USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=27 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 91 CYS SG : rot 90:sc= -5.36! USER MOD Set 1.2: A 132 GLN : amide:sc= -15.7! C(o=-21!,f=-28!) USER MOD Set 2.1: A 42 CYS SG : rot 180:sc= 0.874 USER MOD Set 2.2: A 69 CYS SG : rot 172:sc= -0.777 USER MOD Set 2.3: A 72 CYS SG : rot 111:sc= -0.182 USER MOD Set 3.1: A 53 SER OG : rot 180:sc= -1.16 USER MOD Set 3.2: A 55 TYR OH : rot -130:sc= -0.355 USER MOD Set 4.1: A 11 GLN : amide:sc= -0.806 K(o=-6.1,f=-7.1!) USER MOD Set 4.2: A 14 GLN : amide:sc= -5.25! C(o=-6.1!,f=-5.6!) USER MOD Single : A 8 THR OG1 : rot 25:sc= 0.429 USER MOD Single : A 15 SER OG : rot 130:sc= -1.51 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.528 F(o=-2!,f=-0.53) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -35:sc= 0.07 USER MOD Single : A 41 SER OG : rot -113:sc=-0.00917 USER MOD Single : A 46 HIS :FLIP no HE2:sc= -1.3 F(o=-3.9!,f=-1.3) USER MOD Single : A 51 ASN : amide:sc= -1.89 X(o=-1.9,f=-1.7) USER MOD Single : A 57 ASN : amide:sc= -4.78! C(o=-4.8!,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= -0.506 K(o=-0.51,f=-4!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= -0.458 (180deg=-0.458) USER MOD Single : A 78 ASN :FLIP amide:sc= -9.65! C(o=-11!,f=-9.7!) USER MOD Single : A 81 GLN : amide:sc= -0.26 K(o=-0.26,f=-2.6!) USER MOD Single : A 82 HIS : no HD1:sc= -0.0109 X(o=-0.011,f=-0.14) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0193 USER MOD Single : A 89 HIS : no HD1:sc= 0.0535 K(o=0.054,f=-0.67) USER MOD Single : A 96 GLN :FLIP amide:sc= -0.0236 F(o=-1.5!,f=-0.024) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -110:sc= -2.8! USER MOD Single : A 108 GLN : amide:sc= -0.0632 X(o=-0.063,f=-0.2) USER MOD Single : A 111 MET CE :methyl -133:sc= -14! (180deg=-18.6!) USER MOD Single : A 112 SER OG : rot 180:sc= 0.00664 USER MOD Single : A 115 HIS : no HE2:sc= -0.281 K(o=-0.28,f=-0.99) USER MOD Single : A 117 HIS : no HE2:sc= -8.91! C(o=-8.9!,f=-14!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot -140:sc= -1.52 USER MOD Single : A 124 THR OG1 : rot -145:sc= 1.73 USER MOD Single : A 126 MET CE :methyl -159:sc= 0 (180deg=-0.678) USER MOD Single : A 127 THR OG1 : rot -53:sc= -0.598! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= -2.04 K(o=-2,f=-10!) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 9.152 15.483 19.195 1.00 0.00 N ATOM 119 CA THR A 8 7.936 16.079 18.636 1.00 0.00 C ATOM 120 C THR A 8 8.200 17.568 18.475 1.00 0.00 C ATOM 121 O THR A 8 7.572 18.395 19.127 1.00 0.00 O ATOM 122 CB THR A 8 6.849 15.847 19.687 1.00 0.00 C ATOM 123 OG1 THR A 8 6.853 14.486 20.080 1.00 0.00 O ATOM 124 CG2 THR A 8 5.478 16.210 19.108 1.00 0.00 C ATOM 0 HA THR A 8 7.643 15.659 17.674 1.00 0.00 H new ATOM 0 HB THR A 8 7.049 16.477 20.554 1.00 0.00 H new ATOM 0 HG1 THR A 8 7.741 14.103 19.924 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.709 16.042 19.862 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.474 17.259 18.813 1.00 0.00 H new ATOM 0 HG23 THR A 8 5.274 15.587 18.237 1.00 0.00 H new ATOM 132 N ASP A 9 9.138 17.920 