895 25.399 14.929 1.00 0.00 H new ATOM 468 N VAL A 31 17.199 29.213 15.666 1.00 0.00 N ATOM 469 CA VAL A 31 16.669 30.260 14.765 1.00 0.00 C ATOM 470 C VAL A 31 17.756 30.555 13.719 1.00 0.00 C ATOM 471 O VAL A 31 18.754 31.222 14.006 1.00 0.00 O ATOM 472 CB VAL A 31 16.445 31.475 15.663 1.00 0.00 C ATOM 473 CG1 VAL A 31 15.457 32.415 14.996 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.881 31.037 17.008 1.00 0.00 C ATOM 0 H VAL A 31 17.696 29.565 16.484 1.00 0.00 H new ATOM 0 HA VAL A 31 15.751 29.980 14.249 1.00 0.00 H new ATOM 0 HB VAL A 31 17.398 31.980 15.820 1.00 0.00 H new ATOM 0 HG11 VAL A 31 15.294 33.284 15.634 1.00 0.00 H new ATOM 0 HG12 VAL A 31 15.856 32.740 14.035 1.00 0.00 H new ATOM 0 HG13 VAL A 31 14.511 31.897 14.840 1.00 0.00 H new ATOM 0 HG21 VAL A 31 15.726 31.912 17.640 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.930 30.526 16.855 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.583 30.359 17.494 1.00 0.00 H new ATOM 484 N ARG A 32 17.594 30.047 12.529 1.00 0.00 N ATOM 485 CA ARG A 32 18.611 30.265 11.458 1.00 0.00 C ATOM 486 C ARG A 32 18.703 31.736 11.078 1.00 0.00 C ATOM 487 O ARG A 32 19.689 32.198 10.507 1.00 0.00 O ATOM 488 CB ARG A 32 18.039 29.521 10.274 1.00 0.00 C ATOM 489 CG ARG A 32 18.340 28.027 10.388 1.00 0.00 C ATOM 490 CD ARG A 32 17.554 27.265 9.320 1.00 0.00 C ATOM 491 NE ARG A 32 16.378 26.692 10.038 1.00 0.00 N ATOM 492 CZ ARG A 32 15.411 26.109 9.373 1.00 0.00 C ATOM 493 NH1 ARG A 32 15.459 26.021 8.069 1.00 0.00 N ATOM 494 NH2 ARG A 32 14.389 25.614 10.018 1.00 0.00 N ATOM 0 H ARG A 32 16.792 29.483 12.248 1.00 0.00 H new ATOM 0 HA ARG A 32 19.603 29.939 11.772 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.962 29.679 10.223 1.00 0.00 H new ATOM 0 HB3 ARG A 32 18.463 29.914 9.350 1.00 0.00 H new ATOM 0 HG2 ARG A 32 19.408 27.850 10.264 1.00 0.00 H new ATOM 0 HG3 ARG A 32 18.070 27.666 11.380 1.00 0.00 H new ATOM 0 HD2 ARG A 32 17.239 27.928 8.514 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.161 26.480 8.869 1.00 0.00 H new ATOM 0 HE ARG A 32 16.326 26.755 11.055 1.00 0.00 H new ATOM 0 HH11 ARG A 32 16.254 26.408 7.561 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.701 25.565 7.560 1.00 0.00 H new ATOM 0 HH21 ARG A 32 14.346 25.682 11.035 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.634 25.159 9.505 1.00 0.00 H new ATOM 508 N THR A 33 17.686 32.468 11.390 1.00 0.00 N ATOM 509 CA THR A 33 17.671 33.924 11.065 1.00 0.00 C ATOM 510 C THR A 33 18.799 34.610 11.820 1.00 0.00 C ATOM 511 O THR A 33 19.354 35.618 11.386 1.00 0.00 O ATOM 512 CB THR A 33 16.302 34.425 11.542 1.00 0.00 C ATOM 513 OG1 THR A 33 15.991 35.643 10.883 1.00 0.00 O ATOM 514 CG2 THR A 33 16.310 34.662 13.057 1.00 0.00 C ATOM 0 H THR A 33 16.850 32.124 11.862 1.00 0.00 H new ATOM 0 HA THR A 33 17.817 34.129 10.004 1.00 0.00 H new ATOM 0 HB THR A 33 15.553 33.668 11.307 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.116 35.964 11.185 1.00 0.00 H new ATOM 0 HG21 THR A 33 15.330 35.017 13.375 1.00 0.00 H new ATOM 0 HG22 THR A 33 16.542 33.729 13.570 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.064 35.409 13.304 1.00 0.00 H new ATOM 522 N THR A 34 19.145 34.063 12.944 1.00 0.00 N ATOM 523 CA THR A 34 20.247 34.654 13.758 1.00 0.00 C ATOM 524 C THR A 34 21.360 33.623 13.970 1.00 0.00 C ATOM 525 O THR A 34 22.417 33.931 14.518 1.00 0.00 O ATOM 526 CB THR A 34 19.605 35.027 15.095 1.00 0.00 C ATOM 527 OG1 THR A 34 20.554 35.711 15.898 1.00 0.00 O ATOM 528 CG2 THR A 34 19.145 33.760 15.812 1.00 0.00 C ATOM 0 H THR A 34 18.714 33.228 13.341 1.00 0.00 H new ATOM 0 HA THR A 34 20.699 35.517 13.269 1.00 0.00 H new ATOM 0 HB THR A 34 18.745 35.673 14.919 1.00 0.00 H new ATOM 0 HG1 THR A 34 21.459 35.477 15.605 1.00 0.00 H new ATOM 0 HG21 THR A 34 18.688 34.027 16.765 1.00 0.00 H new ATOM 0 HG22 THR A 34 18.416 33.236 15.194 1.00 0.00 H new ATOM 0 HG23 THR A 34 20.002 33.111 15.990 1.00 0.00 H new ATOM 536 N GLY A 35 21.142 32.404 13.554 1.00 0.00 N ATOM 537 CA GLY A 35 22.176 31.358 13.738 1.00 0.00 C ATOM 538 C GLY A 35 22.280 31.009 15.222 1.00 0.00 C ATOM 539 O GLY A 35 23.339 30.623 15.709 1.00 0.00 O ATOM 0 H GLY A 35 20.287 32.092 13.093 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.919 30.470 13.161 1.00 0.00 H new ATOM 0 HA3 GLY A 35 23.138 31.712 13.367 1.00 0.00 H new ATOM 543 N ILE A 36 21.199 31.122 15.952 1.00 0.00 N ATOM 544 CA ILE A 36 21.251 30.775 17.408 1.00 0.00 C ATOM 545 C ILE A 36 20.314 29.614 17.683 1.00 0.00 C ATOM 546 O ILE A 36 19.399 29.335 16.916 1.00 0.00 O ATOM 547 CB ILE A 36 20.718 31.997 18.180 1.00 0.00 C ATOM 548 CG1 ILE A 36 21.696 33.164 18.098 1.00 0.00 C ATOM 549 CG2 ILE A 36 20.517 31.638 19.669 1.00 0.00 C ATOM 550 CD1 ILE A 36 21.093 34.350 18.858 1.00 0.00 C ATOM 0 H ILE A 36 20.291 31.436 15.609 1.00 0.00 H new ATOM 0 HA ILE A 36 22.267 30.511 17.703 1.00 0.00 H new ATOM 0 HB ILE A 36 19.769 32.285 17.727 1.00 0.00 H new ATOM 0 HG12 ILE A 36 22.657 32.885 18.530 1.00 0.00 H new ATOM 0 HG13 ILE A 36 21.880 33.433 17.058 1.00 0.00 H new ATOM 0 HG21 ILE A 36 20.140 32.509 20.206 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.800 30.822 19.753 1.00 0.00 H new ATOM 0 HG23 ILE A 36 21.469 31.330 20.101 1.00 0.00 H new ATOM 0 HD11 ILE A 36 21.777 35.197 18.812 1.00 0.00 H new ATOM 0 HD12 ILE A 36 20.141 34.627 18.404 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.931 34.071 19.899 1.00 0.00 H new ATOM 562 N PHE A 37 20.479 28.990 18.802 1.00 0.00 N ATOM 563 CA PHE A 37 19.549 27.909 19.192 1.00 0.00 C ATOM 564 C PHE A 37 19.421 27.933 20.700 1.00 0.00 C ATOM 565 O PHE A 37 20.401 27.806 21.434 1.00 0.00 O ATOM 566 CB PHE A 37 20.111 26.582 18.673 1.00 0.00 C ATOM 567 CG PHE A 37 21.117 26.000 19.622 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.670 25.307 20.748 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.482 26.112 19.360 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.582 24.727 21.620 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.400 25.522 20.229 1.00 0.00 C ATOM 572 CZ PHE A 37 22.948 24.828 21.361 1.00 0.00 C ATOM 0 H PHE A 37 21.225 29.183 19.471 1.00 0.00 H new ATOM 0 HA PHE A 37 18.555 28.039 18.763 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.296 25.873 18.526 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.576 26.739 17.700 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.611 25.222 20.942 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.826 26.652 18.490 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.234 24.199 22.496 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.459 25.600 20.030 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.659 24.371 22.033 1.00 0.00 H new ATOM 596 N ARG A 39 17.084 27.098 24.440 1.00 0.00 N ATOM 597 CA ARG A 39 16.324 26.052 25.093 1.00 0.00 C ATOM 598 C ARG A 39 14.857 26.415 24.897 1.00 0.00 C ATOM 599 O ARG A 39 14.557 27.521 24.451 1.00 0.00 O ATOM 600 CB ARG A 39 16.774 26.182 26.538 1.00 0.00 C ATOM 601 CG ARG A 39 18.002 25.293 26.770 1.00 0.00 C ATOM 602 CD ARG A 39 18.989 26.018 27.687 1.00 0.00 C ATOM 603 NE ARG A 39 18.392 25.928 29.053 1.00 0.00 N ATOM 604 CZ ARG A 39 17.933 26.993 29.667 1.00 0.00 C ATOM 605 NH1 ARG A 39 17.983 28.170 29.103 1.00 0.00 N ATOM 606 NH2 ARG A 39 17.419 26.876 30.861 1.00 0.00 N ATOM 0 HA ARG A 39 16.462 25.033 24.731 1.00 0.00 H new ATOM 0 HB2 ARG A 39 17.015 27.221 26.763 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.967 25.889 27.210 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.700 24.347 27.219 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.479 25.057 25.819 1.00 0.00 H new ATOM 0 HD2 ARG A 39 19.973 25.550 27.655 1.00 0.00 H new ATOM 0 HD3 ARG A 39 19.120 27.056 27.382 1.00 0.00 H new ATOM 0 HE ARG A 39 18.340 25.021 29.518 1.00 0.00 H new ATOM 0 HH11 ARG A 39 18.384 28.272 28.171 1.00 0.00 H new ATOM 0 HH12 ARG A 39 17.621 28.987 29.595 1.00 0.00 H new ATOM 0 HH21 ARG A 39 17.376 25.961 31.310 1.00 0.00 H new ATOM 0 HH22 ARG A 39 17.060 27.699 31.345 1.00 0.00 H new ATOM 620 N PRO A 40 13.981 25.518 25.201 1.00 0.00 N ATOM 621 CA PRO A 40 12.548 25.813 25.012 1.00 0.00 C ATOM 622 C PRO A 40 12.090 26.939 25.945 1.00 0.00 C ATOM 623 O PRO A 40 11.007 27.494 25.783 1.00 0.00 O ATOM 624 CB PRO A 40 11.865 24.491 25.349 1.00 0.00 C ATOM 625 CG PRO A 40 12.838 23.775 26.227 1.00 0.00 C ATOM 626 CD PRO A 40 14.206 24.180 25.747 1.00 0.00 C ATOM 0 HA PRO A 40 12.312 26.161 24.006 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.916 24.654 25.860 1.00 0.00 H new ATOM 0 HB3 PRO A 40 11.647 23.917 24.448 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.695 24.048 27.272 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.704 22.695 26.159 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.932 24.193 26.560 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.587 23.494 24.990 1.00 0.00 H new ATOM 634 N SER A 41 12.862 27.272 26.938 1.00 0.00 N ATOM 635 CA SER A 41 12.429 28.326 27.867 1.00 0.00 C ATOM 636 C SER A 41 13.336 29.580 27.824 1.00 0.00 C ATOM 637 O SER A 41 13.477 30.278 28.825 1.00 0.00 O ATOM 638 CB SER A 41 12.451 27.621 29.219 1.00 0.00 C ATOM 639 OG SER A 41 13.798 27.411 29.623 1.00 0.00 O ATOM 0 H SER A 41 13.771 26.856 27.139 1.00 0.00 H new ATOM 0 HA SER A 41 11.448 28.731 27.618 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.927 28.221 29.963 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.927 26.667 29.152 1.00 0.00 H new ATOM 0 HG SER A 41 13.982 26.449 29.661 1.00 0.00 H new ATOM 645 N CYS A 42 13.941 29.898 26.692 1.00 0.00 N ATOM 646 CA CYS A 42 14.806 31.123 26.626 1.00 0.00 C ATOM 647 C CYS A 42 14.017 32.346 27.082 1.00 0.00 C ATOM 648 O CYS A 42 12.902 32.603 26.631 1.00 0.00 O ATOM 649 CB CYS A 42 15.207 31.321 25.168 1.00 0.00 C ATOM 650 SG CYS A 42 16.280 32.789 25.061 1.00 0.00 S ATOM 0 H CYS A 42 13.872 29.367 25.824 1.00 0.00 H new ATOM 0 HA CYS A 42 15.678 31.002 27.269 1.00 0.00 H new ATOM 0 HB2 CYS A 42 15.731 30.441 24.796 1.00 0.00 H new ATOM 0 HB3 CYS A 42 14.322 31.452 24.546 1.00 0.00 H new ATOM 0 HG CYS A 42 16.637 32.976 23.825 1.00 0.00 H new ATOM 655 N ARG A 43 14.591 33.103 27.953 1.00 0.00 N ATOM 656 CA ARG A 43 13.907 34.339 28.452 1.00 0.00 C ATOM 657 C ARG A 43 14.448 35.613 27.786 1.00 0.00 C ATOM 658 O ARG A 43 14.118 36.720 28.207 1.00 0.00 O ATOM 659 CB ARG A 43 14.142 34.390 29.973 1.00 0.00 C ATOM 660 CG ARG A 43 15.570 33.957 30.351 1.00 0.00 C ATOM 661 CD ARG A 43 16.611 34.768 29.570 1.00 0.00 C ATOM 662 NE ARG A 43 16.343 36.202 29.904 1.00 0.00 N ATOM 663 CZ ARG A 43 16.839 36.746 30.990 1.00 0.00 C ATOM 664 NH1 ARG A 43 17.581 36.052 31.813 1.00 0.00 N ATOM 665 NH2 ARG A 43 16.588 38.000 31.253 1.00 0.00 N ATOM 0 H ARG A 43 15.513 32.929 28.353 1.00 0.00 H new ATOM 0 HA ARG A 43 12.845 34.298 28.208 1.00 0.00 H new ATOM 0 HB2 ARG A 43 13.963 35.403 30.334 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.422 33.742 30.473 1.00 0.00 H new ATOM 0 HG2 ARG A 43 15.725 34.094 31.421 1.00 0.00 H new ATOM 0 HG3 ARG A 43 15.700 32.895 30.143 1.00 0.00 H new ATOM 0 HD2 ARG A 43 17.624 34.483 29.855 1.00 0.00 H new ATOM 0 HD3 ARG A 43 16.520 34.592 28.498 1.00 0.00 H new ATOM 0 HE ARG A 43 15.766 36.765 29.278 1.00 0.00 H new ATOM 0 HH11 ARG A 43 17.782 35.072 31.615 1.00 0.00 H new ATOM 0 HH12 ARG A 43 17.959 36.491 32.653 1.00 0.00 H new ATOM 0 HH21 ARG A 43 16.010 38.549 30.616 1.00 0.00 H new ATOM 0 HH22 ARG A 43 16.970 38.431 32.095 1.00 0.00 H new ATOM 679 N ALA A 44 15.307 35.502 26.802 1.00 0.00 N ATOM 680 CA ALA A 44 15.878 36.749 26.199 1.00 0.00 C ATOM 681 C ALA A 44 14.965 37.350 25.134 1.00 0.00 C ATOM 682 O ALA A 44 14.645 38.537 25.170 1.00 0.00 O ATOM 683 CB ALA A 44 17.201 36.309 25.574 1.00 0.00 C ATOM 0 H ALA A 44 15.632 34.624 26.397 1.00 0.00 H new ATOM 0 HA ALA A 44 15.999 37.527 26.953 1.00 0.00 H new ATOM 0 HB1 ALA A 44 17.686 37.167 25.108 1.00 0.00 H new ATOM 0 HB2 ALA A 44 17.851 35.900 26.348 1.00 0.00 H new ATOM 0 HB3 ALA A 44 17.011 35.546 24.819 1.00 0.00 H new ATOM 689 N ARG A 45 14.535 36.559 24.201 1.00 0.00 N ATOM 690 CA ARG A 45 13.631 37.070 23.119 1.00 0.00 C ATOM 691 C ARG A 45 13.367 35.899 22.152 1.00 0.00 C ATOM 692 O ARG A 45 13.961 34.832 22.297 1.00 0.00 O ATOM 693 CB ARG A 45 14.409 38.223 22.447 1.00 0.00 C ATOM 694 CG ARG A 45 13.441 39.160 21.706 1.00 0.00 C ATOM 695 CD ARG A 45 13.671 40.610 22.173 1.00 0.00 C ATOM 696 NE ARG A 45 14.016 41.384 20.936 1.00 0.00 N ATOM 697 CZ ARG A 45 14.289 42.662 20.999 1.00 0.00 C ATOM 698 NH1 ARG A 45 14.268 43.295 22.143 1.00 0.00 N ATOM 699 NH2 ARG A 45 14.585 43.309 19.906 1.00 0.00 N ATOM 0 H ARG A 45 14.768 35.568 24.132 1.00 0.00 H new ATOM 0 HA ARG A 45 12.666 37.435 23.471 1.00 0.00 H new ATOM 0 HB2 ARG A 45 14.964 38.783 23.200 1.00 0.00 H new ATOM 0 HB3 ARG A 45 15.141 37.818 21.748 1.00 0.00 H new ATOM 0 HG2 ARG A 45 13.597 39.084 20.630 1.00 0.00 H new ATOM 0 HG3 ARG A 45 12.410 38.863 21.900 1.00 0.00 H new ATOM 0 HD2 ARG A 45 12.779 41.014 22.651 1.00 0.00 H new ATOM 0 HD3 ARG A 45 14.477 40.663 22.905 1.00 0.00 H new ATOM 0 HE ARG A 45 14.038 40.908 20.034 1.00 0.00 H new ATOM 0 HH11 ARG A 45 14.037 42.792 23.000 1.00 0.00 H new ATOM 0 HH12 ARG A 45 14.483 44.291 22.178 1.00 0.00 H new ATOM 0 HH21 ARG A 45 14.602 42.819 19.012 1.00 0.00 H new ATOM 0 HH22 ARG A 45 14.799 44.305 19.945 1.00 0.00 H new ATOM 713 N HIS A 46 12.480 36.037 21.198 1.00 0.00 N ATOM 714 CA HIS A 46 12.195 34.888 20.287 1.00 0.00 C ATOM 715 C HIS A 46 11.990 35.283 18.839 1.00 0.00 C ATOM 716 O HIS A 46 11.619 36.404 18.512 1.00 0.00 O ATOM 717 CB HIS A 46 10.895 34.293 20.787 1.00 0.00 C ATOM 718 CG HIS A 46 11.170 33.227 21.787 1.00 0.00 C ATOM 719 ND1 HIS A 46 11.159 31.899 21.424 1.00 0.00 N ATOM 720 CD2 HIS A 46 11.399 33.253 23.135 1.00 0.00 C ATOM 721 CE1 HIS A 46 11.352 31.182 22.527 1.00 0.00 C ATOM 722 NE2 HIS A 46 11.512 31.951 23.607 1.00 0.00 N ATOM 0 H HIS A 46 11.946 36.886 21.012 1.00 0.00 H new ATOM 0 HA HIS A 46 13.049 34.211 20.304 1.00 0.00 H new ATOM 0 HB2 HIS A 46 10.278 35.072 21.235 1.00 0.00 H new ATOM 0 HB3 HIS A 46 10.330 33.881 19.951 1.00 0.00 H new ATOM 0 HD1 HIS A 46 11.027 31.532 20.481 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.479 34.145 23.738 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.377 30.102 22.547 1.00 0.00 H new ATOM 730 N ALA A 47 12.154 34.318 17.983 1.00 0.00 N ATOM 731 CA ALA A 47 11.916 34.516 16.540 1.00 0.00 C ATOM 732 C ALA A 47 10.825 33.544 16.089 1.00 0.00 C ATOM 733 O ALA A 47 10.573 32.534 16.743 1.00 0.00 O ATOM 734 CB ALA A 47 13.238 34.194 15.859 1.00 0.00 C ATOM 0 H ALA A 47 12.452 33.376 18.236 1.00 0.00 H new ATOM 0 HA ALA A 47 11.590 35.527 16.298 1.00 0.00 H new ATOM 0 HB1 ALA A 47 13.133 34.321 14.782 1.00 0.00 H new ATOM 0 HB2 ALA A 47 14.012 34.867 16.230 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.518 33.163 16.077 1.00 0.00 H new ATOM 740 N LEU A 48 10.163 33.823 15.004 1.00 0.00 N ATOM 741 CA LEU A 48 9.086 32.920 14.541 1.00 0.00 C ATOM 742 C LEU A 48 9.592 31.478 14.381 1.00 0.00 C ATOM 743 O LEU A 48 10.784 31.228 14.220 1.00 0.00 O ATOM 744 CB LEU A 48 8.640 33.486 13.191 1.00 0.00 C ATOM 745 CG LEU A 48 7.814 34.754 13.415 1.00 0.00 C ATOM 746 CD1 LEU A 48 7.821 35.605 12.142 1.00 0.00 C ATOM 747 CD2 LEU A 48 6.374 34.370 13.760 1.00 0.00 C ATOM 0 H LEU A 48 10.325 34.642 14.418 1.00 0.00 H new ATOM 0 HA LEU A 48 8.268 32.876 15.260 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.510 33.711 12.574 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.049 32.745 12.652 1.00 0.00 H new ATOM 0 HG LEU A 48 8.247 35.326 14.236 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.232 36.508 12.304 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.846 35.881 11.894 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.390 35.034 11.320 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.785 35.273 13.920 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.944 33.797 12.939 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.366 33.766 14.668 1.00 0.00 H new ATOM 759 N ARG A 49 8.690 30.531 14.411 1.00 0.00 N ATOM 760 CA ARG A 49 9.076 29.094 14.248 1.00 0.00 C ATOM 761 C ARG A 49 9.734 28.908 12.889 1.00 0.00 C ATOM 762 O ARG A 49 10.592 28.055 12.673 1.00 0.00 O ATOM 763 CB ARG A 49 7.739 28.385 14.239 1.00 0.00 C ATOM 764 CG ARG A 49 7.925 26.909 14.596 1.00 0.00 C ATOM 765 CD ARG A 49 8.164 26.098 13.318 1.00 0.00 C ATOM 766 NE ARG A 49 7.171 24.986 13.375 1.00 0.00 N ATOM 767 CZ ARG A 49 7.308 23.928 12.613 1.00 0.00 C ATOM 768 NH1 ARG A 49 8.316 23.824 11.785 1.00 0.00 N ATOM 769 NH2 ARG A 49 6.426 22.969 12.680 1.00 0.00 N ATOM 0 H ARG A 49 7.691 30.692 14.543 1.00 0.00 H new ATOM 0 HA ARG A 49 9.763 28.736 15.014 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.063 28.857 14.952 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.278 28.474 13.255 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.769 26.792 15.276 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.043 26.536 15.116 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.019 26.711 12.429 1.00 0.00 H new ATOM 0 HD3 ARG A 49 9.184 25.715 13.279 1.00 0.00 H new ATOM 0 HE ARG A 49 6.378 25.050 14.013 1.00 0.00 H new ATOM 0 HH11 ARG A 49 9.007 24.572 11.727 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.410 22.995 11.198 1.00 0.00 H new ATOM 0 HH21 ARG A 49 5.637 23.046 13.322 1.00 0.00 H new ATOM 0 HH22 ARG A 49 6.525 22.143 12.090 1.00 0.00 H new ATOM 783 N GLU A 50 9.305 29.720 11.982 1.00 0.00 N ATOM 784 CA GLU A 50 9.795 29.721 10.586 1.00 0.00 C ATOM 785 C GLU A 50 11.295 29.477 10.501 1.00 0.00 C ATOM 786 O GLU A 50 11.763 28.503 9.915 1.00 0.00 O ATOM 787 CB GLU A 50 9.482 31.140 10.159 1.00 0.00 C ATOM 788 CG GLU A 50 9.559 31.240 8.664 1.00 0.00 C ATOM 789 CD GLU A 50 11.017 31.352 8.210 1.00 0.00 C ATOM 790 OE1 GLU A 50 11.508 32.466 8.132 1.00 0.00 O ATOM 791 OE2 GLU A 50 11.616 30.323 7.945 1.00 0.00 O ATOM 0 H GLU A 50 8.591 30.426 12.163 1.00 0.00 H new ATOM 0 HA GLU A 50 9.344 28.939 9.975 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.487 31.424 10.503 1.00 0.00 H new ATOM 0 HB3 GLU A 50 10.187 31.833 10.618 1.00 0.00 H new ATOM 0 HG2 GLU A 50 9.097 30.363 8.210 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.997 32.109 8.322 1.00 0.00 H new ATOM 798 N ASN A 51 12.043 30.355 11.081 1.00 0.00 N ATOM 799 CA ASN A 51 13.522 30.218 11.061 1.00 0.00 C ATOM 800 C ASN A 51 13.962 29.448 12.292 1.00 0.00 C ATOM 801 O ASN A 51 15.118 29.480 12.685 1.00 0.00 O ATOM 802 CB ASN A 51 14.036 31.654 11.144 1.00 0.00 C ATOM 803 CG ASN A 51 13.716 32.397 9.847 1.00 0.00 C ATOM 804 OD1 ASN A 51 14.066 31.944 8.759 1.00 0.00 O ATOM 805 ND2 ASN A 51 13.061 33.526 9.906 1.00 0.00 N ATOM 0 H ASN A 51 11.694 31.175 11.577 1.00 0.00 H new ATOM 0 HA ASN A 51 13.892 29.692 10.181 1.00 0.00 H new ATOM 0 HB2 ASN A 51 13.576 32.166 11.989 1.00 0.00 H new ATOM 0 HB3 ASN A 51 15.112 31.655 11.318 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.840 34.033 9.049 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.771 33.901 10.809 1.00 0.00 H new ATOM 812 N VAL A 52 13.048 28.773 12.913 1.00 0.00 N ATOM 813 CA VAL A 52 13.379 28.014 14.145 1.00 0.00 C ATOM 814 C VAL A 52 13.274 26.498 13.922 1.00 0.00 C ATOM 815 O VAL A 52 12.282 25.991 13.402 1.00 0.00 O ATOM 816 CB VAL A 52 12.326 28.500 15.144 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.994 27.400 16.145 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.865 29.714 15.899 1.00 0.00 C ATOM 0 H VAL A 52 12.073 28.712 12.619 1.00 0.00 H new ATOM 0 HA VAL A 52 14.402 28.179 14.482 1.00 0.00 H new ATOM 0 HB VAL A 52 11.422 28.769 14.597 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.244 27.762 16.848 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.605 26.531 15.615 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.896 27.119 16.689 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.116 30.062 16.611 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.773 29.436 16.434 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.091 30.512 15.191 1.00 0.00 H new ATOM 828 N SER A 53 14.271 25.771 14.345 1.00 0.00 N ATOM 829 CA SER A 53 14.248 24.292 14.216 1.00 0.00 C ATOM 830 C SER A 53 14.530 23.695 15.588 1.00 0.00 C ATOM 831 O SER A 53 14.772 24.424 16.541 1.00 0.00 O ATOM 832 CB SER A 53 15.358 23.945 13.231 1.00 0.00 C ATOM 833 OG SER A 53 16.495 24.754 13.501 1.00 0.00 O ATOM 0 H SER A 53 15.113 26.148 14.781 1.00 0.00 H new ATOM 0 HA SER A 53 13.292 23.905 13.864 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.619 22.890 13.316 1.00 0.00 H new ATOM 0 HB3 SER A 53 15.017 24.107 12.209 1.00 0.00 H new ATOM 0 HG SER A 53 17.310 24.220 13.393 1.00 0.00 H new ATOM 839 N PHE A 54 14.467 22.403 15.731 1.00 0.00 N ATOM 840 CA PHE A 54 14.691 21.802 17.048 1.00 0.00 C ATOM 841 C PHE A 54 15.786 20.750 17.000 1.00 0.00 C ATOM 842 O PHE A 54 16.015 20.092 15.986 1.00 0.00 O ATOM 843 CB PHE A 54 13.350 21.191 17.371 1.00 0.00 C ATOM 844 CG PHE A 54 12.336 22.304 17.388 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.355 23.240 18.424 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.411 22.425 16.349 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.446 24.300 18.423 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.495 23.482 16.350 1.00 0.00 C ATOM 849 CZ PHE A 54 10.515 24.421 17.387 1.00 0.00 C ATOM 0 H PHE A 54 14.268 21.742 14.980 1.00 0.00 H new ATOM 0 HA PHE A 54 15.026 22.520 17.797 1.00 0.00 H new ATOM 0 HB2 PHE A 54 13.082 20.440 16.628 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.381 20.687 18.337 1.00 0.00 H new ATOM 0 HD1 PHE A 54 13.072 23.144 19.226 1.00 0.00 H new ATOM 0 HD2 PHE A 54 11.403 21.703 15.546 1.00 0.00 H new ATOM 0 HE1 PHE A 54 11.462 25.026 19.222 1.00 0.00 H new ATOM 0 HE2 PHE A 54 9.773 23.573 15.552 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.811 25.240 17.387 1.00 0.00 H new ATOM 859 N TYR A 55 16.465 20.596 18.089 1.00 0.00 N ATOM 860 CA TYR A 55 17.568 19.605 18.165 1.00 0.00 C ATOM 861 C TYR A 55 17.394 18.724 19.390 1.00 0.00 C ATOM 862 O TYR A 55 16.794 19.133 20.380 1.00 0.00 O ATOM 863 CB TYR A 55 18.831 20.446 18.325 1.00 0.00 C ATOM 864 CG TYR A 55 19.182 21.077 17.006 1.00 0.00 C ATOM 865 CD1 TYR A 55 19.305 20.273 15.876 1.00 0.00 C ATOM 866 CD2 TYR A 55 19.389 22.457 16.912 1.00 0.00 C ATOM 867 CE1 TYR A 55 19.635 20.840 14.644 1.00 0.00 C ATOM 868 CE2 TYR A 55 19.720 23.028 15.681 1.00 0.00 C ATOM 869 CZ TYR A 55 19.844 22.221 14.544 1.00 0.00 C ATOM 870 OH TYR A 55 20.174 22.783 13.327 1.00 0.00 O ATOM 0 H TYR A 55 16.303 21.122 18.948 1.00 0.00 H new ATOM 0 HA TYR A 55 17.598 18.956 17.290 1.00 0.00 H new ATOM 0 HB2 TYR A 55 18.674 21.217 19.079 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.655 19.822 18.673 1.00 0.00 H new ATOM 0 HD1 TYR A 55 19.145 19.208 15.953 1.00 0.00 H new ATOM 0 HD2 TYR A 55 19.293 23.080 17.789 1.00 0.00 H new ATOM 0 HE1 TYR A 55 19.729 20.214 13.769 1.00 0.00 H new ATOM 0 HE2 TYR A 55 19.880 24.093 15.606 1.00 0.00 H new ATOM 0 HH TYR A 55 20.407 23.726 13.455 1.00 0.00 H new ATOM 880 N ALA A 56 17.933 17.539 19.367 1.00 0.00 N ATOM 881 CA ALA A 56 17.819 16.670 20.563 1.00 0.00 C ATOM 882 C ALA A 56 18.648 17.297 21.677 1.00 0.00 C ATOM 883 O ALA A 56 18.247 17.327 22.836 1.00 0.00 O ATOM 884 CB ALA A 56 18.395 15.323 20.151 1.00 0.00 C ATOM 0 H ALA A 56 18.442 17.139 18.579 1.00 0.00 H new ATOM 0 HA ALA A 56 16.795 16.555 20.918 1.00 0.00 H new ATOM 0 HB1 ALA A 56 18.341 14.632 20.992 1.00 0.00 H new ATOM 0 HB2 ALA A 56 17.822 14.923 19.315 1.00 0.00 H new ATOM 0 HB3 ALA A 56 19.435 15.449 19.851 1.00 0.00 H new ATOM 890 N ASN A 57 19.797 17.823 21.342 1.00 0.00 N ATOM 891 CA ASN A 57 20.631 18.468 22.368 1.00 0.00 C ATOM 892 C ASN A 57 21.269 19.730 21.822 1.00 0.00 C ATOM 893 O ASN A 57 21.336 19.967 20.609 1.00 0.00 O ATOM 894 CB ASN A 57 21.725 17.481 22.710 1.00 0.00 C ATOM 895 CG ASN A 57 22.489 17.105 21.451 1.00 0.00 C ATOM 896 OD1 ASN A 57 23.522 17.699 21.157 1.00 0.00 O ATOM 897 ND2 ASN A 57 22.033 16.156 20.687 1.00 0.00 N ATOM 0 H ASN A 57 20.184 17.828 20.398 1.00 0.00 H new ATOM 0 HA ASN A 57 20.029 18.738 23.236 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.404 17.916 23.443 1.00 0.00 H new ATOM 0 HB3 ASN A 57 21.294 16.589 23.165 1.00 0.00 H new ATOM 0 HD21 ASN A 57 22.535 15.901 19.836 1.00 0.00 H new ATOM 0 HD22 ASN A 57 21.174 15.667 20.939 1.00 0.00 H new ATOM 904 N ALA A 58 21.762 20.526 22.703 1.00 0.00 N ATOM 905 CA ALA A 58 22.431 21.770 22.290 1.00 0.00 C ATOM 906 C ALA A 58 23.672 21.449 21.461 1.00 0.00 C ATOM 907 O ALA A 58 24.098 22.259 20.656 1.00 0.00 O ATOM 908 CB ALA A 58 22.822 22.457 23.594 1.00 0.00 C ATOM 0 H ALA A 58 21.730 20.367 23.710 1.00 0.00 H new ATOM 0 HA ALA A 58 21.791 22.400 21.673 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.329 23.396 23.373 1.00 0.00 H new ATOM 0 HB2 ALA A 58 21.927 22.657 24.182 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.491 21.809 24.160 1.00 0.00 H new ATOM 914 N SER A 59 24.264 20.285 21.618 1.00 0.00 N ATOM 915 CA SER A 59 25.474 19.979 20.801 1.00 0.00 C ATOM 916 C SER A 59 25.048 19.755 19.358 1.00 0.00 C ATOM 917 O SER A 59 25.725 20.168 18.421 1.00 0.00 O ATOM 