17.632 1.00 0.00 N ATOM 133 CA ASP A 9 9.478 19.369 17.433 1.00 0.00 C ATOM 134 C ASP A 9 8.208 20.222 17.432 1.00 0.00 C ATOM 135 O ASP A 9 8.213 21.368 17.876 1.00 0.00 O ATOM 136 CB ASP A 9 10.175 19.451 16.073 1.00 0.00 C ATOM 137 CG ASP A 9 9.340 18.728 15.014 1.00 0.00 C ATOM 138 OD1 ASP A 9 9.450 17.517 14.926 1.00 0.00 O ATOM 139 OD2 ASP A 9 8.604 19.400 14.310 1.00 0.00 O ATOM 0 H ASP A 9 9.686 17.268 17.071 1.00 0.00 H new ATOM 0 HA ASP A 9 10.115 19.744 18.234 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.314 20.494 15.789 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.166 19.002 16.135 1.00 0.00 H new ATOM 144 N ASP A 10 7.114 19.678 16.971 1.00 0.00 N ATOM 145 CA ASP A 10 5.855 20.429 16.974 1.00 0.00 C ATOM 146 C ASP A 10 5.493 20.814 18.404 1.00 0.00 C ATOM 147 O ASP A 10 5.271 21.990 18.717 1.00 0.00 O ATOM 148 CB ASP A 10 4.854 19.442 16.393 1.00 0.00 C ATOM 149 CG ASP A 10 4.975 19.421 14.869 1.00 0.00 C ATOM 150 OD1 ASP A 10 4.312 20.222 14.231 1.00 0.00 O ATOM 151 OD2 ASP A 10 5.728 18.603 14.365 1.00 0.00 O ATOM 0 H ASP A 10 7.052 18.733 16.591 1.00 0.00 H new ATOM 0 HA ASP A 10 5.893 21.359 16.407 1.00 0.00 H new ATOM 0 HB2 ASP A 10 5.036 18.446 16.795 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.842 19.723 16.683 1.00 0.00 H new ATOM 156 N GLN A 11 5.456 19.868 19.304 1.00 0.00 N ATOM 157 CA GLN A 11 5.129 20.261 20.690 1.00 0.00 C ATOM 158 C GLN A 11 6.372 20.792 21.370 1.00 0.00 C ATOM 159 O GLN A 11 6.279 21.637 22.253 1.00 0.00 O ATOM 160 CB GLN A 11 4.608 19.047 21.425 1.00 0.00 C ATOM 161 CG GLN A 11 4.209 19.521 22.819 1.00 0.00 C ATOM 162 CD GLN A 11 2.704 19.330 23.023 1.00 0.00 C ATOM 163 OE1 GLN A 11 1.941 19.289 22.061 1.00 0.00 O ATOM 164 NE2 GLN A 11 2.233 19.209 24.234 1.00 0.00 N ATOM 0 H GLN A 11 5.632 18.876 19.142 1.00 0.00 H new ATOM 0 HA GLN A 11 4.369 21.042 20.693 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.754 18.615 20.903 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.372 18.272 21.483 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.761 18.962 23.575 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.471 20.571 22.944 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.866 19.243 25.033 1.00 0.00 H new ATOM 0 HE22 GLN A 11 1.232 19.080 24.381 1.00 0.00 H new ATOM 173 N ARG A 12 7.540 20.364 20.963 1.00 0.00 N ATOM 174 CA ARG A 12 8.751 20.928 21.582 1.00 0.00 C ATOM 175 C ARG A 12 8.605 22.425 21.450 1.00 0.00 C ATOM 176 O ARG A 12 8.821 23.184 22.390 1.00 0.00 O ATOM 177 CB ARG A 12 9.916 20.439 20.736 1.00 0.00 C ATOM 178 CG ARG A 12 10.149 18.934 20.934 1.00 0.00 C ATOM 179 CD ARG A 12 10.063 18.555 22.418 1.00 0.00 C ATOM 180 NE ARG A 12 8.692 17.990 22.596 1.00 0.00 N ATOM 181 CZ ARG A 12 8.499 16.695 22.701 1.00 0.00 C ATOM 182 NH1 ARG A 12 9.503 15.854 22.653 1.00 0.00 N ATOM 183 NH2 ARG A 12 7.287 16.237 22.856 1.00 0.00 N ATOM 0 H ARG A 12 7.695 19.660 20.241 1.00 0.00 H new ATOM 0 HA ARG A 12 8.901 20.647 22.624 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.717 20.644 19.684 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.819 20.988 