918 CB SER A 59 26.086 18.713 21.403 1.00 0.00 C ATOM 919 OG SER A 59 27.449 18.618 21.008 1.00 0.00 O ATOM 0 H SER A 59 23.967 19.552 22.262 1.00 0.00 H new ATOM 0 HA SER A 59 26.202 20.790 20.809 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.011 18.740 22.490 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.536 17.834 21.068 1.00 0.00 H new ATOM 0 HG SER A 59 27.846 17.809 21.393 1.00 0.00 H new ATOM 925 N GLU A 60 23.910 19.146 19.161 1.00 0.00 N ATOM 926 CA GLU A 60 23.412 18.944 17.781 1.00 0.00 C ATOM 927 C GLU A 60 23.230 20.326 17.168 1.00 0.00 C ATOM 928 O GLU A 60 23.718 20.634 16.075 1.00 0.00 O ATOM 929 CB GLU A 60 22.074 18.223 17.947 1.00 0.00 C ATOM 930 CG GLU A 60 21.645 17.620 16.613 1.00 0.00 C ATOM 931 CD GLU A 60 22.504 16.393 16.296 1.00 0.00 C ATOM 932 OE1 GLU A 60 23.708 16.548 16.177 1.00 0.00 O ATOM 933 OE2 GLU A 60 21.941 15.318 16.173 1.00 0.00 O ATOM 0 H GLU A 60 23.308 18.782 19.899 1.00 0.00 H new ATOM 0 HA GLU A 60 24.076 18.367 17.138 1.00 0.00 H new ATOM 0 HB2 GLU A 60 22.163 17.439 18.699 1.00 0.00 H new ATOM 0 HB3 GLU A 60 21.316 18.921 18.302 1.00 0.00 H new ATOM 0 HG2 GLU A 60 20.593 17.338 16.653 1.00 0.00 H new ATOM 0 HG3 GLU A 60 21.746 18.361 15.820 1.00 0.00 H new ATOM 940 N ALA A 61 22.583 21.189 17.898 1.00 0.00 N ATOM 941 CA ALA A 61 22.408 22.584 17.420 1.00 0.00 C ATOM 942 C ALA A 61 23.783 23.194 17.228 1.00 0.00 C ATOM 943 O ALA A 61 24.081 23.829 16.218 1.00 0.00 O ATOM 944 CB ALA A 61 21.694 23.288 18.556 1.00 0.00 C ATOM 0 H ALA A 61 22.167 20.986 18.807 1.00 0.00 H new ATOM 0 HA ALA A 61 21.858 22.656 16.481 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.523 24.331 18.288 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.738 22.800 18.743 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.307 23.241 19.456 1.00 0.00 H new ATOM 950 N LEU A 62 24.633 22.977 18.187 1.00 0.00 N ATOM 951 CA LEU A 62 26.012 23.493 18.099 1.00 0.00 C ATOM 952 C LEU A 62 26.673 22.876 16.861 1.00 0.00 C ATOM 953 O LEU A 62 27.556 23.464 16.242 1.00 0.00 O ATOM 954 CB LEU A 62 26.667 23.004 19.398 1.00 0.00 C ATOM 955 CG LEU A 62 26.149 23.800 20.608 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.584 23.100 21.896 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.703 25.228 20.613 1.00 0.00 C ATOM 0 H LEU A 62 24.423 22.456 19.038 1.00 0.00 H new ATOM 0 HA LEU A 62 26.090 24.576 17.999 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.458 21.944 19.539 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.750 23.108 19.326 1.00 0.00 H new ATOM 0 HG LEU A 62 25.062 23.848 20.543 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.219 23.661 22.756 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.172 22.091 21.919 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.672 23.048 21.932 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.318 25.764 21.480 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.792 25.196 20.660 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.394 25.741 19.702 1.00 0.00 H new ATOM 969 N ALA A 63 26.234 21.698 16.482 1.00 0.00 N ATOM 970 CA ALA A 63 26.793 21.032 15.286 1.00 0.00 C ATOM 971 C ALA A 63 26.164 21.613 14.014 1.00 0.00 C ATOM 972 O ALA A 63 26.692 21.453 12.915 1.00 0.00 O ATOM 973 CB ALA A 63 26.434 19.550 15.441 1.00 0.00 C ATOM 0 H ALA A 63 25.504 21.173 16.963 1.00 0.00 H new ATOM 0 HA ALA A 63 27.870 21.177 15.201 1.00 0.00 H new ATOM 0 HB1 ALA A 63 26.818 18.991 14.587 1.00 0.00 H new ATOM 0 HB2 ALA A 63 26.878 19.162 16.358 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.350 19.441 15.488 1.00 0.00 H new ATOM 979 N ALA A 64 25.047 22.293 14.139 1.00 0.00 N ATOM 980 CA ALA A 64 24.398 22.889 12.922 1.00 0.00 C ATOM 981 C ALA A 64 25.110 24.166 12.509 1.00 0.00 C ATOM 982 O ALA A 64 24.746 24.830 11.540 1.00 0.00 O ATOM 983 CB ALA A 64 22.943 23.193 13.301 1.00 0.00 C ATOM 0 H ALA A 64 24.560 22.461 15.020 1.00 0.00 H new ATOM 0 HA ALA A 64 24.449 22.200 12.079 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.428 23.629 12.445 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.443 22.270 13.594 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.923 23.896 14.134 1.00 0.00 H new ATOM 989 N GLY A 65 26.111 24.510 13.235 1.00 0.00 N ATOM 990 CA GLY A 65 26.883 25.746 12.929 1.00 0.00 C ATOM 991 C GLY A 65 26.187 26.957 13.556 1.00 0.00 C ATOM 992 O GLY A 65 26.138 28.036 12.968 1.00 0.00 O ATOM 0 H GLY A 65 26.443 23.986 14.045 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.898 25.657 13.316 1.00 0.00 H new ATOM 0 HA3 GLY A 65 26.963 25.879 11.850 1.00 0.00 H new ATOM 996 N PHE A 66 25.654 26.805 14.741 1.00 0.00 N ATOM 997 CA PHE A 66 24.969 27.954 15.405 1.00 0.00 C ATOM 998 C PHE A 66 25.711 28.408 16.651 1.00 0.00 C ATOM 999 O PHE A 66 26.476 27.662 17.258 1.00 0.00 O ATOM 1000 CB PHE A 66 23.580 27.454 15.810 1.00 0.00 C ATOM 1001 CG PHE A 66 22.713 27.269 14.594 1.00 0.00 C ATOM 1002 CD1 PHE A 66 23.061 26.349 13.602 1.00 0.00 C ATOM 1003 CD2 PHE A 66 21.551 28.036 14.462 1.00 0.00 C ATOM 1004 CE1 PHE A 66 22.243 26.197 12.477 1.00 0.00 C ATOM 1005 CE2 PHE A 66 20.737 27.886 13.341 1.00 0.00 C ATOM 1006 CZ PHE A 66 21.081 26.967 12.348 1.00 0.00 C ATOM 0 H PHE A 66 25.663 25.937 15.276 1.00 0.00 H new ATOM 0 HA PHE A 66 24.927 28.803 14.723 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.669 26.510 16.348 1.00 0.00 H new ATOM 0 HB3 PHE A 66 23.115 28.166 16.491 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.959 25.757 13.703 1.00 0.00 H new ATOM 0 HD2 PHE A 66 21.284 28.746 15.231 1.00 0.00 H new ATOM 0 HE1 PHE A 66 22.508 25.486 11.709 1.00 0.00 H new ATOM 0 HE2 PHE A 66 19.841 28.480 13.240 1.00 0.00 H new ATOM 0 HZ PHE A 66 20.450 26.850 11.479 1.00 0.00 H new ATOM 1016 N ARG A 67 25.451 29.614 17.061 1.00 0.00 N ATOM 1017 CA ARG A 67 26.079 30.140 18.292 1.00 0.00 C ATOM 1018 C ARG A 67 25.048 30.021 19.416 1.00 0.00 C ATOM 1019 O ARG A 67 23.996 30.655 19.363 1.00 0.00 O ATOM 1020 CB ARG A 67 26.400 31.604 17.989 1.00 0.00 C ATOM 1021 CG ARG A 67 27.828 31.711 17.441 1.00 0.00 C ATOM 1022 CD ARG A 67 28.684 32.557 18.389 1.00 0.00 C ATOM 1023 NE ARG A 67 28.847 33.871 17.699 1.00 0.00 N ATOM 1024 CZ ARG A 67 29.732 34.741 18.123 1.00 0.00 C ATOM 1025 NH1 ARG A 67 30.489 34.474 19.156 1.00 0.00 N ATOM 1026 NH2 ARG A 67 29.860 35.884 17.507 1.00 0.00 N ATOM 0 H ARG A 67 24.822 30.263 16.588 1.00 0.00 H new ATOM 0 HA ARG A 67 26.982 29.608 18.593 1.00 0.00 H new ATOM 0 HB2 ARG A 67 25.690 32.001 17.263 1.00 0.00 H new ATOM 0 HB3 ARG A 67 26.300 32.204 18.893 1.00 0.00 H new ATOM 0 HG2 ARG A 67 28.262 30.717 17.334 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.814 32.162 16.449 1.00 0.00 H new ATOM 0 HD2 ARG A 67 28.198 32.678 19.357 1.00 0.00 H new ATOM 0 HD3 ARG A 67 29.650 32.086 18.574 1.00 0.00 H new ATOM 0 HE ARG A 67 28.265 34.094 16.891 1.00 0.00 H new ATOM 0 HH11 ARG A 67 30.394 33.581 19.641 1.00 0.00 H new ATOM 0 HH12 ARG A 67 31.174 35.158 19.477 1.00 0.00 H new ATOM 0 HH21 ARG A 67 29.273 36.097 16.700 1.00 0.00 H new ATOM 0 HH22 ARG A 67 30.547 36.565 17.832 1.00 0.00 H new ATOM 1040 N PRO A 68 25.345 29.200 20.384 1.00 0.00 N ATOM 1041 CA PRO A 68 24.397 28.990 21.502 1.00 0.00 C ATOM 1042 C PRO A 68 24.131 30.304 22.246 1.00 0.00 C ATOM 1043 O PRO A 68 25.032 31.104 22.492 1.00 0.00 O ATOM 1044 CB PRO A 68 25.081 27.920 22.356 1.00 0.00 C ATOM 1045 CG PRO A 68 26.529 28.005 21.996 1.00 0.00 C ATOM 1046 CD PRO A 68 26.575 28.414 20.551 1.00 0.00 C ATOM 0 HA PRO A 68 23.405 28.665 21.189 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.927 28.106 23.419 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.679 26.929 22.144 1.00 0.00 H new ATOM 0 HG2 PRO A 68 27.045 28.732 22.624 1.00 0.00 H new ATOM 0 HG3 PRO A 68 27.025 27.046 22.146 1.00 0.00 H new ATOM 0 HD2 PRO A 68 27.463 29.005 20.328 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.593 27.549 19.888 1.00 0.00 H new ATOM 1054 N CYS A 69 22.886 30.548 22.570 1.00 0.00 N ATOM 1055 CA CYS A 69 22.495 31.811 23.257 1.00 0.00 C ATOM 1056 C CYS A 69 23.267 31.964 24.574 1.00 0.00 C ATOM 1057 O CYS A 69 23.229 31.098 25.445 1.00 0.00 O ATOM 1058 CB CYS A 69 20.987 31.653 23.452 1.00 0.00 C ATOM 1059 SG CYS A 69 20.327 32.734 24.758 1.00 0.00 S ATOM 0 H CYS A 69 22.112 29.911 22.382 1.00 0.00 H new ATOM 0 HA CYS A 69 22.730 32.717 22.698 1.00 0.00 H new ATOM 0 HB2 CYS A 69 20.479 31.873 22.513 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.764 30.615 23.699 1.00 0.00 H new ATOM 0 HG CYS A 69 19.558 32.043 25.546 1.00 0.00 H new ATOM 1064 N LYS A 70 23.969 33.059 24.719 1.00 0.00 N ATOM 1065 CA LYS A 70 24.788 33.302 25.954 1.00 0.00 C ATOM 1066 C LYS A 70 23.947 33.230 27.231 1.00 0.00 C ATOM 1067 O LYS A 70 24.454 33.417 28.333 1.00 0.00 O ATOM 1068 CB LYS A 70 25.365 34.707 25.777 1.00 0.00 C ATOM 1069 CG LYS A 70 26.699 34.804 26.524 1.00 0.00 C ATOM 1070 CD LYS A 70 27.681 35.655 25.717 1.00 0.00 C ATOM 1071 CE LYS A 70 28.920 35.954 26.569 1.00 0.00 C ATOM 1072 NZ LYS A 70 30.070 35.438 25.775 1.00 0.00 N ATOM 0 H LYS A 70 24.012 33.807 24.027 1.00 0.00 H new ATOM 0 HA LYS A 70 25.559 32.539 26.066 1.00 0.00 H new ATOM 0 HB2 LYS A 70 25.511 34.922 24.718 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.666 35.451 26.160 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.544 35.245 27.509 1.00 0.00 H new ATOM 0 HG3 LYS A 70 27.111 33.808 26.683 1.00 0.00 H new ATOM 0 HD2 LYS A 70 27.971 35.130 24.807 1.00 0.00 H new ATOM 0 HD3 LYS A 70 27.205 36.586 25.410 1.00 0.00 H new ATOM 0 HE2 LYS A 70 29.020 37.023 26.759 1.00 0.00 H new ATOM 0 HE3 LYS A 70 28.859 35.462 27.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 30.955 35.607 26.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 29.952 34.417 25.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 30.108 35.929 24.859 1.00 0.00 H new ATOM 1086 N ARG A 71 22.684 32.969 27.109 1.00 0.00 N ATOM 1087 CA ARG A 71 21.817 32.884 28.310 1.00 0.00 C ATOM 1088 C ARG A 71 21.311 31.456 28.461 1.00 0.00 C ATOM 1089 O ARG A 71 21.145 30.934 29.562 1.00 0.00 O ATOM 1090 CB ARG A 71 20.657 33.801 27.987 1.00 0.00 C ATOM 1091 CG ARG A 71 20.122 34.416 29.282 1.00 0.00 C ATOM 1092 CD ARG A 71 19.621 35.840 29.017 1.00 0.00 C ATOM 1093 NE ARG A 71 20.724 36.743 29.470 1.00 0.00 N ATOM 1094 CZ ARG A 71 21.069 36.809 30.736 1.00 0.00 C ATOM 1095 NH1 ARG A 71 20.457 36.086 31.639 1.00 0.00 N ATOM 1096 NH2 ARG A 71 22.035 37.606 31.099 1.00 0.00 N ATOM 0 H ARG A 71 22.208 32.809 26.221 1.00 0.00 H new ATOM 0 HA ARG A 71 22.330 33.158 29.232 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.979 34.587 27.304 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.868 33.244 27.482 1.00 0.00 H new ATOM 0 HG2 ARG A 71 19.311 33.804 29.677 1.00 0.00 H new ATOM 0 HG3 ARG A 71 20.907 34.432 30.038 1.00 0.00 H new ATOM 0 HD2 ARG A 71 19.402 35.988 27.960 1.00 0.00 H new ATOM 0 HD3 ARG A 71 18.700 36.040 29.565 1.00 0.00 H new ATOM 0 HE ARG A 71 21.216 37.317 28.785 1.00 0.00 H new ATOM 0 HH11 ARG A 71 19.700 35.460 31.364 1.00 0.00 H new ATOM 0 HH12 ARG A 71 20.737 36.149 32.618 1.00 0.00 H new ATOM 0 HH21 ARG A 71 22.517 38.173 30.402 1.00 0.00 H new ATOM 0 HH22 ARG A 71 22.308 37.662 32.080 1.00 0.00 H new ATOM 1110 N CYS A 72 21.064 30.828 27.352 1.00 0.00 N ATOM 1111 CA CYS A 72 20.559 29.420 27.366 1.00 0.00 C ATOM 1112 C CYS A 72 21.729 28.439 27.345 1.00 0.00 C ATOM 1113 O CYS A 72 21.593 27.270 27.701 1.00 0.00 O ATOM 1114 CB CYS A 72 19.746 29.271 26.080 1.00 0.00 C ATOM 1115 SG CYS A 72 18.108 29.988 26.295 1.00 0.00 S ATOM 0 H CYS A 72 21.190 31.229 26.422 1.00 0.00 H new ATOM 0 HA CYS A 72 19.969 29.212 28.258 1.00 0.00 H new ATOM 0 HB2 CYS A 72 20.262 29.764 25.256 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.658 28.217 25.816 1.00 0.00 H new ATOM 0 HG CYS A 72 17.924 30.923 25.411 1.00 0.00 H new ATOM 1120 N GLN A 73 22.868 28.892 26.911 1.00 0.00 N ATOM 1121 CA GLN A 73 24.055 28.003 26.833 1.00 0.00 C ATOM 1122 C GLN A 73 24.731 27.835 28.209 1.00 0.00 C ATOM 1123 O GLN A 73 25.080 26.718 28.585 1.00 0.00 O ATOM 1124 CB GLN A 73 24.975 28.697 25.824 1.00 0.00 C ATOM 1125 CG GLN A 73 26.308 27.948 25.729 1.00 0.00 C ATOM 1126 CD GLN A 73 27.375 28.703 26.524 1.00 0.00 C ATOM 1127 OE1 GLN A 73 27.426 28.608 27.748 1.00 0.00 O ATOM 1128 NE2 GLN A 73 28.236 29.452 25.890 1.00 0.00 N ATOM 0 H GLN A 73 23.029 29.851 26.604 1.00 0.00 H new ATOM 0 HA GLN A 73 23.797 26.989 26.526 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.496 28.730 24.845 1.00 0.00 H new ATOM 0 HB3 GLN A 73 25.149 29.729 26.128 1.00 0.00 H new ATOM 0 HG2 GLN A 73 26.197 26.936 26.118 1.00 0.00 H new ATOM 0 HG3 GLN A 73 26.613 27.857 24.686 1.00 0.00 H new ATOM 0 HE21 GLN A 73 28.193 29.530 24.874 1.00 0.00 H new ATOM 0 HE22 GLN A 73 28.952 29.959 26.411 1.00 0.00 H new ATOM 1137 N PRO A 74 24.909 28.920 28.931 1.00 0.00 N ATOM 1138 CA PRO A 74 25.556 28.828 30.265 1.00 0.00 C ATOM 1139 C PRO A 74 24.605 28.224 31.308 1.00 0.00 C ATOM 1140 O PRO A 74 25.024 27.445 32.162 1.00 0.00 O ATOM 1141 CB PRO A 74 25.886 30.274 30.611 1.00 0.00 C ATOM 1142 CG PRO A 74 24.917 31.095 29.827 1.00 0.00 C ATOM 1143 CD PRO A 74 24.548 30.306 28.594 1.00 0.00 C ATOM 0 HA PRO A 74 26.433 28.181 30.256 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.782 30.457 31.681 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.914 30.518 30.345 1.00 0.00 H new ATOM 0 HG2 PRO A 74 24.030 31.314 30.422 1.00 0.00 H new ATOM 0 HG3 PRO A 74 25.360 32.052 29.552 1.00 0.00 H new ATOM 0 HD2 PRO A 74 23.486 30.397 28.366 1.00 0.00 H new ATOM 0 HD3 PRO A 74 25.093 30.658 27.718 1.00 0.00 H new ATOM 1151 N ASP A 75 23.342 28.566 31.271 1.00 0.00 N ATOM 1152 CA ASP A 75 22.400 28.000 32.284 1.00 0.00 C ATOM 1153 C ASP A 75 22.085 26.538 31.937 1.00 0.00 C ATOM 1154 O ASP A 75 22.572 26.003 30.942 1.00 0.00 O ATOM 1155 CB ASP A 75 21.144 28.886 32.233 1.00 0.00 C ATOM 1156 CG ASP A 75 20.076 28.276 31.316 1.00 0.00 C ATOM 1157 OD1 ASP A 75 19.475 27.295 31.721 1.00 0.00 O ATOM 1158 OD2 ASP A 75 19.871 28.804 30.238 1.00 0.00 O ATOM 0 H ASP A 75 22.926 29.204 30.593 1.00 0.00 H new ATOM 0 HA ASP A 75 22.820 27.997 33.290 1.00 0.00 H new ATOM 0 HB2 ASP A 75 20.739 29.007 33.238 1.00 0.00 H new ATOM 0 HB3 ASP A 75 21.411 29.880 31.875 1.00 0.00 H new ATOM 1163 N LYS A 76 21.301 25.878 32.746 1.00 0.00 N ATOM 1164 CA LYS A 76 20.977 24.452 32.472 1.00 0.00 C ATOM 1165 C LYS A 76 19.487 24.271 32.147 1.00 0.00 C ATOM 1166 O LYS A 76 18.616 24.876 32.764 1.00 0.00 O ATOM 1167 CB LYS A 76 21.335 23.735 33.771 1.00 0.00 C ATOM 1168 CG LYS A 76 22.849 23.509 33.826 1.00 0.00 C ATOM 1169 CD LYS A 76 23.259 22.494 32.755 1.00 0.00 C ATOM 1170 CE LYS A 76 24.466 23.024 31.977 1.00 0.00 C ATOM 1171 NZ LYS A 76 24.461 22.262 30.699 1.00 0.00 N ATOM 0 H LYS A 76 20.871 26.267 33.585 1.00 0.00 H new ATOM 0 HA LYS A 76 21.519 24.064 31.610 1.00 0.00 H new ATOM 0 HB2 LYS A 76 21.013 24.328 34.627 1.00 0.00 H new ATOM 0 HB3 LYS A 76 20.811 22.781 33.829 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.373 24.451 33.667 1.00 0.00 H new ATOM 0 HG3 LYS A 76 23.137 23.147 34.813 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.505 21.539 33.220 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.427 22.312 32.075 1.00 0.00 H new ATOM 0 HE2 LYS A 76 24.381 24.096 31.798 1.00 0.00 H new ATOM 0 HE3 LYS A 76 25.393 22.865 32.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 25.261 22.569 30.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 24.549 21.246 30.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 23.570 22.438 30.193 1.00 0.00 H new ATOM 1185 N ALA A 77 19.193 23.432 31.189 1.00 0.00 N ATOM 1186 CA ALA A 77 17.774 23.164 30.798 1.00 0.00 C ATOM 1187 C ALA A 77 17.177 22.121 31.764 1.00 0.00 C ATOM 1188 O ALA A 77 17.059 22.386 32.950 1.00 0.00 O ATOM 1189 CB ALA A 77 17.910 22.631 29.377 1.00 0.00 C ATOM 0 H ALA A 77 19.886 22.912 30.651 1.00 0.00 H new ATOM 0 HA ALA A 77 17.111 24.028 30.844 1.00 0.00 H new ATOM 0 HB1 ALA A 77 16.922 22.397 28.980 1.00 0.00 H new ATOM 0 HB2 ALA A 77 18.384 23.386 28.749 1.00 0.00 H new ATOM 0 HB3 ALA A 77 18.522 21.729 29.384 1.00 0.00 H new ATOM 1195 N ASN A 78 16.860 20.913 31.328 1.00 0.00 N ATOM 1196 CA ASN A 78 16.374 19.908 32.325 1.00 0.00 C ATOM 1197 C ASN A 78 17.449 19.737 33.386 1.00 0.00 C ATOM 1198 O ASN A 78 17.140 19.512 34.555 1.00 0.00 O ATOM 1199 CB ASN A 78 16.140 18.571 31.603 1.00 0.00 C ATOM 1200 CG ASN A 78 14.788 18.569 30.884 1.00 0.00 C ATOM 1201 OD1 ASN A 78 14.651 17.975 29.816 1.00 0.00 O ATOM 1202 ND2 ASN A 78 13.770 19.193 31.415 1.00 0.00 N ATOM 0 H ASN A 78 16.916 20.595 30.361 1.00 0.00 H new ATOM 0 HA ASN A 78 15.444 20.237 32.788 1.00 0.00 H new ATOM 0 HB2 ASN A 78 16.940 18.397 30.883 1.00 0.00 H new ATOM 0 HB3 ASN A 78 16.175 17.753 32.323 1.00 0.00 H new ATOM 0 HD21 ASN A 78 12.865 19.186 30.944 1.00 0.00 H new ATOM 0 HD22 ASN A 78 13.880 19.687 32.301 1.00 0.00 H new ATOM 1209 N PRO A 79 18.688 19.913 32.982 1.00 0.00 N ATOM 1210 CA PRO A 79 19.806 19.846 33.963 1.00 0.00 C ATOM 1211 C PRO A 79 19.588 20.946 35.025 1.00 0.00 C ATOM 1212 O PRO A 79 20.159 20.903 36.113 1.00 0.00 O ATOM 1213 CB PRO A 79 21.021 20.095 33.052 1.00 0.00 C ATOM 1214 CG PRO A 79 20.464 20.869 31.926 1.00 0.00 C ATOM 1215 CD PRO A 79 19.190 20.173 31.627 1.00 0.00 C ATOM 0 HA PRO A 79 19.909 18.921 34.530 1.00 0.00 H new ATOM 0 HB2 PRO A 79 21.803 20.650 33.571 1.00 0.00 H new ATOM 0 HB3 PRO A 79 21.465 19.159 32.713 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.298 21.911 32.198 1.00 0.00 H new ATOM 0 HG3 PRO A 79 21.134 20.867 31.066 1.00 0.00 H new ATOM 0 HD2 PRO A 79 18.507 20.794 31.046 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.345 19.254 31.061 1.00 0.00 H new ATOM 1223 N ARG A 80 18.733 21.917 34.728 1.00 0.00 N ATOM 1224 CA ARG A 80 18.433 22.993 35.708 1.00 0.00 C ATOM 1225 C ARG A 80 18.062 22.345 37.047 1.00 0.00 C ATOM 1226 O ARG A 80 18.730 22.533 38.064 1.00 0.00 O ATOM 1227 CB ARG A 80 17.229 23.759 35.160 1.00 0.00 C ATOM 1228 CG ARG A 80 17.163 25.144 35.809 1.00 0.00 C ATOM 1229 CD ARG A 80 16.191 25.116 36.992 1.00 0.00 C ATOM 1230 NE ARG A 80 14.963 25.806 36.498 1.00 0.00 N ATOM 1231 CZ ARG A 80 14.055 26.240 37.338 1.00 0.00 C ATOM 1232 NH1 ARG A 80 14.204 26.080 38.628 1.00 0.00 N ATOM 1233 NH2 ARG A 80 12.991 26.840 36.880 1.00 0.00 N ATOM 0 H ARG A 80 18.237 21.996 33.840 1.00 0.00 H new ATOM 0 HA ARG A 80 19.284 23.657 35.857 1.00 0.00 H new ATOM 0 HB2 ARG A 80 17.310 23.857 34.077 1.00 0.00 H new ATOM 0 HB3 ARG A 80 16.311 23.207 35.363 1.00 0.00 H new ATOM 0 HG2 ARG A 80 18.154 25.445 36.148 1.00 0.00 H new ATOM 0 HG3 ARG A 80 16.838 25.884 35.077 1.00 0.00 H new ATOM 0 HD2 ARG A 80 15.973 24.093 37.300 1.00 0.00 H new ATOM 0 HD3 ARG A 80 16.609 25.627 37.859 1.00 0.00 H new ATOM 0 HE ARG A 80 14.829 25.941 35.496 1.00 0.00 H new ATOM 0 HH11 ARG A 80 15.035 25.613 38.991 1.00 0.00 H new ATOM 0 HH12 ARG A 80 13.490 26.423 39.270 1.00 0.00 H new ATOM 0 HH21 ARG A 80 12.871 26.968 35.875 1.00 0.00 H new ATOM 0 HH22 ARG A 80 12.280 27.181 37.527 1.00 0.00 H new ATOM 1247 N GLN A 81 17.007 21.566 37.055 1.00 0.00 N ATOM 1248 CA GLN A 81 16.563 20.866 38.304 1.00 0.00 C ATOM 1249 C GLN A 81 17.735 20.110 38.972 1.00 0.00 C ATOM 1250 O GLN A 81 17.813 20.011 40.196 1.00 0.00 O ATOM 1251 CB GLN A 81 15.489 19.878 37.844 1.00 0.00 C ATOM 1252 CG GLN A 81 14.167 20.620 37.626 1.00 0.00 C ATOM 1253 CD GLN A 81 13.975 20.895 36.134 1.00 0.00 C ATOM 1254 OE1 GLN A 81 14.607 21.789 35.575 1.00 0.00 O ATOM 1255 NE2 GLN A 81 13.128 20.172 35.454 1.00 0.00 N ATOM 0 H GLN A 81 16.426 21.382 36.237 1.00 0.00 H new ATOM 0 HA GLN A 81 16.191 21.572 39.046 1.00 0.00 H new ATOM 0 HB2 GLN A 81 15.801 19.391 36.920 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.359 19.094 38.590 1.00 0.00 H new ATOM 0 HG2 GLN A 81 13.337 20.025 38.006 1.00 0.00 H new ATOM 0 HG3 GLN A 81 14.168 21.558 38.182 1.00 0.00 H new ATOM 0 HE21 GLN A 81 12.603 19.430 35.918 1.00 0.00 H new ATOM 0 HE22 GLN A 81 12.990 20.349 34.459 1.00 0.00 H new ATOM 1264 N HIS A 82 18.647 19.572 38.187 1.00 0.00 N ATOM 1265 CA HIS A 82 19.802 18.820 38.775 1.00 0.00 C ATOM 1266 C HIS A 82 20.735 19.809 39.506 1.00 0.00 C ATOM 1267 O HIS A 82 21.213 19.550 40.615 1.00 0.00 O ATOM 1268 CB HIS A 82 20.517 18.178 37.584 1.00 0.00 C ATOM 1269 CG HIS A 82 21.117 16.867 38.010 1.00 0.00 C ATOM 1270 ND1 HIS A 82 20.374 15.888 38.652 1.00 0.00 N ATOM 1271 CD2 HIS A 82 22.388 16.359 37.899 1.00 0.00 C ATOM 1272 CE1 HIS A 82 21.196 14.852 38.901 1.00 0.00 C ATOM 1273 NE2 HIS A 82 22.435 15.086 38.462 1.00 0.00 N ATOM 0 H HIS A 82 18.638 19.623 37.168 1.00 0.00 H new ATOM 0 HA HIS A 82 19.489 18.068 39.500 1.00 0.00 H new ATOM 0 HB2 HIS A 82 19.814 18.020 36.766 1.00 0.00 H new ATOM 0 HB3 HIS A 82 21.296 18.843 37.212 1.00 0.00 H new ATOM 0 HD2 HIS A 82 23.224 16.869 37.444 1.00 0.00 H new ATOM 0 HE1 HIS A 82 20.891 13.942 39.396 1.00 0.00 H new ATOM 0 HE2 HIS A 82 23.242 14.466 38.525 1.00 0.00 H new ATOM 1281 N ARG A 83 20.965 20.957 38.927 1.00 0.00 N ATOM 1282 CA ARG A 83 21.818 21.984 39.598 1.00 0.00 C ATOM 1283 C ARG A 83 21.085 22.509 40.838 1.00 0.00 C ATOM 1284 O ARG A 83 21.700 22.954 41.820 1.00 0.00 O ATOM 1285 CB ARG A 83 21.999 23.096 38.562 1.00 0.00 C ATOM 1286 CG ARG A 83 23.105 24.049 39.020 1.00 0.00 C ATOM 1287 CD ARG A 83 23.325 25.125 37.952 1.00 0.00 C ATOM 1288 NE ARG A 83 22.097 25.973 37.998 1.00 0.00 N ATOM 1289 CZ ARG A 83 21.868 26.869 37.066 1.00 0.00 C ATOM 1290 NH1 ARG A 83 22.710 27.037 36.079 1.00 0.00 N ATOM 1291 NH2 ARG A 83 20.789 27.601 37.125 1.00 0.00 N ATOM 0 H ARG A 83 20.598 21.230 38.015 1.00 0.00 H new ATOM 0 HA ARG A 83 22.780 21.590 39.926 1.00 0.00 H new ATOM 0 HB2 ARG A 83 22.253 22.666 37.593 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.065 23.642 38.433 1.00 0.00 H new ATOM 0 HG2 ARG A 83 22.831 24.513 39.968 1.00 0.00 H new ATOM 0 HG3 ARG A 83 24.029 23.496 39.191 1.00 0.00 H new ATOM 0 HD2 ARG A 83 24.218 25.713 38.162 1.00 0.00 H new ATOM 0 HD3 ARG A 83 23.461 24.680 36.966 1.00 0.00 H new ATOM 0 HE ARG A 83 21.430 25.855 38.760 1.00 0.00 H new ATOM 0 HH11 ARG A 83 23.555 26.469 36.028 1.00 0.00 H new ATOM 0 HH12 ARG A 83 22.521 27.736 35.361 1.00 0.00 H new ATOM 0 HH21 ARG A 83 20.129 27.475 37.892 1.00 0.00 H new ATOM 0 HH22 ARG A 83 20.606 28.299 36.404 1.00 0.00 H new ATOM 1305 N LEU A 84 19.775 22.436 40.835 1.00 0.00 N ATOM 1306 CA LEU A 84 19.035 22.907 42.016 1.00 0.00 C ATOM 1307 C LEU A 84 19.151 21.819 43.082 1.00 0.00 C ATOM 1308 O LEU A 84 19.211 22.101 44.281 1.00 0.00 O ATOM 1309 CB LEU A 84 17.588 23.115 41.598 1.00 0.00 C ATOM 1310 CG LEU A 84 16.896 24.201 42.473 1.00 0.00 C ATOM 1311 CD1 LEU A 84 17.882 24.985 43.390 1.00 0.00 C ATOM 1312 CD2 LEU A 84 16.211 25.192 41.541 1.00 0.00 C ATOM 0 H LEU A 84 19.205 22.074 40.071 1.00 0.00 H new ATOM 0 HA LEU A 84 19.425 23.844 42.413 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.549 23.411 40.550 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.044 22.175 41.684 1.00 0.00 H new ATOM 0 HG LEU A 84 16.192 23.689 43.129 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.330 25.724 43.970 1.00 0.00 H new ATOM 0 HD12 LEU A 84 18.380 24.291 44.067 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.628 25.489 42.775 1.00 0.00 H new ATOM 0 HD21 LEU A 84 15.718 25.965 42.131 1.00 0.00 H new ATOM 0 HD22 LEU A 84 16.954 25.652 40.889 1.00 0.00 H new ATOM 0 HD23 LEU A 84 15.471 24.670 40.935 1.00 0.00 H new ATOM 1324 N ASP A 85 19.269 20.578 42.668 1.00 0.00 N ATOM 1325 CA ASP A 85 19.475 19.487 43.662 1.00 0.00 C ATOM 1326 C ASP A 85 20.795 19.775 44.382 1.00 0.00 C ATOM 1327 O ASP A 85 20.931 19.603 45.599 1.00 0.00 O ATOM 1328 CB ASP A 85 19.582 18.208 42.839 1.00 0.00 C ATOM 1329 CG ASP A 85 18.194 17.588 42.665 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.425 18.118 41.880 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.924 16.594 43.319 1.00 0.00 O ATOM 0 H ASP A 85 19.231 20.280 41.693 1.00 0.00 H new ATOM 0 HA ASP A 85 18.678 19.405 44.401 1.00 0.00 H new ATOM 0 HB2 ASP A 85 20.018 18.427 41.864 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.247 17.500 43.334 1.00 0.00 H new ATOM 1336 N LYS A 86 21.759 20.268 43.645 1.00 0.00 N ATOM 1337 CA LYS A 86 23.075 20.637 44.260 1.00 0.00 C ATOM 1338 C LYS A 86 22.845 21.649 45.405 1.00 0.00 C ATOM 1339 O LYS A 86 23.279 21.450 46.544 1.00 0.00 O ATOM 1340 CB LYS A 86 23.877 21.281 43.128 1.00 0.00 C ATOM 1341 CG LYS A 86 25.350 21.363 43.529 1.00 0.00 C ATOM 1342 CD LYS A 86 26.136 22.104 42.446 1.00 0.00 C ATOM 1343 CE LYS A 86 26.133 23.604 42.749 1.00 0.00 C ATOM 1344 NZ LYS A 86 27.056 24.200 41.743 1.00 0.00 N ATOM 0 H LYS A 86 21.693 20.432 42.640 1.00 0.00 H new ATOM 0 HA LYS A 86 23.595 19.778 44.684 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.770 20.697 42.214 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.491 22.278 42.916 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.449 21.881 44.483 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.756 20.361 43.666 1.00 0.00 H new ATOM 0 HD2 LYS A 86 27.160 21.732 42.406 1.00 0.00 H new ATOM 0 HD3 LYS A 86 25.691 21.919 41.468 1.00 0.00 H new ATOM 0 HE2 LYS A 86 25.130 24.023 42.662 1.00 0.00 H new ATOM 0 HE3 LYS A 86 26.474 23.803 43.