21.003 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.408 18.370 20.367 1.00 0.00 H new ATOM 0 HG3 ARG A 12 11.128 18.659 20.541 1.00 0.00 H new ATOM 0 HD2 ARG A 12 10.828 17.825 22.683 1.00 0.00 H new ATOM 0 HD3 ARG A 12 10.217 19.425 23.057 1.00 0.00 H new ATOM 0 HE ARG A 12 7.891 18.621 22.637 1.00 0.00 H new ATOM 0 HH11 ARG A 12 10.454 16.202 22.532 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.333 14.852 22.736 1.00 0.00 H new ATOM 0 HH21 ARG A 12 6.499 16.883 22.895 1.00 0.00 H new ATOM 0 HH22 ARG A 12 7.128 15.233 22.938 1.00 0.00 H new ATOM 197 N TRP A 13 8.167 22.852 20.290 1.00 0.00 N ATOM 198 CA TRP A 13 7.935 24.289 20.093 1.00 0.00 C ATOM 199 C TRP A 13 6.848 24.725 21.053 1.00 0.00 C ATOM 200 O TRP A 13 6.942 25.773 21.685 1.00 0.00 O ATOM 201 CB TRP A 13 7.438 24.463 18.663 1.00 0.00 C ATOM 202 CG TRP A 13 7.338 25.929 18.404 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.253 26.569 17.913 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.337 26.951 18.659 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.526 27.924 17.853 1.00 0.00 N ATOM 206 CE2 TRP A 13 7.801 28.209 18.305 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.647 26.906 19.160 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.539 29.384 18.449 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.394 28.081 19.304 1.00 0.00 C ATOM 210 CH2 TRP A 13 9.846 29.321 18.956 1.00 0.00 C ATOM 0 H TRP A 13 7.965 22.260 19.484 1.00 0.00 H new ATOM 0 HA TRP A 13 8.837 24.876 20.266 1.00 0.00 H new ATOM 0 HB2 TRP A 13 8.124 23.994 17.958 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.468 23.982 18.532 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.326 26.100 17.617 1.00 0.00 H new ATOM 0 HE1 TRP A 13 5.867 28.626 17.517 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.082 25.957 19.437 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 8.108 30.335 18.172 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.402 28.030 19.687 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.426 30.224 19.077 1.00 0.00 H new ATOM 221 N GLN A 14 5.826 23.918 21.219 1.00 0.00 N ATOM 222 CA GLN A 14 4.772 24.307 22.187 1.00 0.00 C ATOM 223 C GLN A 14 5.440 24.436 23.559 1.00 0.00 C ATOM 224 O GLN A 14 5.048 25.245 24.391 1.00 0.00 O ATOM 225 CB GLN A 14 3.738 23.171 22.147 1.00 0.00 C ATOM 226 CG GLN A 14 2.538 23.528 23.030 1.00 0.00 C ATOM 227 CD GLN A 14 2.885 23.291 24.501 1.00 0.00 C ATOM 228 OE1 GLN A 14 2.784 24.198 25.321 1.00 0.00 O ATOM 229 NE2 GLN A 14 3.287 22.110 24.883 1.00 0.00 N ATOM 0 H GLN A 14 5.684 23.031 20.736 1.00 0.00 H new ATOM 0 HA GLN A 14 4.282 25.255 21.963 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.409 23.003 21.122 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.192 22.242 22.493 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.260 24.571 22.876 1.00 0.00 H new ATOM 0 HG3 GLN A 14 1.676 22.923 22.749 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.371 21.355 24.202 1.00 0.00 H new ATOM 0 HE22 GLN A 14 3.517 21.942 25.862 1.00 0.00 H new ATOM 238 N SER A 15 6.481 23.671 23.775 1.00 0.00 N ATOM 