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 27.107 25.229 41.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 28.004 23.787 41.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 26.702 24.001 40.786 1.00 0.00 H new ATOM 1358 N ILE A 87 22.150 22.721 45.126 1.00 0.00 N ATOM 1359 CA ILE A 87 21.855 23.752 46.187 1.00 0.00 C ATOM 1360 C ILE A 87 21.190 23.094 47.436 1.00 0.00 C ATOM 1361 O ILE A 87 21.572 23.353 48.575 1.00 0.00 O ATOM 1362 CB ILE A 87 20.933 24.734 45.464 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.725 25.452 44.361 1.00 0.00 C ATOM 1364 CG2 ILE A 87 20.391 25.760 46.439 1.00 0.00 C ATOM 1365 CD1 ILE A 87 22.818 26.337 44.985 1.00 0.00 C ATOM 0 H ILE A 87 21.768 22.935 44.205 1.00 0.00 H new ATOM 0 HA ILE A 87 22.742 24.244 46.587 1.00 0.00 H new ATOM 0 HB ILE A 87 20.099 24.184 45.028 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.177 24.720 43.692 1.00 0.00 H new ATOM 0 HG13 ILE A 87 21.052 26.062 43.758 1.00 0.00 H new ATOM 0 HG21 ILE A 87 19.736 26.453 45.911 1.00 0.00 H new ATOM 0 HG22 ILE A 87 19.828 25.254 47.223 1.00 0.00 H new ATOM 0 HG23 ILE A 87 21.219 26.311 46.885 1.00 0.00 H new ATOM 0 HD11 ILE A 87 23.373 26.841 44.194 1.00 0.00 H new ATOM 0 HD12 ILE A 87 22.357 27.080 45.635 1.00 0.00 H new ATOM 0 HD13 ILE A 87 23.499 25.717 45.568 1.00 0.00 H new ATOM 1377 N THR A 88 20.240 22.210 47.247 1.00 0.00 N ATOM 1378 CA THR A 88 19.617 21.501 48.417 1.00 0.00 C ATOM 1379 C THR A 88 20.752 20.888 49.255 1.00 0.00 C ATOM 1380 O THR A 88 20.777 20.974 50.482 1.00 0.00 O ATOM 1381 CB THR A 88 18.736 20.409 47.803 1.00 0.00 C ATOM 1382 OG1 THR A 88 18.075 20.927 46.657 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.698 19.946 48.825 1.00 0.00 C ATOM 0 H THR A 88 19.867 21.947 46.335 1.00 0.00 H new ATOM 0 HA THR A 88 19.029 22.153 49.063 1.00 0.00 H new ATOM 0 HB THR A 88 19.358 19.562 47.515 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.512 20.230 46.261 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.074 19.169 48.383 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.205 19.548 49.704 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.074 20.790 49.118 1.00 0.00 H new ATOM 1391 N HIS A 89 21.736 20.320 48.600 1.00 0.00 N ATOM 1392 CA HIS A 89 22.907 19.776 49.350 1.00 0.00 C ATOM 1393 C HIS A 89 23.493 20.934 50.167 1.00 0.00 C ATOM 1394 O HIS A 89 23.863 20.779 51.328 1.00 0.00 O ATOM 1395 CB HIS A 89 23.896 19.299 48.286 1.00 0.00 C ATOM 1396 CG HIS A 89 24.689 18.142 48.827 1.00 0.00 C ATOM 1397 ND1 HIS A 89 24.080 17.012 49.348 1.00 0.00 N ATOM 1398 CD2 HIS A 89 26.041 17.926 48.939 1.00 0.00 C ATOM 1399 CE1 HIS A 89 25.053 16.174 49.747 1.00 0.00 C ATOM 1400 NE2 HIS A 89 26.269 16.682 49.521 1.00 0.00 N ATOM 0 H HIS A 89 21.778 20.211 47.587 1.00 0.00 H new ATOM 0 HA HIS A 89 22.659 18.957 50.025 1.00 0.00 H new ATOM 0 HB2 HIS A 89 23.361 18.998 47.385 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.564 20.112 48.004 1.00 0.00 H new ATOM 0 HD2 HIS A 89 26.810 18.616 48.624 1.00 0.00 H new ATOM 0 HE1 HIS A 89 24.874 15.208 50.196 1.00 0.00 H new ATOM 0 HE2 HIS A 89 27.170 16.251 49.730 1.00 0.00 H new ATOM 1408 N ALA A 90 23.522 22.121 49.583 1.00 0.00 N ATOM 1409 CA ALA A 90 24.013 23.321 50.333 1.00 0.00 C ATOM 1410 C ALA A 90 23.198 23.427 51.615 1.00 0.00 C ATOM 1411 O ALA A 90 23.706 23.802 52.668 1.00 0.00 O ATOM 1412 CB ALA A 90 23.754 24.548 49.434 1.00 0.00 C ATOM 0 H ALA A 90 23.227 22.302 48.624 1.00 0.00 H new ATOM 0 HA ALA A 90 25.072 23.256 50.581 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.097 25.450 49.941 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.295 24.432 48.495 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.686 24.631 49.230 1.00 0.00 H new ATOM 1418 N CYS A 91 21.944 23.044 51.557 1.00 0.00 N ATOM 1419 CA CYS A 91 21.102 23.072 52.792 1.00 0.00 C ATOM 1420 C CYS A 91 21.717 22.122 53.818 1.00 0.00 C ATOM 1421 O CYS A 91 22.024 22.501 54.952 1.00 0.00 O ATOM 1422 CB CYS A 91 19.711 22.552 52.361 1.00 0.00 C ATOM 1423 SG CYS A 91 18.888 21.673 53.737 1.00 0.00 S ATOM 0 H CYS A 91 21.472 22.716 50.714 1.00 0.00 H new ATOM 0 HA CYS A 91 21.035 24.067 53.233 1.00 0.00 H new ATOM 0 HB2 CYS A 91 19.091 23.387 52.035 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.817 21.882 51.508 1.00 0.00 H new ATOM 0 HG CYS A 91 17.726 22.211 53.962 1.00 0.00 H new ATOM 1429 N ARG A 92 21.908 20.893 53.430 1.00 0.00 N ATOM 1430 CA ARG A 92 22.509 19.897 54.363 1.00 0.00 C ATOM 1431 C ARG A 92 23.770 20.472 55.015 1.00 0.00 C ATOM 1432 O ARG A 92 23.868 20.561 56.229 1.00 0.00 O ATOM 1433 CB ARG A 92 22.863 18.696 53.486 1.00 0.00 C ATOM 1434 CG ARG A 92 23.104 17.471 54.368 1.00 0.00 C ATOM 1435 CD ARG A 92 21.768 16.959 54.913 1.00 0.00 C ATOM 1436 NE ARG A 92 20.986 16.552 53.708 1.00 0.00 N ATOM 1437 CZ ARG A 92 19.957 17.257 53.295 1.00 0.00 C ATOM 1438 NH1 ARG A 92 19.580 18.341 53.926 1.00 0.00 N ATOM 1439 NH2 ARG A 92 19.298 16.870 52.238 1.00 0.00 N ATOM 0 H ARG A 92 21.674 20.533 52.505 1.00 0.00 H new ATOM 0 HA ARG A 92 21.828 19.628 55.171 1.00 0.00 H new ATOM 0 HB2 ARG A 92 22.055 18.496 52.782 1.00 0.00 H new ATOM 0 HB3 ARG A 92 23.754 18.913 52.896 1.00 0.00 H new ATOM 0 HG2 ARG A 92 23.598 16.688 53.793 1.00 0.00 H new ATOM 0 HG3 ARG A 92 23.769 17.729 55.192 1.00 0.00 H new ATOM 0 HD2 ARG A 92 21.915 16.118 55.590 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.249 17.734 55.476 1.00 0.00 H new ATOM 0 HE ARG A 92 21.255 15.712 53.196 1.00 0.00 H new ATOM 0 HH11 ARG A 92 20.088 18.652 54.754 1.00 0.00 H new ATOM 0 HH12 ARG A 92 18.778 18.874 53.589 1.00 0.00 H new ATOM 0 HH21 ARG A 92 19.583 16.027 51.740 1.00 0.00 H new ATOM 0 HH22 ARG A 92 18.498 17.411 51.910 1.00 0.00 H new ATOM 1453 N LEU A 93 24.732 20.858 54.224 1.00 0.00 N ATOM 1454 CA LEU A 93 26.003 21.420 54.779 1.00 0.00 C ATOM 1455 C LEU A 93 25.751 22.619 55.711 1.00 0.00 C ATOM 1456 O LEU A 93 26.461 22.794 56.711 1.00 0.00 O ATOM 1457 CB LEU A 93 26.803 21.863 53.549 1.00 0.00 C ATOM 1458 CG LEU A 93 27.881 20.821 53.225 1.00 0.00 C ATOM 1459 CD1 LEU A 93 28.863 20.711 54.397 1.00 0.00 C ATOM 1460 CD2 LEU A 93 27.221 19.460 52.982 1.00 0.00 C ATOM 0 H LEU A 93 24.695 20.809 53.206 1.00 0.00 H new ATOM 0 HA LEU A 93 26.527 20.681 55.385 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.136 21.987 52.696 1.00 0.00 H new ATOM 0 HB3 LEU A 93 27.266 22.832 53.735 1.00 0.00 H new ATOM 0 HG LEU A 93 28.421 21.129 52.330 1.00 0.00 H new ATOM 0 HD11 LEU A 93 29.627 19.970 54.163 1.00 0.00 H new ATOM 0 HD12 LEU A 93 29.336 21.678 54.568 1.00 0.00 H new ATOM 0 HD13 LEU A 93 28.325 20.407 55.295 1.00 0.00 H new ATOM 0 HD21 LEU A 93 27.987 18.720 52.752 1.00 0.00 H new ATOM 0 HD22 LEU A 93 26.678 19.154 53.876 1.00 0.00 H new ATOM 0 HD23 LEU A 93 26.527 19.536 52.145 1.00 0.00 H new ATOM 1472 N LEU A 94 24.778 23.450 55.403 1.00 0.00 N ATOM 1473 CA LEU A 94 24.513 24.664 56.249 1.00 0.00 C ATOM 1474 C LEU A 94 23.962 24.248 57.613 1.00 0.00 C ATOM 1475 O LEU A 94 23.899 25.048 58.545 1.00 0.00 O ATOM 1476 CB LEU A 94 23.432 25.445 55.465 1.00 0.00 C ATOM 1477 CG LEU A 94 24.057 26.598 54.662 1.00 0.00 C ATOM 1478 CD1 LEU A 94 23.853 26.356 53.162 1.00 0.00 C ATOM 1479 CD2 LEU A 94 23.369 27.915 55.031 1.00 0.00 C ATOM 0 H LEU A 94 24.156 23.340 54.602 1.00 0.00 H new ATOM 0 HA LEU A 94 25.414 25.250 56.430 1.00 0.00 H new ATOM 0 HB2 LEU A 94 22.908 24.769 54.789 1.00 0.00 H new ATOM 0 HB3 LEU A 94 22.690 25.841 56.158 1.00 0.00 H new ATOM 0 HG LEU A 94 25.121 26.649 54.894 1.00 0.00 H new ATOM 0 HD11 LEU A 94 24.298 27.176 52.597 1.00 0.00 H new ATOM 0 HD12 LEU A 94 24.330 25.418 52.877 1.00 0.00 H new ATOM 0 HD13 LEU A 94 22.786 26.302 52.944 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.814 28.730 54.460 1.00 0.00 H new ATOM 0 HD22 LEU A 94 22.306 27.848 54.799 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.496 28.106 56.097 1.00 0.00 H new ATOM 1491 N GLU A 95 23.606 23.005 57.764 1.00 0.00 N ATOM 1492 CA GLU A 95 23.113 22.530 59.086 1.00 0.00 C ATOM 1493 C GLU A 95 23.759 21.179 59.424 1.00 0.00 C ATOM 1494 O GLU A 95 23.568 20.631 60.508 1.00 0.00 O ATOM 1495 CB GLU A 95 21.596 22.401 58.937 1.00 0.00 C ATOM 1496 CG GLU A 95 20.991 21.873 60.244 1.00 0.00 C ATOM 1497 CD GLU A 95 21.167 22.906 61.363 1.00 0.00 C ATOM 1498 OE1 GLU A 95 21.845 23.895 61.137 1.00 0.00 O ATOM 1499 OE2 GLU A 95 20.616 22.689 62.431 1.00 0.00 O ATOM 0 H GLU A 95 23.635 22.297 57.030 1.00 0.00 H new ATOM 0 HA GLU A 95 23.367 23.213 59.896 1.00 0.00 H new ATOM 0 HB2 GLU A 95 21.162 23.369 58.689 1.00 0.00 H new ATOM 0 HB3 GLU A 95 21.358 21.725 58.116 1.00 0.00 H new ATOM 0 HG2 GLU A 95 19.932 21.657 60.102 1.00 0.00 H new ATOM 0 HG3 GLU A 95 21.473 20.936 60.524 1.00 0.00 H new ATOM 1506 N GLN A 96 24.539 20.642 58.521 1.00 0.00 N ATOM 1507 CA GLN A 96 25.212 19.345 58.783 1.00 0.00 C ATOM 1508 C GLN A 96 26.490 19.597 59.575 1.00 0.00 C ATOM 1509 O GLN A 96 26.788 18.891 60.537 1.00 0.00 O ATOM 1510 CB GLN A 96 25.532 18.765 57.402 1.00 0.00 C ATOM 1511 CG GLN A 96 26.247 17.419 57.556 1.00 0.00 C ATOM 1512 CD GLN A 96 27.366 17.311 56.515 1.00 0.00 C ATOM 1513 OE1 GLN A 96 27.271 16.526 55.573 1.00 0.00 O ATOM 1514 NE2 GLN A 96 28.427 18.061 56.635 1.00 0.00 N ATOM 0 H GLN A 96 24.737 21.053 57.609 1.00 0.00 H new ATOM 0 HA GLN A 96 24.595 18.659 59.363 1.00 0.00 H new ATOM 0 HB2 GLN A 96 24.613 18.635 56.830 1.00 0.00 H new ATOM 0 HB3 GLN A 96 26.160 19.459 56.843 1.00 0.00 H new ATOM 0 HG2 GLN A 96 26.661 17.328 58.560 1.00 0.00 H new ATOM 0 HG3 GLN A 96 25.537 16.602 57.428 1.00 0.00 H new ATOM 0 HE21 GLN A 96 28.506 18.712 57.416 1.00 0.00 H new ATOM 0 HE22 GLN A 96 29.178 17.996 55.947 1.00 0.00 H new ATOM 1523 N GLU A 97 27.251 20.599 59.208 1.00 0.00 N ATOM 1524 CA GLU A 97 28.495 20.870 59.984 1.00 0.00 C ATOM 1525 C GLU A 97 28.171 21.789 61.166 1.00 0.00 C ATOM 1526 O GLU A 97 27.030 21.854 61.621 1.00 0.00 O ATOM 1527 CB GLU A 97 29.451 21.549 58.997 1.00 0.00 C ATOM 1528 CG GLU A 97 28.915 22.932 58.607 1.00 0.00 C ATOM 1529 CD GLU A 97 29.549 23.368 57.286 1.00 0.00 C ATOM 1530 OE1 GLU A 97 30.723 23.704 57.296 1.00 0.00 O ATOM 1531 OE2 GLU A 97 28.851 23.361 56.286 1.00 0.00 O ATOM 0 H GLU A 97 27.069 21.226 58.424 1.00 0.00 H new ATOM 0 HA GLU A 97 28.939 19.964 60.397 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.439 21.647 59.446 1.00 0.00 H new ATOM 0 HB3 GLU A 97 29.565 20.931 58.107 1.00 0.00 H new ATOM 0 HG2 GLU A 97 27.830 22.899 58.509 1.00 0.00 H new ATOM 0 HG3 GLU A 97 29.143 23.656 59.389 1.00 0.00 H new ATOM 1538 N THR A 98 29.135 22.516 61.658 1.00 0.00 N ATOM 1539 CA THR A 98 28.854 23.444 62.790 1.00 0.00 C ATOM 1540 C THR A 98 28.823 24.891 62.259 1.00 0.00 C ATOM 1541 O THR A 98 27.751 25.482 62.158 1.00 0.00 O ATOM 1542 CB THR A 98 29.969 23.198 63.822 1.00 0.00 C ATOM 1543 OG1 THR A 98 29.670 22.015 64.552 1.00 0.00 O ATOM 1544 CG2 THR A 98 30.062 24.378 64.794 1.00 0.00 C ATOM 0 H THR A 98 30.100 22.509 61.328 1.00 0.00 H new ATOM 0 HA THR A 98 27.885 23.275 63.260 1.00 0.00 H new ATOM 0 HB THR A 98 30.921 23.091 63.302 1.00 0.00 H new ATOM 0 HG1 THR A 98 30.376 21.850 65.211 1.00 0.00 H new ATOM 0 HG21 THR A 98 30.855 24.191 65.519 1.00 0.00 H new ATOM 0 HG22 THR A 98 30.285 25.289 64.239 1.00 0.00 H new ATOM 0 HG23 THR A 98 29.113 24.495 65.317 1.00 0.00 H new ATOM 1552 N PRO A 99 29.972 25.421 61.901 1.00 0.00 N ATOM 1553 CA PRO A 99 30.025 26.796 61.344 1.00 0.00 C ATOM 1554 C PRO A 99 29.302 26.823 59.996 1.00 0.00 C ATOM 1555 O PRO A 99 29.418 25.886 59.207 1.00 0.00 O ATOM 1556 CB PRO A 99 31.520 27.074 61.187 1.00 0.00 C ATOM 1557 CG PRO A 99 32.144 25.723 61.087 1.00 0.00 C ATOM 1558 CD PRO A 99 31.313 24.815 61.952 1.00 0.00 C ATOM 0 HA PRO A 99 29.541 27.545 61.971 1.00 0.00 H new ATOM 0 HB2 PRO A 99 31.721 27.671 60.297 1.00 0.00 H new ATOM 0 HB3 PRO A 99 31.912 27.630 62.039 1.00 0.00 H new ATOM 0 HG2 PRO A 99 32.156 25.374 60.054 1.00 0.00 H new ATOM 0 HG3 PRO A 99 33.179 25.746 61.427 1.00 0.00 H new ATOM 0 HD2 PRO A 99 31.306 23.794 61.571 1.00 0.00 H new ATOM 0 HD3 PRO A 99 31.695 24.772 62.972 1.00 0.00 H new ATOM 1566 N VAL A 100 28.562 27.858 59.700 1.00 0.00 N ATOM 1567 CA VAL A 100 27.856 27.887 58.383 1.00 0.00 C ATOM 1568 C VAL A 100 28.866 28.259 57.305 1.00 0.00 C ATOM 1569 O VAL A 100 29.712 29.131 57.498 1.00 0.00 O ATOM 1570 CB VAL A 100 26.777 28.970 58.476 1.00 0.00 C ATOM 1571 CG1 VAL A 100 25.716 28.714 57.405 1.00 0.00 C ATOM 1572 CG2 VAL A 100 26.113 28.953 59.859 1.00 0.00 C ATOM 0 H VAL A 100 28.416 