239 CA SER A 15 7.236 23.747 25.050 1.00 0.00 C ATOM 240 C SER A 15 8.119 24.990 25.026 1.00 0.00 C ATOM 241 O SER A 15 8.350 25.652 26.042 1.00 0.00 O ATOM 242 CB SER A 15 8.093 22.480 25.078 1.00 0.00 C ATOM 243 OG SER A 15 7.922 21.825 26.329 1.00 0.00 O ATOM 0 H SER A 15 6.840 22.989 23.107 1.00 0.00 H new ATOM 0 HA SER A 15 6.591 23.813 25.926 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.806 21.815 24.264 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.142 22.733 24.927 1.00 0.00 H new ATOM 0 HG SER A 15 7.719 20.878 26.178 1.00 0.00 H new ATOM 249 N VAL A 16 8.612 25.316 23.867 1.00 0.00 N ATOM 250 CA VAL A 16 9.494 26.500 23.736 1.00 0.00 C ATOM 251 C VAL A 16 8.720 27.773 23.923 1.00 0.00 C ATOM 252 O VAL A 16 9.226 28.790 24.393 1.00 0.00 O ATOM 253 CB VAL A 16 10.057 26.435 22.321 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.014 27.590 22.116 1.00 0.00 C ATOM 255 CG2 VAL A 16 10.814 25.134 22.115 1.00 0.00 C ATOM 0 H VAL A 16 8.439 24.808 23.000 1.00 0.00 H new ATOM 0 HA VAL A 16 10.278 26.493 24.493 1.00 0.00 H new ATOM 0 HB VAL A 16 9.233 26.490 21.609 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.421 27.550 21.106 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.483 28.532 22.257 1.00 0.00 H new ATOM 0 HG13 VAL A 16 11.828 27.521 22.838 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.211 25.101 21.100 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.636 25.075 22.828 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.139 24.292 22.268 1.00 0.00 H new ATOM 265 N LEU A 17 7.515 27.728 23.551 1.00 0.00 N ATOM 266 CA LEU A 17 6.653 28.899 23.672 1.00 0.00 C ATOM 267 C LEU A 17 5.976 28.854 25.025 1.00 0.00 C ATOM 268 O LEU A 17 5.714 29.871 25.663 1.00 0.00 O ATOM 269 CB LEU A 17 5.680 28.691 22.535 1.00 0.00 C ATOM 270 CG LEU A 17 6.422 28.573 21.187 1.00 0.00 C ATOM 271 CD1 LEU A 17 5.613 29.281 20.119 1.00 0.00 C ATOM 272 CD2 LEU A 17 7.826 29.205 21.235 1.00 0.00 C ATOM 0 H LEU A 17 7.065 26.904 23.152 1.00 0.00 H new ATOM 0 HA LEU A 17 7.152 29.866 23.614 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.095 27.788 22.713 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.977 29.523 22.496 1.00 0.00 H new ATOM 0 HG LEU A 17 6.537 27.512 20.965 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.128 29.204 19.162 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.630 28.817 20.040 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.498 30.332 20.386 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.307 29.096 20.263 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.740 30.263 21.481 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.425 28.703 21.995 1.00 0.00 H new ATOM 284 N ALA A 18 5.726 27.668 25.479 1.00 0.00 N ATOM 285 CA ALA A 18 5.100 27.489 26.814 1.00 0.00 C ATOM 286 C ALA A 18 6.166 27.629 27.906 1.00 0.00 C ATOM 287 O ALA A 18 5.859 27.579 29.093 1.00 0.00 O ATOM 288 CB ALA A 18 4.520 26.076 26.815 1.00 0.00 C ATOM 0 H ALA A 18 5.930 26.802 24.979 1.00 0.00 H new ATOM 0 HA ALA A 18 4.329 28.235 27.008 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.042 25.880 27.775 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.783 25.985 26.017 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.320 25.354 26.654 1.00 0.00 H new ATOM 294 N ARG A 19 7.417 27.769 27.521 1.00 0.00 N ATOM 295 CA ARG A 19 8.526 27.895 28.517 1.00 0.00 C ATOM 296 C ARG A 19 8.455 26.759 29.521 1.00 0.00 C ATOM 297 O ARG A 19 8.687 26.930 30.715 1.00 0.00 O ATOM 298 CB ARG A 19 8.385 29.289 29.170 1.00 0.00 C ATOM 299 CG ARG A 19 7.241 29.333 30.193 1.00 0.00 C ATOM 300 CD ARG A 19 7.514 30.445 31.212 1.00 0.00 C ATOM 301 NE ARG A 19 8.302 29.794 32.301 1.00 0.00 N ATOM 302 CZ ARG A 19 8.564 30.440 33.412 1.00 0.00 C ATOM 303 NH1 ARG A 19 8.142 31.667 33.589 1.00 0.00 N ATOM 304 NH2 ARG A 19 9.254 29.855 34.353 1.00 0.00 N ATOM 0 H ARG A 19 7.716 27.801 26.546 1.00 0.00 H new ATOM 0 HA ARG A 19 9.508 27.818 28.050 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.321 29.555 29.661 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.208 30.036 28.396 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.292 29.513 29.687 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.155 28.372 30.701 1.00 0.00 H new ATOM 0 HD2 ARG A 19 8.071 31.266 30.760 1.00 0.00 H new ATOM 0 HD3 ARG A 19 6.584 30.864 31.596 1.00 0.00 H new ATOM 0 HE ARG A 19 8.639 28.839 32.180 1.00 0.00 H new ATOM 0 HH11 ARG A 19 7.603 32.131 32.858 1.00 0.00 H new ATOM 0 HH12 ARG A 19 8.352 32.158 34.458 1.00 0.00 H new ATOM 0 HH21 ARG A 19 9.587 28.900 34.222 1.00 0.00 H new ATOM 0 HH22 ARG A 19 9.460 30.353 35.219 1.00 0.00 H new ATOM 318 N ASP A 20 8.160 25.593 29.033 1.00 0.00 N ATOM 319 CA ASP A 20 8.089 24.406 29.915 1.00 0.00 C ATOM 320 C ASP A 20 9.497 24.037 30.397 1.00 0.00 C ATOM 321 O ASP A 20 10.318 23.562 29.617 1.00 0.00 O ATOM 322 CB ASP A 20 7.508 23.298 29.035 1.00 0.00 C ATOM 323 CG ASP A 20 7.151 22.085 29.898 1.00 0.00 C ATOM 324 OD1 ASP A 20 6.959 22.265 31.091 1.00 0.00 O ATOM 325 OD2 ASP A 20 7.073 20.998 29.351 1.00 0.00 O ATOM 0 H ASP A 20 7.963 25.411 28.049 1.00 0.00 H new ATOM 0 HA ASP A 20 7.481 24.575 30.804 1.00 0.00 H new ATOM 0 HB2 ASP A 20 6.621 23.661 28.516 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.230 23.012 28.270 1.00 0.00 H new ATOM 330 N PRO A 21 9.740 24.248 31.668 1.00 0.00 N ATOM 331 CA PRO A 21 11.062 23.915 32.267 1.00 0.00 C ATOM 332 C PRO A 21 11.264 22.395 32.280 1.00 0.00 C ATOM 333 O PRO A 21 12.222 21.882 32.854 1.00 0.00 O ATOM 334 CB PRO A 21 10.969 24.471 33.686 1.00 0.00 C ATOM 335 CG PRO A 21 9.507 24.510 33.982 1.00 0.00 C ATOM 336 CD PRO A 21 8.819 24.798 32.676 1.00 0.00 C ATOM 0 HA PRO A 21 11.905 24.331 31.715 1.00 0.00 H new ATOM 0 HB2 PRO A 21 11.500 23.836 34.396 1.00 0.00 H new ATOM 0 HB3 PRO A 21 11.413 25.464 33.752 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.169 23.561 34.398 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.280 25.280 34.719 1.00 0.00 H new ATOM 0 HD2 PRO A 21 7.840 24.322 32.626 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.661 25.867 32.534 1.00 0.00 H new ATOM 344 N ASN A 22 10.361 21.669 31.676 1.00 0.00 N ATOM 345 CA ASN A 22 10.447 20.201 