28.671 60.299 1.00 0.00 H new ATOM 0 HA VAL A 100 27.410 26.922 58.141 1.00 0.00 H new ATOM 0 HB VAL A 100 27.241 29.944 58.322 1.00 0.00 H new ATOM 0 HG11 VAL A 100 24.945 29.482 57.466 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.180 28.743 56.419 1.00 0.00 H new ATOM 0 HG13 VAL A 100 25.266 27.734 57.565 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.349 29.729 59.906 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.652 27.980 60.029 1.00 0.00 H new ATOM 0 HG23 VAL A 100 26.865 29.137 60.626 1.00 0.00 H new ATOM 1582 N THR A 101 28.818 27.595 56.188 1.00 0.00 N ATOM 1583 CA THR A 101 29.805 27.886 55.113 1.00 0.00 C ATOM 1584 C THR A 101 29.133 28.463 53.869 1.00 0.00 C ATOM 1585 O THR A 101 28.426 27.777 53.135 1.00 0.00 O ATOM 1586 CB THR A 101 30.457 26.546 54.775 1.00 0.00 C ATOM 1587 OG1 THR A 101 29.823 25.503 55.502 1.00 0.00 O ATOM 1588 CG2 THR A 101 31.938 26.594 55.146 1.00 0.00 C ATOM 0 H THR A 101 28.140 26.864 55.972 1.00 0.00 H new ATOM 0 HA THR A 101 30.529 28.629 55.448 1.00 0.00 H new ATOM 0 HB THR A 101 30.351 26.355 53.707 1.00 0.00 H new ATOM 0 HG1 THR A 101 30.454 25.125 56.149 1.00 0.00 H new ATOM 0 HG21 THR A 101 32.404 25.639 54.905 1.00 0.00 H new ATOM 0 HG22 THR A 101 32.428 27.389 54.584 1.00 0.00 H new ATOM 0 HG23 THR A 101 32.040 26.789 56.214 1.00 0.00 H new ATOM 1596 N LEU A 102 29.388 29.707 53.617 1.00 0.00 N ATOM 1597 CA LEU A 102 28.837 30.382 52.424 1.00 0.00 C ATOM 1598 C LEU A 102 30.013 31.010 51.675 1.00 0.00 C ATOM 1599 O LEU A 102 30.022 31.075 50.452 1.00 0.00 O ATOM 1600 CB LEU A 102 27.863 31.444 52.955 1.00 0.00 C ATOM 1601 CG LEU A 102 26.449 31.168 52.417 1.00 0.00 C ATOM 1602 CD1 LEU A 102 25.982 29.781 52.870 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.471 32.225 52.949 1.00 0.00 C ATOM 0 H LEU A 102 29.972 30.300 54.206 1.00 0.00 H new ATOM 0 HA LEU A 102 28.313 29.716 51.739 1.00 0.00 H new ATOM 0 HB2 LEU A 102 27.856 31.432 54.045 1.00 0.00 H new ATOM 0 HB3 LEU A 102 28.191 32.437 52.649 1.00 0.00 H new ATOM 0 HG LEU A 102 26.474 31.209 51.328 1.00 0.00 H new ATOM 0 HD11 LEU A 102 24.980 29.591 52.486 1.00 0.00 H new ATOM 0 HD12 LEU A 102 26.667 29.024 52.488 1.00 0.00 H new ATOM 0 HD13 LEU A 102 25.967 29.740 53.959 1.00 0.00 H new ATOM 0 HD21 LEU A 102 24.472 32.023 52.564 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.454 32.189 54.038 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.792 33.214 52.623 1.00 0.00 H new ATOM 1615 N GLU A 103 31.033 31.442 52.397 1.00 0.00 N ATOM 1616 CA GLU A 103 32.251 32.040 51.749 1.00 0.00 C ATOM 1617 C GLU A 103 32.663 31.269 50.477 1.00 0.00 C ATOM 1618 O GLU A 103 32.937 31.866 49.438 1.00 0.00 O ATOM 1619 CB GLU A 103 33.350 31.940 52.808 1.00 0.00 C ATOM 1620 CG GLU A 103 34.494 32.896 52.455 1.00 0.00 C ATOM 1621 CD GLU A 103 33.995 34.341 52.524 1.00 0.00 C ATOM 1622 OE1 GLU A 103 33.979 34.890 53.614 1.00 0.00 O ATOM 1623 OE2 GLU A 103 33.637 34.874 51.487 1.00 0.00 O ATOM 0 H GLU A 103 31.070 31.404 53.416 1.00 0.00 H new ATOM 0 HA GLU A 103 32.064 33.065 51.430 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.946 32.187 53.790 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.722 30.917 52.865 1.00 0.00 H new ATOM 0 HG2 GLU A 103 35.326 32.754 53.145 1.00 0.00 H new ATOM 0 HG3 GLU A 103 34.869 32.677 51.455 1.00 0.00 H new ATOM 1630 N ALA A 104 32.690 29.957 50.532 1.00 0.00 N ATOM 1631 CA ALA A 104 33.060 29.165 49.319 1.00 0.00 C ATOM 1632 C ALA A 104 32.006 29.404 48.233 1.00 0.00 C ATOM 1633 O ALA A 104 32.326 29.640 47.068 1.00 0.00 O ATOM 1634 CB ALA A 104 33.045 27.704 49.772 1.00 0.00 C ATOM 0 H ALA A 104 32.473 29.405 51.361 1.00 0.00 H new ATOM 0 HA ALA A 104 34.031 29.442 48.909 1.00 0.00 H new ATOM 0 HB1 ALA A 104 33.308 27.060 48.933 1.00 0.00 H new ATOM 0 HB2 ALA A 104 33.768 27.565 50.576 1.00 0.00 H new ATOM 0 HB3 ALA A 104 32.049 27.444 50.130 1.00 0.00 H new ATOM 1640 N LEU A 105 30.750 29.369 48.604 1.00 0.00 N ATOM 1641 CA LEU A 105 29.667 29.614 47.607 1.00 0.00 C ATOM 1642 C LEU A 105 29.781 31.052 47.094 1.00 0.00 C ATOM 1643 O LEU A 105 29.838 31.299 45.891 1.00 0.00 O ATOM 1644 CB LEU A 105 28.353 29.399 48.381 1.00 0.00 C ATOM 1645 CG LEU A 105 27.115 29.712 47.511 1.00 0.00 C ATOM 1646 CD1 LEU A 105 27.056 31.206 47.192 1.00 0.00 C ATOM 1647 CD2 LEU A 105 27.146 28.917 46.198 1.00 0.00 C ATOM 0 H LEU A 105 30.430 29.181 49.554 1.00 0.00 H new ATOM 0 HA LEU A 105 29.722 28.955 46.740 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.301 28.367 48.729 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.345 30.035 49.266 1.00 0.00 H new ATOM 0 HG LEU A 105 26.230 29.422 48.077 1.00 0.00 H new ATOM 0 HD11 LEU A 105 26.179 31.413 46.579 1.00 0.00 H new ATOM 0 HD12 LEU A 105 26.992 31.774 48.120 1.00 0.00 H new ATOM 0 HD13 LEU A 105 27.955 31.498 46.650 1.00 0.00 H new ATOM 0 HD21 LEU A 105 26.263 29.157 45.606 1.00 0.00 H new ATOM 0 HD22 LEU A 105 28.042 29.179 45.635 1.00 0.00 H new ATOM 0 HD23 LEU A 105 27.155 27.850 46.419 1.00 0.00 H new ATOM 1659 N ALA A 106 29.806 32.001 47.987 1.00 0.00 N ATOM 1660 CA ALA A 106 29.904 33.433 47.581 1.00 0.00 C ATOM 1661 C ALA A 106 31.093 33.671 46.640 1.00 0.00 C ATOM 1662 O ALA A 106 30.967 34.340 45.617 1.00 0.00 O ATOM 1663 CB ALA A 106 30.107 34.196 48.891 1.00 0.00 C ATOM 0 H ALA A 106 29.762 31.845 48.994 1.00 0.00 H new ATOM 0 HA ALA A 106 29.016 33.756 47.037 1.00 0.00 H new ATOM 0 HB1 ALA A 106 30.189 35.263 48.682 1.00 0.00 H new ATOM 0 HB2 ALA A 106 29.257 34.020 49.550 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.020 33.850 49.376 1.00 0.00 H new ATOM 1669 N ASP A 107 32.246 33.149 46.969 1.00 0.00 N ATOM 1670 CA ASP A 107 33.435 33.357 46.107 1.00 0.00 C ATOM 1671 C ASP A 107 33.268 32.652 44.753 1.00 0.00 C ATOM 1672 O ASP A 107 33.764 33.121 43.730 1.00 0.00 O ATOM 1673 CB ASP A 107 34.576 32.738 46.905 1.00 0.00 C ATOM 1674 CG ASP A 107 35.208 33.799 47.808 1.00 0.00 C ATOM 1675 OD1 ASP A 107 36.021 34.561 47.314 1.00 0.00 O ATOM 1676 OD2 ASP A 107 34.868 33.830 48.980 1.00 0.00 O ATOM 0 H ASP A 107 32.411 32.585 47.803 1.00 0.00 H new ATOM 0 HA ASP A 107 33.604 34.408 45.874 1.00 0.00 H new ATOM 0 HB2 ASP A 107 34.204 31.909 47.507 1.00 0.00 H new ATOM 0 HB3 ASP A 107 35.326 32.329 46.228 1.00 0.00 H new ATOM 1681 N GLN A 108 32.594 31.532 44.726 1.00 0.00 N ATOM 1682 CA GLN A 108 32.417 30.799 43.434 1.00 0.00 C ATOM 1683 C GLN A 108 31.404 31.509 42.522 1.00 0.00 C ATOM 1684 O GLN A 108 31.520 31.470 41.299 1.00 0.00 O ATOM 1685 CB GLN A 108 31.898 29.416 43.835 1.00 0.00 C ATOM 1686 CG GLN A 108 31.879 28.498 42.608 1.00 0.00 C ATOM 1687 CD GLN A 108 30.432 28.247 42.175 1.00 0.00 C ATOM 1688 OE1 GLN A 108 29.882 28.993 41.368 1.00 0.00 O ATOM 1689 NE2 GLN A 108 29.782 27.231 42.674 1.00 0.00 N ATOM 0 H GLN A 108 32.160 31.093 45.538 1.00 0.00 H new ATOM 0 HA GLN A 108 33.349 30.748 42.870 1.00 0.00 H new ATOM 0 HB2 GLN A 108 32.533 28.989 44.611 1.00 0.00 H new ATOM 0 HB3 GLN A 108 30.895 29.500 44.254 1.00 0.00 H new ATOM 0 HG2 GLN A 108 32.439 28.954 41.792 1.00 0.00 H new ATOM 0 HG3 GLN A 108 32.368 27.552 42.841 1.00 0.00 H new ATOM 0 HE21 GLN A 108 30.239 26.612 43.344 1.00 0.00 H new ATOM 0 HE22 GLN A 108 28.817 27.056 42.394 1.00 0.00 H new ATOM 1698 N VAL A 109 30.408 32.142 43.083 1.00 0.00 N ATOM 1699 CA VAL A 109 29.388 32.831 42.236 1.00 0.00 C ATOM 1700 C VAL A 109 29.666 34.336 42.152 1.00 0.00 C ATOM 1701 O VAL A 109 29.088 35.034 41.324 1.00 0.00 O ATOM 1702 CB VAL A 109 28.050 32.580 42.928 1.00 0.00 C ATOM 1703 CG1 VAL A 109 26.909 32.959 41.981 1.00 0.00 C ATOM 1704 CG2 VAL A 109 27.929 31.103 43.302 1.00 0.00 C ATOM 0 H VAL A 109 30.256 32.212 44.089 1.00 0.00 H new ATOM 0 HA VAL A 109 29.401 32.453 41.214 1.00 0.00 H new ATOM 0 HB VAL A 109 27.994 33.186 43.832 1.00 0.00 H new ATOM 0 HG11 VAL A 109 25.953 32.780 42.473 1.00 0.00 H new ATOM 0 HG12 VAL A 109 26.990 34.014 41.717 1.00 0.00 H new ATOM 0 HG13 VAL A 109 26.970 32.353 41.077 1.00 0.00 H new ATOM 0 HG21 VAL A 109 26.973 30.930 43.795 1.00 0.00 H new ATOM 0 HG22 VAL A 109 27.988 30.493 42.400 1.00 0.00 H new ATOM 0 HG23 VAL A 109 28.740 30.831 43.977 1.00 0.00 H new ATOM 1714 N ALA A 110 30.530 34.845 42.998 1.00 0.00 N ATOM 1715 CA ALA A 110 30.858 36.311 42.984 1.00 0.00 C ATOM 1716 C ALA A 110 29.765 37.106 43.705 1.00 0.00 C ATOM 1717 O ALA A 110 29.468 38.247 43.355 1.00 0.00 O ATOM 1718 CB ALA A 110 30.949 36.726 41.512 1.00 0.00 C ATOM 0 H ALA A 110 31.028 34.304 43.705 1.00 0.00 H new ATOM 0 HA ALA A 110 31.796 36.511 43.501 1.00 0.00 H new ATOM 0 HB1 ALA A 110 31.186 37.788 41.447 1.00 0.00 H new ATOM 0 HB2 ALA A 110 31.731 36.149 41.019 1.00 0.00 H new ATOM 0 HB3 ALA A 110 29.994 36.537 41.021 1.00 0.00 H new ATOM 1724 N MET A 111 29.159 36.519 44.711 1.00 0.00 N ATOM 1725 CA MET A 111 28.080 37.238 45.461 1.00 0.00 C ATOM 1726 C MET A 111 28.181 36.978 46.975 1.00 0.00 C ATOM 1727 O MET A 111 28.781 36.005 47.421 1.00 0.00 O ATOM 1728 CB MET A 111 26.763 36.683 44.909 1.00 0.00 C ATOM 1729 CG MET A 111 26.900 35.185 44.634 1.00 0.00 C ATOM 1730 SD MET A 111 25.281 34.490 44.223 1.00 0.00 S ATOM 1731 CE MET A 111 25.494 32.915 45.085 1.00 0.00 C ATOM 0 H MET A 111 29.364 35.577 45.044 1.00 0.00 H new ATOM 0 HA MET A 111 28.159 38.317 45.330 1.00 0.00 H new ATOM 0 HB2 MET A 111 25.958 36.858 45.623 1.00 0.00 H new ATOM 0 HB3 MET A 111 26.495 37.206 43.991 1.00 0.00 H new ATOM 0 HG2 MET A 111 27.597 35.018 43.813 1.00 0.00 H new ATOM 0 HG3 MET A 111 27.311 34.681 45.509 1.00 0.00 H new ATOM 0 HE1 MET A 111 24.528 32.418 45.179 1.00 0.00 H new ATOM 0 HE2 MET A 111 26.175 32.280 44.519 1.00 0.00 H new ATOM 0 HE3 MET A 111 25.907 33.096 46.077 1.00 0.00 H new ATOM 1741 N SER A 112 27.599 37.847 47.764 1.00 0.00 N ATOM 1742 CA SER A 112 27.636 37.701 49.258 1.00 0.00 C ATOM 1743 C SER A 112 26.711 36.561 49.733 1.00 0.00 C ATOM 1744 O SER A 112 25.941 36.016 48.946 1.00 0.00 O ATOM 1745 CB SER A 112 27.158 39.058 49.787 1.00 0.00 C ATOM 1746 OG SER A 112 25.779 38.982 50.130 1.00 0.00 O ATOM 0 H SER A 112 27.090 38.667 47.433 1.00 0.00 H new ATOM 0 HA SER A 112 28.630 37.442 49.621 1.00 0.00 H new ATOM 0 HB2 SER A 112 27.744 39.346 50.660 1.00 0.00 H new ATOM 0 HB3 SER A 112 27.313 39.828 49.031 1.00 0.00 H new ATOM 0 HG SER A 112 25.478 39.851 50.469 1.00 0.00 H new ATOM 1752 N PRO A 113 26.813 36.227 51.008 1.00 0.00 N ATOM 1753 CA PRO A 113 25.974 35.137 51.589 1.00 0.00 C ATOM 1754 C PRO A 113 24.487 35.449 51.447 1.00 0.00 C ATOM 1755 O PRO A 113 23.691 34.562 51.122 1.00 0.00 O ATOM 1756 CB PRO A 113 26.423 35.087 53.050 1.00 0.00 C ATOM 1757 CG PRO A 113 27.005 36.436 53.307 1.00 0.00 C ATOM 1758 CD PRO A 113 27.680 36.832 52.022 1.00 0.00 C ATOM 0 HA PRO A 113 26.100 34.178 51.086 1.00 0.00 H new ATOM 0 HB2 PRO A 113 25.585 34.883 53.716 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.159 34.299 53.213 1.00 0.00 H new ATOM 0 HG2 PRO A 113 26.230 37.152 53.581 1.00 0.00 H new ATOM 0 HG3 PRO A 113 27.717 36.406 54.132 1.00 0.00 H new ATOM 0 HD2 PRO A 113 27.739 37.915 51.912 1.00 0.00 H new ATOM 0 HD3 PRO A 113 28.699 36.450 51.965 1.00 0.00 H new ATOM 1766 N PHE A 114 24.076 36.682 51.611 1.00 0.00 N ATOM 1767 CA PHE A 114 22.631 36.962 51.409 1.00 0.00 C ATOM 1768 C PHE A 114 22.302 36.807 49.935 1.00 0.00 C ATOM 1769 O PHE A 114 21.219 36.333 49.591 1.00 0.00 O ATOM 1770 CB PHE A 114 22.337 38.388 51.878 1.00 0.00 C ATOM 1771 CG PHE A 114 22.400 38.495 53.387 1.00 0.00 C ATOM 1772 CD1 PHE A 114 22.669 37.375 54.186 1.00 0.00 C ATOM 1773 CD2 PHE A 114 22.172 39.735 53.983 1.00 0.00 C ATOM 1774 CE1 PHE A 114 22.717 37.505 55.579 1.00 0.00 C ATOM 1775 CE2 PHE A 114 22.218 39.866 55.374 1.00 0.00 C ATOM 1776 CZ PHE A 114 22.494 38.751 56.173 1.00 0.00 C ATOM 0 H PHE A 114 24.659 37.479 51.867 1.00 0.00 H new ATOM 0 HA PHE A 114 22.019 36.266 51.982 1.00 0.00 H new ATOM 0 HB2 PHE A 114 23.056 39.075 51.432 1.00 0.00 H new ATOM 0 HB3 PHE A 114 21.349 38.691 51.531 1.00 0.00 H new ATOM 0 HD1 PHE A 114 22.839 36.412 53.727 1.00 0.00 H new ATOM 0 HD2 PHE A 114 21.959 40.597 53.368 1.00 0.00 H new ATOM 0 HE1 PHE A 114 22.926 36.643 56.195 1.00 0.00 H new ATOM 0 HE2 PHE A 114 22.041 40.828 55.832 1.00 0.00 H new ATOM 0 HZ PHE A 114 22.535 38.853 57.247 1.00 0.00 H new ATOM 1786 N HIS A 115 23.195 37.151 49.036 1.00 0.00 N ATOM 1787 CA HIS A 115 22.828 36.940 47.619 1.00 0.00 C ATOM 1788 C HIS A 115 22.799 35.430 47.284 1.00 0.00 C ATOM 1789 O HIS A 115 22.034 34.992 46.427 1.00 0.00 O ATOM 1790 CB HIS A 115 23.764 37.703 46.714 1.00 0.00 C ATOM 1791 CG HIS A 115 22.931 37.970 45.503 1.00 0.00 C ATOM 1792 ND1 HIS A 115 23.131 