31.656 1.00 0.00 C ATOM 346 C ASN A 22 10.965 19.751 30.305 1.00 0.00 C ATOM 347 O ASN A 22 11.375 18.608 30.111 1.00 0.00 O ATOM 348 CB ASN A 22 8.995 19.820 31.817 1.00 0.00 C ATOM 349 CG ASN A 22 8.831 18.329 31.617 1.00 0.00 C ATOM 350 OD1 ASN A 22 8.837 17.877 30.401 1.00 0.00 O flip ATOM 351 ND2 ASN A 22 8.696 17.565 32.570 1.00 0.00 N flip ATOM 0 H ASN A 22 9.552 22.053 31.187 1.00 0.00 H new ATOM 0 HA ASN A 22 11.107 19.765 32.406 1.00 0.00 H new ATOM 0 HB2 ASN A 22 8.643 20.104 32.809 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.385 20.362 31.095 1.00 0.00 H new ATOM 0 HD21 ASN A 22 8.693 17.932 33.522 1.00 0.00 H new ATOM 0 HD22 ASN A 22 8.587 16.564 32.409 1.00 0.00 H new ATOM 358 N ALA A 23 11.004 20.660 29.390 1.00 0.00 N ATOM 359 CA ALA A 23 11.555 20.342 28.055 1.00 0.00 C ATOM 360 C ALA A 23 12.891 21.055 27.919 1.00 0.00 C ATOM 361 O ALA A 23 13.643 20.880 26.953 1.00 0.00 O ATOM 362 CB ALA A 23 10.568 20.910 27.050 1.00 0.00 C ATOM 0 H ALA A 23 10.676 21.619 29.507 1.00 0.00 H new ATOM 0 HA ALA A 23 11.700 19.273 27.902 1.00 0.00 H new ATOM 0 HB1 ALA A 23 10.921 20.706 26.039 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.593 20.445 27.195 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.481 21.987 27.194 1.00 0.00 H new ATOM 368 N ASP A 24 13.191 21.852 28.902 1.00 0.00 N ATOM 369 CA ASP A 24 14.448 22.604 28.920 1.00 0.00 C ATOM 370 C ASP A 24 15.540 21.604 29.273 1.00 0.00 C ATOM 371 O ASP A 24 15.431 20.906 30.257 1.00 0.00 O ATOM 372 CB ASP A 24 14.196 23.628 30.043 1.00 0.00 C ATOM 373 CG ASP A 24 15.123 24.831 29.923 1.00 0.00 C ATOM 374 OD1 ASP A 24 15.784 24.944 28.917 1.00 0.00 O ATOM 375 OD2 ASP A 24 15.142 25.632 30.843 1.00 0.00 O ATOM 0 H ASP A 24 12.592 22.010 29.712 1.00 0.00 H new ATOM 0 HA ASP A 24 14.745 23.097 27.994 1.00 0.00 H new ATOM 0 HB2 ASP A 24 13.159 23.962 30.006 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.343 23.150 31.012 1.00 0.00 H new ATOM 380 N GLY A 25 16.559 21.478 28.474 1.00 0.00 N ATOM 381 CA GLY A 25 17.623 20.452 28.771 1.00 0.00 C ATOM 382 C GLY A 25 17.352 19.256 27.862 1.00 0.00 C ATOM 383 O GLY A 25 18.267 18.609 27.355 1.00 0.00 O ATOM 0 H GLY A 25 16.711 22.032 27.631 1.00 0.00 H new ATOM 0 HA2 GLY A 25 18.616 20.861 28.585 1.00 0.00 H new ATOM 0 HA3 GLY A 25 17.591 20.155 29.819 1.00 0.00 H new ATOM 387 N GLU A 26 16.096 18.973 27.626 1.00 0.00 N ATOM 388 CA GLU A 26 15.733 17.855 26.731 1.00 0.00 C ATOM 389 C GLU A 26 16.024 18.262 25.287 1.00 0.00 C ATOM 390 O GLU A 26 16.559 17.485 24.499 1.00 0.00 O ATOM 391 CB GLU A 26 14.233 17.641 26.945 1.00 0.00 C ATOM 392 CG GLU A 26 13.839 16.239 26.470 1.00 0.00 C ATOM 393 CD GLU A 26 13.138 15.490 27.605 1.00 0.00 C ATOM 394 OE1 GLU A 26 12.346 16.109 28.297 1.00 0.00 O ATOM 395 OE2 GLU A 26 13.405 14.310 27.764 1.00 0.00 O ATOM 0 H GLU A 26 15.305 19.479 28.024 1.00 0.00 H new ATOM 0 HA GLU A 26 16.294 16.944 26.937 1.00 0.00 H new ATOM 0 HB2 GLU A 26 13.985 17.761 28.000 1.00 0.00 H new ATOM 0 HB3 GLU A 26 13.667 18.394 26.397 1.00 0.00 H new ATOM 0 HG2 GLU A 26 13.179 16.309 25.605 1.00 0.00 H new ATOM 0 HG3 GLU