37.304 44.312 1.00 0.00 N ATOM 1793 CD2 HIS A 115 21.770 38.684 45.351 1.00 0.00 C ATOM 1794 CE1 HIS A 115 22.102 37.613 43.506 1.00 0.00 C ATOM 1795 NE2 HIS A 115 21.239 38.456 44.089 1.00 0.00 N ATOM 0 H HIS A 115 24.116 37.549 49.217 1.00 0.00 H new ATOM 0 HA HIS A 115 21.823 37.328 47.451 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.107 38.628 47.178 1.00 0.00 H new ATOM 0 HB3 HIS A 115 24.652 37.120 46.471 1.00 0.00 H new ATOM 0 HD1 HIS A 115 23.914 36.691 44.086 1.00 0.00 H new ATOM 0 HD2 HIS A 115 21.334 39.327 46.101 1.00 0.00 H new ATOM 0 HE1 HIS A 115 21.984 37.227 42.504 1.00 0.00 H new ATOM 1803 N LEU A 116 23.560 34.621 47.985 1.00 0.00 N ATOM 1804 CA LEU A 116 23.504 33.148 47.747 1.00 0.00 C ATOM 1805 C LEU A 116 22.083 32.703 48.053 1.00 0.00 C ATOM 1806 O LEU A 116 21.448 31.992 47.276 1.00 0.00 O ATOM 1807 CB LEU A 116 24.489 32.521 48.745 1.00 0.00 C ATOM 1808 CG LEU A 116 24.277 30.994 48.846 1.00 0.00 C ATOM 1809 CD1 LEU A 116 23.140 30.688 49.826 1.00 0.00 C ATOM 1810 CD2 LEU A 116 23.926 30.400 47.473 1.00 0.00 C ATOM 0 H LEU A 116 24.214 34.919 48.709 1.00 0.00 H new ATOM 0 HA LEU A 116 23.762 32.860 46.728 1.00 0.00 H new ATOM 0 HB2 LEU A 116 25.512 32.730 48.432 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.357 32.976 49.727 1.00 0.00 H new ATOM 0 HG LEU A 116 25.205 30.546 49.201 1.00 0.00 H new ATOM 0 HD11 LEU A 116 22.997 29.609 49.892 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.393 31.081 50.811 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.220 31.155 49.474 1.00 0.00 H new ATOM 0 HD21 LEU A 116 23.781 29.324 47.568 1.00 0.00 H new ATOM 0 HD22 LEU A 116 23.009 30.858 47.102 1.00 0.00 H new ATOM 0 HD23 LEU A 116 24.738 30.596 46.773 1.00 0.00 H new ATOM 1822 N HIS A 117 21.558 33.150 49.161 1.00 0.00 N ATOM 1823 CA HIS A 117 20.158 32.797 49.511 1.00 0.00 C ATOM 1824 C HIS A 117 19.216 33.355 48.426 1.00 0.00 C ATOM 1825 O HIS A 117 18.253 32.706 48.024 1.00 0.00 O ATOM 1826 CB HIS A 117 19.928 33.433 50.879 1.00 0.00 C ATOM 1827 CG HIS A 117 20.769 32.687 51.878 1.00 0.00 C ATOM 1828 ND1 HIS A 117 20.472 31.388 52.263 1.00 0.00 N ATOM 1829 CD2 HIS A 117 21.923 33.017 52.548 1.00 0.00 C ATOM 1830 CE1 HIS A 117 21.429 30.990 53.118 1.00 0.00 C ATOM 1831 NE2 HIS A 117 22.336 31.944 53.328 1.00 0.00 N ATOM 0 H HIS A 117 22.039 33.744 49.837 1.00 0.00 H new ATOM 0 HA HIS A 117 19.968 31.725 49.556 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.202 34.488 50.861 1.00 0.00 H new ATOM 0 HB3 HIS A 117 18.874 33.382 51.152 1.00 0.00 H new ATOM 0 HD1 HIS A 117 19.673 30.835 51.953 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.432 33.967 52.479 1.00 0.00 H new ATOM 0 HE1 HIS A 117 21.460 30.014 53.580 1.00 0.00 H new ATOM 1839 N ARG A 118 19.513 34.524 47.901 1.00 0.00 N ATOM 1840 CA ARG A 118 18.675 35.101 46.793 1.00 0.00 C ATOM 1841 C ARG A 118 18.762 34.174 45.553 1.00 0.00 C ATOM 1842 O ARG A 118 17.793 33.998 44.818 1.00 0.00 O ATOM 1843 CB ARG A 118 19.285 36.476 46.496 1.00 0.00 C ATOM 1844 CG ARG A 118 18.583 37.116 45.288 1.00 0.00 C ATOM 1845 CD ARG A 118 17.059 37.049 45.460 1.00 0.00 C ATOM 1846 NE ARG A 118 16.791 37.593 46.825 1.00 0.00 N ATOM 1847 CZ ARG A 118 15.656 37.346 47.433 1.00 0.00 C ATOM 1848 NH1 ARG A 118 14.733 36.619 46.856 1.00 0.00 N ATOM 1849 NH2 ARG A 118 15.443 37.830 48.625 1.00 0.00 N ATOM 0 H ARG A 118 20.300 35.104 48.191 1.00 0.00 H new ATOM 0 HA ARG A 118 17.622 35.189 47.060 1.00 0.00 H new ATOM 0 HB2 ARG A 118 19.186 37.122 47.368 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.351 36.373 46.294 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.899 38.154 45.183 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.876 36.600 44.373 1.00 0.00 H new ATOM 0 HD2 ARG A 118 16.551 37.637 44.696 1.00 0.00 H new ATOM 0 HD3 ARG A 118 16.698 36.025 45.367 1.00 0.00 H new ATOM 0 HE ARG A 118 17.498 38.163 47.289 1.00 0.00 H new ATOM 0 HH11 ARG A 118 14.893 36.238 45.923 1.00 0.00 H new ATOM 0 HH12 ARG A 118 13.854 36.434 47.339 1.00 0.00 H new ATOM 0 HH21 ARG A 118 16.158 38.398 49.080 1.00 0.00 H new ATOM 0 HH22 ARG A 118 14.562 37.641 49.102 1.00 0.00 H new ATOM 1863 N LEU A 119 19.901 33.542 45.347 1.00 0.00 N ATOM 1864 CA LEU A 119 20.080 32.568 44.202 1.00 0.00 C ATOM 1865 C LEU A 119 19.235 31.307 44.475 1.00 0.00 C ATOM 1866 O LEU A 119 18.415 30.891 43.658 1.00 0.00 O ATOM 1867 CB LEU A 119 21.580 32.220 44.258 1.00 0.00 C ATOM 1868 CG LEU A 119 22.063 31.510 42.979 1.00 0.00 C ATOM 1869 CD1 LEU A 119 23.425 30.861 43.261 1.00 0.00 C ATOM 1870 CD2 LEU A 119 21.075 30.419 42.554 1.00 0.00 C ATOM 0 H LEU A 119 20.729 33.659 45.931 1.00 0.00 H new ATOM 0 HA LEU A 119 19.774 32.967 43.235 1.00 0.00 H new ATOM 0 HB2 LEU A 119 22.157 33.133 44.404 1.00 0.00 H new ATOM 0 HB3 LEU A 119 21.771 31.581 45.120 1.00 0.00 H new ATOM 0 HG LEU A 119 22.140 32.244 42.177 1.00 0.00 H new ATOM 0 HD11 LEU A 119 23.779 30.354 42.363 1.00 0.00 H new ATOM 0 HD12 LEU A 119 24.141 31.630 43.550 1.00 0.00 H new ATOM 0 HD13 LEU A 119 23.323 30.137 44.070 1.00 0.00 H new ATOM 0 HD21 LEU A 119 21.438 29.932 41.649 1.00 0.00 H new ATOM 0 HD22 LEU A 119 20.983 29.681 43.351 1.00 0.00 H new ATOM 0 HD23 LEU A 119 20.100 30.867 42.360 1.00 0.00 H new ATOM 1882 N PHE A 120 19.423 30.709 45.633 1.00 0.00 N ATOM 1883 CA PHE A 120 18.644 29.477 46.029 1.00 0.00 C ATOM 1884 C PHE A 120 17.128 29.744 45.793 1.00 0.00 C ATOM 1885 O PHE A 120 16.408 28.891 45.289 1.00 0.00 O ATOM 1886 CB PHE A 120 18.986 29.339 47.543 1.00 0.00 C ATOM 1887 CG PHE A 120 19.042 27.888 48.041 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.015 26.996 47.716 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.093 27.452 48.899 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.026 25.687 48.215 1.00 0.00 C ATOM 1891 CE2 PHE A 120 20.088 26.144 49.406 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.055 25.264 49.061 1.00 0.00 C ATOM 0 H PHE A 120 20.093 31.025 46.334 1.00 0.00 H new ATOM 0 HA PHE A 120 18.884 28.574 45.468 1.00 0.00 H new ATOM 0 HB2 PHE A 120 19.948 29.815 47.732 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.242 29.883 48.124 1.00 0.00 H new ATOM 0 HD1 PHE A 120 17.207 27.319 47.076 1.00 0.00 H new ATOM 0 HD2 PHE A 120 20.894 28.129 49.159 1.00 0.00 H new ATOM 0 HE1 PHE A 120 17.236 25.002 47.945 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.881 25.816 50.062 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.053 24.256 49.449 1.00 0.00 H new ATOM 1902 N LYS A 121 16.660 30.932 46.107 1.00 0.00 N ATOM 1903 CA LYS A 121 15.211 31.306 45.870 1.00 0.00 C ATOM 1904 C LYS A 121 14.936 31.505 44.370 1.00 0.00 C ATOM 1905 O LYS A 121 13.920 31.062 43.843 1.00 0.00 O ATOM 1906 CB LYS A 121 15.072 32.628 46.645 1.00 0.00 C ATOM 1907 CG LYS A 121 14.045 33.587 46.011 1.00 0.00 C ATOM 1908 CD LYS A 121 12.742 32.869 45.647 1.00 0.00 C ATOM 1909 CE LYS A 121 12.307 33.310 44.243 1.00 0.00 C ATOM 1910 NZ LYS A 121 10.983 33.968 44.425 1.00 0.00 N ATOM 0 H LYS A 121 17.223 31.673 46.524 1.00 0.00 H new ATOM 0 HA LYS A 121 14.504 30.543 46.194 1.00 0.00 H new ATOM 0 HB2 LYS A 121 14.776 32.413 47.672 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.043 33.121 46.690 1.00 0.00 H new ATOM 0 HG2 LYS A 121 13.830 34.399 46.705 1.00 0.00 H new ATOM 0 HG3 LYS A 121 14.474 34.038 45.116 1.00 0.00 H new ATOM 0 HD2 LYS A 121 12.886 31.789 45.675 1.00 0.00 H new ATOM 0 HD3 LYS A 121 11.965 33.106 46.374 1.00 0.00 H new ATOM 0 HE2 LYS A 121 13.031 33.998 43.806 1.00 0.00 H new ATOM 0 HE3 LYS A 121 12.232 32.456 43.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 10.957 34.853 43.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 10.231 33.333 44.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.835 34.178 45.433 1.00 0.00 H new ATOM 1924 N ALA A 122 15.829 32.162 43.678 1.00 0.00 N ATOM 1925 CA ALA A 122 15.629 32.386 42.216 1.00 0.00 C ATOM 1926 C ALA A 122 15.490 31.039 41.520 1.00 0.00 C ATOM 1927 O ALA A 122 14.512 30.774 40.823 1.00 0.00 O ATOM 1928 CB ALA A 122 16.889 33.110 41.740 1.00 0.00 C ATOM 0 H ALA A 122 16.689 32.553 44.062 1.00 0.00 H new ATOM 0 HA ALA A 122 14.733 32.967 41.998 1.00 0.00 H new ATOM 0 HB1 ALA A 122 16.813 33.308 40.671 1.00 0.00 H new ATOM 0 HB2 ALA A 122 16.992 34.053 42.277 1.00 0.00 H new ATOM 0 HB3 ALA A 122 17.762 32.486 41.932 1.00 0.00 H new ATOM 1934 N THR A 123 16.459 30.185 41.690 1.00 0.00 N ATOM 1935 CA THR A 123 16.392 28.844 41.026 1.00 0.00 C ATOM 1936 C THR A 123 15.271 27.972 41.655 1.00 0.00 C ATOM 1937 O THR A 123 14.321 27.593 40.975 1.00 0.00 O ATOM 1938 CB THR A 123 17.768 28.215 41.267 1.00 0.00 C ATOM 1939 OG1 THR A 123 18.765 29.229 41.243 1.00 0.00 O ATOM 1940 CG2 THR A 123 18.066 27.189 40.169 1.00 0.00 C ATOM 0 H THR A 123 17.292 30.351 42.255 1.00 0.00 H new ATOM 0 HA THR A 123 16.158 28.925 39.964 1.00 0.00 H new ATOM 0 HB THR A 123 17.771 27.720 42.238 1.00 0.00 H new ATOM 0 HG1 THR A 123 19.610 28.850 40.923 1.00 0.00 H new ATOM 0 HG21 THR A 123 19.045 26.744 40.343 1.00 0.00 H new ATOM 0 HG22 THR A 123 17.305 26.409 40.184 1.00 0.00 H new ATOM 0 HG23 THR A 123 18.060 27.684 39.198 1.00 0.00 H new ATOM 1948 N THR A 124 15.337 27.672 42.941 1.00 0.00 N ATOM 1949 CA THR A 124 14.244 26.857 43.600 1.00 0.00 C ATOM 1950 C THR A 124 12.889 27.515 43.300 1.00 0.00 C ATOM 1951 O THR A 124 11.878 26.843 43.116 1.00 0.00 O ATOM 1952 CB THR A 124 14.568 26.867 45.105 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.079 25.671 45.695 1.00 0.00 O ATOM 1954 CG2 THR A 124 13.921 28.072 45.794 1.00 0.00 C ATOM 0 H THR A 124 16.096 27.954 43.561 1.00 0.00 H new ATOM 0 HA THR A 124 14.191 25.832 43.234 1.00 0.00 H new ATOM 0 HB THR A 124 15.649 26.935 45.229 1.00 0.00 H new ATOM 0 HG1 THR A 124 14.728 25.340 46.350 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.164 28.057 46.856 1.00 0.00 H new ATOM 0 HG22 THR A 124 14.299 28.992 45.348 1.00 0.00 H new ATOM 0 HG23 THR A 124 12.839 28.025 45.669 1.00 0.00 H new ATOM 1962 N GLY A 125 12.870 28.827 43.202 1.00 0.00 N ATOM 1963 CA GLY A 125 11.603 29.549 42.863 1.00 0.00 C ATOM 1964 C GLY A 125 10.984 30.382 44.012 1.00 0.00 C ATOM 1965 O GLY A 125 10.346 31.390 43.713 1.00 0.00 O ATOM 0 H GLY A 125 13.682 29.428 43.343 1.00 0.00 H new ATOM 0 HA2 GLY A 125 11.797 30.212 42.020 1.00 0.00 H new ATOM 0 HA3 GLY A 125 10.866 28.818 42.530 1.00 0.00 H new ATOM 1969 N MET A 126 11.114 30.063 45.286 1.00 0.00 N ATOM 1970 CA MET A 126 10.447 30.981 46.289 1.00 0.00 C ATOM 1971 C MET A 126 10.950 30.861 47.749 1.00 0.00 C ATOM 1972 O MET A 126 10.131 30.792 48.664 1.00 0.00 O ATOM 1973 CB MET A 126 8.969 30.565 46.252 1.00 0.00 C ATOM 1974 CG MET A 126 8.235 31.289 45.122 1.00 0.00 C ATOM 1975 SD MET A 126 6.491 31.486 45.564 1.00 0.00 S ATOM 1976 CE MET A 126 6.412 33.285 45.379 1.00 0.00 C ATOM 0 H MET A 126 11.619 29.260 45.662 1.00 0.00 H new ATOM 0 HA MET A 126 10.660 32.013 46.012 1.00 0.00 H new ATOM 0 HB2 MET A 126 8.892 29.487 46.111 1.00 0.00 H new ATOM 0 HB3 MET A 126 8.496 30.796 47.207 1.00 0.00 H new ATOM 0 HG2 MET A 126 8.689 32.264 44.945 1.00 0.00 H new ATOM 0 HG3 MET A 126 8.324 30.723 44.195 1.00 0.00 H new ATOM 0 HE1 MET A 126 5.404 33.630 45.608 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.120 33.753 46.063 1.00 0.00 H new ATOM 0 HE3 MET A 126 6.665 33.557 44.354 1.00 0.00 H new ATOM 1986 N THR A 127 12.239 30.882 48.026 1.00 0.00 N ATOM 1987 CA THR A 127 12.666 30.809 49.461 1.00 0.00 C ATOM 1988 C THR A 127 14.178 31.073 49.650 1.00 0.00 C ATOM 1989 O THR A 127 14.934 30.124 49.821 1.00 0.00 O ATOM 1990 CB THR A 127 12.358 29.378 49.894 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.183 28.894 49.261 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.155 29.368 51.393 1.00 0.00 C ATOM 0 H THR A 127 12.992 30.945 47.340 1.00 0.00 H new ATOM 0 HA THR A 127 12.146 31.569 50.045 1.00 0.00 H new ATOM 0 HB THR A 127 13.189 28.733 49.608 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.444 29.516 49.424 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.933 28.353 51.723 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.062 29.720 51.885 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.324 30.024 51.652 1.00 0.00 H new ATOM 2000 N PRO A 128 14.608 32.317 49.653 1.00 0.00 N ATOM 2001 CA PRO A 128 16.063 32.565 49.849 1.00 0.00 C ATOM 2002 C PRO A 128 16.542 32.245 51.277 1.00 0.00 C ATOM 2003 O PRO A 128 16.695 31.079 51.635 1.00 0.00 O ATOM 2004 CB PRO A 128 16.200 34.052 49.511 1.00 0.00 C ATOM 2005 CG PRO A 128 14.844 34.638 49.764 1.00 0.00 C ATOM 2006 CD PRO A 128 13.832 33.550 49.498 1.00 0.00 C ATOM 0 HA PRO A 128 16.686 31.921 49.228 1.00 0.00 H new ATOM 0 HB2 PRO A 128 16.958 34.529 50.133 1.00 0.00 H new ATOM 0 HB3 PRO A 128 16.503 34.194 48.474 1.00 0.00 H new ATOM 0 HG2 PRO A 128 14.764 34.995 50.791 1.00 0.00 H new ATOM 0 HG3 PRO A 128 14.668 35.495 49.114 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.002 33.593 50.203 1.00 0.00 H new ATOM 0 HD3 PRO A 128 13.406 33.633 48.498 1.00 0.00 H new ATOM 2014 N LYS A 129 16.817 33.240 52.096 1.00 0.00 N ATOM 2015 CA LYS A 129 17.322 32.946 53.474 1.00 0.00 C ATOM 2016 C LYS A 129 16.304 32.112 54.272 1.00 0.00 C ATOM 2017 O LYS A 129 16.660 31.422 55.228 1.00 0.00 O ATOM 2018 CB LYS A 129 17.581 34.300 54.134 1.00 0.00 C ATOM 2019 CG LYS A 129 18.631 34.145 55.241 1.00 0.00 C ATOM 2020 CD LYS A 129 20.028 33.995 54.628 1.00 0.00 C ATOM 2021 CE LYS A 129 21.078 34.510 55.623 1.00 0.00 C ATOM 2022 NZ LYS A 129 22.372 33.914 55.188 1.00 0.00 N ATOM 0 H LYS A 129 16.714 34.229 51.870 1.00 0.00 H new ATOM 0 HA LYS A 129 18.235 32.351 53.441 1.00 0.00 H new ATOM 0 HB2 LYS A 129 17.927 35.018 53.390 1.00 0.00 H new ATOM 0 HB3 LYS A 129 16.655 34.695 54.551 1.00 0.00 H new ATOM 0 HG2 LYS A 129 18.606 35.013 55.900 1.00 0.00 H new ATOM 0 HG3 LYS A 129 18.399 33.273 55.853 1.00 0.00 H new ATOM 0 HD2 LYS A 129 20.221 32.950 54.387 1.00 0.00 H new ATOM 0 HD3 LYS A 129 20.090 34.554 53.695 1.00 0.00 H new ATOM 0 HE2 LYS A 129 21.126 35.599 55.613 1.00 0.00 H new ATOM 0 HE3 LYS A 129 20.832 34.211 56.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 23.018 33.856 56.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 22.205 32.960 54.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 22.797 34.509 54.449 1.00 0.00 H new ATOM 2036 N ALA A 130 15.057 32.126 53.887 1.00 0.00 N ATOM 2037 CA ALA A 130 14.050 31.294 54.622 1.00 0.00 C ATOM 2038 C ALA A 130 14.335 29.812 54.348 1.00 0.00 C ATOM 2039 O ALA A 130 14.231 28.974 55.243 1.00 0.00 O ATOM 2040 CB ALA A 130 12.691 31.684 54.041 1.00 0.00 C ATOM 0 H ALA A 130 14.691 32.669 53.105 1.00 0.00 H new ATOM 0 HA ALA A 130 14.082 31.454 55.700 1.00 0.00 H new ATOM 0 HB1 ALA A 130 11.906 31.111 54.535 1.00 0.00 H new ATOM 0 HB2 ALA A 130 12.519 32.748 54.201 1.00 0.00 H new ATOM 0 HB3 ALA A 130 12.678 31.471 52.972 1.00 0.00 H new ATOM 2046 N TRP A 131 14.732 29.467 53.134 1.00 0.00 N ATOM 2047 CA TRP A 131 15.056 28.038 52.858 1.00 0.00 C ATOM 2048 C TRP A 131 16.260 27.674 53.711 1.00 0.00 C ATOM 2049 O TRP A 131 16.336 26.585 54.274 1.00 0.00 O ATOM 2050 CB TRP A 131 15.404 27.966 51.373 1.00 0.00 C ATOM 2051 CG TRP A 131 14.485 27.031 50.628 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.733 26.576 49.378 1.00 0.00 C ATOM 2053 CD2 TRP A 131 13.193 26.445 51.021 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.706 25.742 48.985 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.733 25.631 49.954 1.00 0.00 C ATOM 2056 CE3 TRP A 131 12.384 26.525 52.177 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 11.529 24.931 50.029 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 11.171 25.821 52.250 1.00 0.00 C ATOM 2059 CH2 TRP A 131 10.745 25.025 51.179 1.00 0.00 C ATOM 0 H TRP A 131 14.841 30.105 52.346 1.00 0.00 H new ATOM 0 HA TRP A 131 14.239 27.354 53.088 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.341 28.963 50.936 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.435 27.632 51.257 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.598 26.826 48.782 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.671 25.265 48.084 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.701 27.133 53.011 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 11.205 24.319 49.200 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 10.562 25.894 53.139 1.00 0.00 H new ATOM 0 HH2 TRP A 131 9.812 24.485 51.243 1.00 0.00 H new ATOM 2070 N GLN A 132 17.182 28.588 53.868 1.00 0.00 N ATOM 2071 CA GLN A 132 18.359 28.310 54.742 1.00 0.00 C ATOM 2072 C GLN A 132 17.846 27.969 56.137 1.00 0.00 C ATOM 2073 O GLN A 132 18.341 27.061 56.801 1.00 0.00 O ATOM 2074 CB GLN A 132 19.159 29.610 54.770 1.00 0.00 C ATOM 2075 CG GLN A 132 20.350 29.462 55.722 1.00 0.00 C ATOM 2076 CD GLN A 132 20.691 30.823 56.332 1.00 0.00 C ATOM 2077 OE1 GLN A 132 19.800 31.603 56.660 1.00 0.00 O ATOM 2078 NE2 GLN A 132 21.943 31.150 56.504 1.00 0.00 N ATOM 0 H GLN A 132 17.171 29.510 53.431 1.00 0.00 H new ATOM 0 HA GLN A 132 18.971 27.481 54.388 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.510 29.854 53.767 1.00 0.00 H new ATOM 0 HB3 GLN A 132 18.522 30.433 55.094 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.112 28.748 56.510 1.00 0.00 H new ATOM 0 HG3 GLN A 132 21.212 29.067 55.184 1.00 0.00 H new ATOM 0 HE21 GLN A 132 22.682 30.502 56.231 1.00 0.00 H new ATOM 0 HE22 GLN A 132 22.183 32.054 56.911 1.00 0.00 H new ATOM 2087 N GLN A 133 16.848 28.678 56.589 1.00 0.00 N ATOM 2088 CA GLN A 133 16.283 28.390 57.937 1.00 0.00 C ATOM 2089 C GLN A 133 15.681 26.980 57.937 1.00 0.00 C ATOM 2090 O GLN A 133 15.990 26.145 58.793 1.00 0.00 O ATOM 2091 CB GLN A 133 15.194 29.447 58.143 1.00 0.00 C ATOM 2092 CG GLN A 133 15.066 29.767 59.633 1.00 0.00 C ATOM 2093 CD GLN A 133 15.910 31.002 59.961 1.00 0.00 C ATOM 2094 OE1 GLN A 133 16.879 31.299 59.266 1.00 0.00 O ATOM 2095 NE2 GLN A 133 15.591 31.742 60.987 1.00 0.00 N ATOM 0 H GLN A 133 16.400 29.443 56.084 1.00 0.00 H new ATOM 0 HA GLN A 133 17.029 28.427 58.731 1.00 0.00 H new ATOM 0 HB2 GLN A 133 15.440 30.351 57.586 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.242 29.084 57.756 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.022 29.948 59.889 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.398 28.917 60.229 1.00 0.00 H new ATOM 0 HE21 GLN A 133 14.787 31.495 61.564 1.00 0.00 H new ATOM 0 HE22 GLN A 133 16.146 32.568 61.213 1.00 0.00 H new ATOM 2104 N ALA A 134 14.839 26.689 56.976 1.00 0.00 N ATOM 2105 CA ALA A 134 14.230 25.327 56.907 1.00 0.00 C ATOM 2106 C ALA A 134 15.336 24.280 56.922 1.00 0.00 C ATOM 2107 O ALA A 134 15.268 23.287 57.644 1.00 0.00 O ATOM 2108 CB ALA A 134 13.458 25.291 55.588 1.00 0.00 C ATOM 0 H ALA A 134 14.549 27.333 56.240 1.00 0.00 H new ATOM 0 HA ALA A 134 13.572 25.117 57.751 1.00 0.00 H new ATOM 0 HB1 ALA A 134 12.983 24.317 55.471 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.694 26.069 55.592 1.00 0.00 H new ATOM 0 HB3 ALA A 134 14.145 25.462 54.759 1.00 0.00 H new ATOM 2114 N TRP A 135 16.375 24.506 56.170 1.00 0.00 N ATOM 2115 CA TRP A 135 17.522 23.554 56.165 1.00 0.00 C ATOM 2116 C TRP A 135 17.980 23.337 57.597 1.00 0.00 C ATOM 2117 O TRP A 135 18.117 22.217 58.082 1.00 0.00 O ATOM 2118 CB TRP A 135 18.624 24.294 55.420 1.00 0.00 C ATOM 2119 CG TRP A 135 18.192 24.638 54.035 1.00 0.00 C ATOM 2120 CD1 TRP A 135 18.877 25.462 53.228 1.00 0.00 C ATOM 2121 CD2 TRP A 135 17.040 24.168 53.268 1.00 0.00 C ATOM 2122 NE1 TRP A 135 18.222 25.553 52.016 1.00 0.00 N ATOM 2123 CE2 TRP A 135 17.088 24.766 51.988 1.00 0.00 C ATOM 2124 CE3 TRP A 135 15.969 23.296 53.552 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 16.117 24.509 51.023 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 14.988 23.037 52.580 1.00 0.00 C ATOM 2127 CH2 TRP A 135 15.063 23.640 51.319 1.00 0.00 C ATOM 0 H TRP A 135 16.481 25.313 55.555 1.00 0.00 H new ATOM 0 HA TRP A 135 17.271 22.592 55.718 1.00 0.00 H new ATOM 0 HB2 TRP A 135 18.886 25.204 55.960 1.00 0.00 H new ATOM 0 HB3 TRP A 135 19.521 23.676 55.382 1.00 0.00 H new ATOM 0 HD1 TRP A 135 19.794 25.972 53.485 1.00 0.00 H new ATOM 0 HE1 TRP A 135 18.537 26.131 51.237 1.00 0.00 H new ATOM 0 HE3 TRP A 135 15.902 22.825 54.522 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 16.178 24.978 50.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 14.171 22.368 52.807 1.00 0.00 H new ATOM 0 HH2 TRP A 135 14.307 23.434 50.576 1.00 0.00 H new ATOM 2138 N ARG A 136 18.221 24.419 58.269 1.00 0.00 N ATOM 2139 CA ARG A 136 18.687 24.354 59.685 1.00 0.00 C ATOM 2140 C ARG A 136 17.588 23.809 60.604 1.00 0.00 C ATOM 2141 O ARG A 136 17.834 23.498 61.768 1.00 0.00 O ATOM 2142 CB ARG A 136 19.020 25.805 60.046 1.00 0.00 C ATOM 2143 CG ARG A 136 19.370 25.912 61.533 1.00 0.00 C ATOM 2144 CD ARG A 136 19.651 27.376 61.888 1.00 0.00 C ATOM 2145 NE ARG A 136 18.685 27.707 62.977 1.00 0.00 N ATOM 2146 CZ ARG A 136 18.797 28.824 63.656 1.00 0.00 C ATOM 2147 NH1 ARG A 136 19.759 29.673 63.393 1.00 0.00 N ATOM 2148 NH2 ARG A 136 17.941 29.094 64.603 1.00 0.00 N ATOM 0 H ARG A 136 18.115 25.363 57.897 1.00 0.00 H new ATOM 0 HA ARG A 136 19.540 23.686 59.805 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.857 26.155 59.442 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.171 26.449 59.817 1.00 0.00 H new ATOM 0 HG2 ARG A 136 18.548 25.531 62.139 1.00 0.00 H new ATOM 0 HG3 ARG A 136 20.243 25.298 61.757 1.00 0.00 H new ATOM 0 HD2 ARG A 136 20.680 27.510 62.221 1.00 0.00 H new ATOM 0 HD3 ARG A 136 19.508 28.025 61.024 1.00 0.00 H new ATOM 0 HE ARG A 136 17.929 27.058 63.196 1.00 0.00 H new ATOM 0 HH11 ARG A 136 20.431 29.469 62.653 1.00 0.00 H new ATOM 0 HH12 ARG A 136 19.836 30.538 63.928 1.00 0.00 H new ATOM 0 HH21 ARG A 136 17.189 28.438 64.813 1.00 0.00 H new ATOM 0 HH22 ARG A 136 18.024 29.961 65.134 1.00 0.00 H new ATOM 2162 N ALA A 137 16.389 23.692 60.116 1.00 0.00 N ATOM 2163 CA ALA A 137 15.289 23.178 60.978 1.00 0.00 C ATOM 2164 C ALA A 137 15.144 21.664 60.814 1.00 0.00 C ATOM 2165 O ALA A 137 14.900 20.940 61.779 1.00 0.00 O ATOM 2166 CB ALA A 137 14.032 23.894 60.481 1.00 0.00 C ATOM 0 H ALA A 137 16.121 23.929 59.161 1.00 0.00 H new ATOM 0 HA ALA A 137 15.475 23.363 62.036 1.00 0.00 H new ATOM 0 HB1 ALA A 137 13.172 23.569 61.067 1.00 0.00 H new ATOM 0 HB2 ALA A 137 14.160 24.971 60.590 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.867 23.653 59.431 1.00 0.00 H new ATOM 2172 N ARG A 138 15.272 21.171 59.611 1.00 0.00 N ATOM 2173 CA ARG A 138 15.123 19.708 59.394 1.00 0.00 C ATOM 2174 C ARG A 138 16.483 19.027 59.278 1.00 0.00 C ATOM 2175 O ARG A 138 16.720 17.996 59.904 1.00 0.00 O ATOM 2176 CB ARG A 138 14.352 19.592 58.077 1.00 0.00 C ATOM 2177 CG ARG A 138 13.706 18.208 57.975 1.00 0.00 C ATOM 2178 CD ARG A 138 13.599 17.800 56.502 1.00 0.00 C ATOM 2179 NE ARG A 138 12.208 17.284 56.343 1.00 0.00 N ATOM 2180 CZ ARG A 138 11.182 18.100 56.379 1.00 0.00 C ATOM 2181 NH1 ARG A 138 11.354 19.385 56.557 1.00 0.00 N ATOM 2182 NH2 ARG A 138 9.974 17.625 56.238 1.00 0.00 N ATOM 0 H ARG A 138 15.473 21.718 58.774 1.00 0.00 H new ATOM 0 HA ARG A 138 14.610 19.223 60.225 1.00 0.00 H new ATOM 0 HB2 ARG A 138 13.586 20.366 58.024 1.00 0.00 H new ATOM 0 HB3 ARG A 138 15.026 19.752 57.235 1.00 0.00 H new ATOM 0 HG2 ARG A 138 14.300 17.477 58.523 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.717 18.222 58.432 1.00 0.00 H new ATOM 0 HD2 ARG A 138 13.783 18.649 55.843 1.00 0.00 H new ATOM 0 HD3 ARG A 138 14.334 17.036 56.250 1.00 0.00 H new ATOM 0 HE ARG A 138 12.053 16.285 56.205 1.00 0.00 H new ATOM 0 HH11 ARG A 138 12.295 19.763 56.670 1.00 0.00 H new ATOM 0 HH12 ARG A 138 10.547 20.009 56.583 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.832 16.624 56.101 1.00 0.00 H new ATOM 0 HH22 ARG A 138 9.172 18.255 56.265 1.00 0.00 H new ATOM 2196 N ARG A 139 17.373 19.545 58.476 1.00 0.00 N ATOM 2197 CA ARG A 139 18.693 18.855 58.333 1.00 0.00 C ATOM 2198 C ARG A 139 19.815 19.839 58.004 1.00 0.00 C ATOM 2199 O ARG A 139 19.623 20.659 57.121 1.00 0.00 O ATOM 2200 CB ARG A 139 18.477 17.865 57.189 1.00 0.00 C ATOM 2201 CG ARG A 139 19.371 16.639 57.386 1.00 0.00 C ATOM 2202 CD ARG A 139 18.685 15.409 56.780 1.00 0.00 C ATOM 2203 NE ARG A 139 19.651 14.852 55.786 1.00 0.00 N ATOM 2204 CZ ARG A 139 20.647 14.086 56.166 1.00 0.00 C ATOM 2205 NH1 ARG A 139 20.823 13.789 57.429 1.00 0.00 N ATOM 2206 NH2 ARG A 139 21.474 13.613 55.274 1.00 0.00 N ATOM 2207 OXT ARG A 139 20.856 19.741 58.630 1.00 0.00 O ATOM 0 H ARG A 139 17.252 20.395 57.925 1.00 0.00 H new ATOM 0 HA ARG A 139 19.001 18.368 59.258 1.00 0.00 H new ATOM 0 HB2 ARG A 139 17.431 17.561 57.152 1.00 0.00 H new ATOM 0 HB3 ARG A 139 18.704 18.342 56.236 1.00 0.00 H new ATOM 0 HG2 ARG A 139 20.339 16.800 56.912 1.00 0.00 H new ATOM 0 HG3 ARG A 139 19.559 16.479 58.448 1.00 0.00 H new ATOM 0 HD2 ARG A 139 18.449 14.674 57.550 1.00 0.00 H new ATOM 0 HD3 ARG A 139 17.745 15.682 56.301 1.00 0.00 H new ATOM 0 HE ARG A 139 19.535 15.070 54.796 1.00 0.00 H new ATOM 0 HH11 ARG A 139 20.181 14.154 58.133 1.00 0.00 H new ATOM 0 HH12 ARG A 139 21.602 13.192 57.709 1.00 0.00 H new ATOM 0 HH21 ARG A 139 21.344 13.839 54.288 1.00 0.00 H new ATOM 0 HH22 ARG A 139 22.250 13.017 55.563 1.00 0.00 H new