A 26 14.725 15.690 26.151 1.00 0.00 H new ATOM 402 N PHE A 27 15.691 19.478 24.930 1.00 0.00 N ATOM 403 CA PHE A 27 15.964 19.950 23.536 1.00 0.00 C ATOM 404 C PHE A 27 16.180 21.453 23.500 1.00 0.00 C ATOM 405 O PHE A 27 15.934 22.176 24.464 1.00 0.00 O ATOM 406 CB PHE A 27 14.741 19.598 22.695 1.00 0.00 C ATOM 407 CG PHE A 27 13.606 20.573 22.942 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.580 21.816 22.289 1.00 0.00 C ATOM 409 CD2 PHE A 27 12.565 20.215 23.797 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.503 22.690 22.497 1.00 0.00 C ATOM 411 CE2 PHE A 27 11.493 21.094 24.010 1.00 0.00 C ATOM 412 CZ PHE A 27 11.460 22.324 23.357 1.00 0.00 C ATOM 0 H PHE A 27 15.244 20.162 25.540 1.00 0.00 H new ATOM 0 HA PHE A 27 16.867 19.474 23.154 1.00 0.00 H new ATOM 0 HB2 PHE A 27 15.008 19.607 21.638 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.413 18.586 22.932 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.387 22.098 21.629 1.00 0.00 H new ATOM 0 HD2 PHE A 27 12.584 19.258 24.297 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.478 23.645 21.994 1.00 0.00 H new ATOM 0 HE2 PHE A 27 10.693 20.817 24.680 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.629 22.996 23.514 1.00 0.00 H new ATOM 422 N VAL A 28 16.604 21.922 22.376 1.00 0.00 N ATOM 423 CA VAL A 28 16.822 23.377 22.187 1.00 0.00 C ATOM 424 C VAL A 28 16.061 23.805 20.963 1.00 0.00 C ATOM 425 O VAL A 28 15.534 22.979 20.225 1.00 0.00 O ATOM 426 CB VAL A 28 18.320 23.578 21.937 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.084 22.342 22.358 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.593 23.799 20.456 1.00 0.00 C ATOM 0 H VAL A 28 16.815 21.350 21.558 1.00 0.00 H new ATOM 0 HA VAL A 28 16.492 23.952 23.052 1.00 0.00 H new ATOM 0 HB VAL A 28 18.638 24.447 22.513 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.148 22.493 22.177 1.00 0.00 H new ATOM 0 HG12 VAL A 28 18.919 22.156 23.419 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.736 21.485 21.781 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.663 23.940 20.300 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.255 22.931 19.890 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.057 24.685 20.116 1.00 0.00 H new ATOM 438 N PHE A 29 16.054 25.060 20.684 1.00 0.00 N ATOM 439 CA PHE A 29 15.386 25.490 19.447 1.00 0.00 C ATOM 440 C PHE A 29 16.231 26.539 18.763 1.00 0.00 C ATOM 441 O PHE A 29 16.578 27.570 19.331 1.00 0.00 O ATOM 442 CB PHE A 29 13.978 25.940 19.825 1.00 0.00 C ATOM 443 CG PHE A 29 13.825 27.452 19.957 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.587 28.240 18.820 1.00 0.00 C ATOM 445 CD2 PHE A 29 13.843 28.056 21.224 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.378 29.625 18.953 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.625 29.439 21.350 1.00 0.00 C ATOM 448 CZ PHE A 29 13.394 30.218 20.216 1.00 0.00 C ATOM 0 H PHE A 29 16.474 25.799 21.248 1.00 0.00 H new ATOM 0 HA PHE A 29 15.282 24.689 18.715 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.278 25.579 19.072 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.700 25.473 20.770 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.564 27.783 17.842 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.025 27.457 22.104 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.205 30.230 18.076 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.636 29.899 22.327 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.227 31.280 20.316 1.00 0.00 H new ATOM 458 N ALA A 30 16.618 26.232 17.568 1.00 0.00 N ATOM 459 CA ALA A 30 17.530 27.132 16.808 1.00 0.00 C ATOM 460 C ALA A 30 16.810 27.984 15.773 1.00 0.00 C ATOM 461 O ALA A 30 16.284 27.492 14.778 1.00 0.00 O ATOM 462 CB ALA A 30 18.517 26.195 16.118 1.00 0.00 C ATOM 0 H ALA A 30 16.341 25.385 17.072 1.00 0.00 H new ATOM 0 HA ALA A 30 18.005 27.845 17.482 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.227 26.781 15.534 1.00 0.00 H new ATOM 0 HB2 ALA A 30 19.055 25.616 16.869 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.975 25.518 15.457 1.00 0.00 H new ATOM 468 N VAL A 31 16.826 29.266 15.982 1.00 0.00 N ATOM 469 CA VAL A 31 16.200 30.197 15.016 1.00 0.00 C ATOM 470 C VAL A 31 17.277 30.565 13.981 1.00 0.00 C ATOM 471 O VAL A 31 18.234 31.282 14.287 1.00 0.00 O ATOM 472 CB VAL A 31 15.806 31.424 15.843 1.00 0.00 C ATOM 473 CG1 VAL A 31 14.727 32.211 15.114 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.275 30.992 17.202 1.00 0.00 C ATOM 0 H VAL A 31 17.253 29.713 16.793 1.00 0.00 H new ATOM 0 HA VAL A 31 15.335 29.785 14.496 1.00 0.00 H new ATOM 0 HB VAL A 31 16.688 32.049 15.982 1.00 0.00 H new ATOM 0 HG11 VAL A 31 14.450 33.083 15.706 1.00 0.00 H new ATOM 0 HG12 VAL A 31 15.106 32.536 14.145 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.851 31.579 14.968 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.998 31.873 17.781 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.399 30.357 17.066 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.047 30.436 17.734 1.00 0.00 H new ATOM 484 N ARG A 32 17.151 30.069 12.781 1.00 0.00 N ATOM 485 CA ARG A 32 18.162 30.357 11.721 1.00 0.00 C ATOM 486 C ARG A 32 18.124 31.823 11.312 1.00 0.00 C ATOM 487 O ARG A 32 19.071 32.366 10.747 1.00 0.00 O ATOM 488 CB ARG A 32 17.674 29.536 10.547 1.00 0.00 C ATOM 489 CG ARG A 32 18.109 28.078 10.704 1.00 0.00 C ATOM 490 CD ARG A 32 17.235 27.184 9.819 1.00 0.00 C ATOM 491 NE ARG A 32 17.649 27.501 8.421 1.00 0.00 N ATOM 492 CZ ARG A 32 17.026 26.961 7.401 1.00 0.00 C ATOM 493 NH1 ARG A 32 16.029 26.134 7.589 1.00 0.00 N ATOM 494 NH2 ARG A 32 17.403 27.251 6.186 1.00 0.00 N ATOM 0 H ARG A 32 16.381 29.469 12.485 1.00 0.00 H new ATOM 0 HA ARG A 32 19.176 30.132 12.052 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.588 29.594 10.480 1.00 0.00 H new ATOM 0 HB3 ARG A 32 18.073 29.944 9.618 1.00 0.00 H new ATOM 0 HG2 ARG A 32 19.157 27.969 10.426 1.00 0.00 H new ATOM 0 HG3 ARG A 32 18.022 27.772 11.747 1.00 0.00 H new ATOM 0 HD2 ARG A 32 17.391 26.130 10.047 1.00 0.00 H new ATOM 0 HD3 ARG A 32 16.176 27.390 9.973 1.00 0.00 H new ATOM 0 HE ARG A 32 18.424 28.144 8.257 1.00 0.00 H new ATOM 0 HH11 ARG A 32 15.729 25.904 8.536 1.00 0.00 H new ATOM 0 HH12 ARG A 32 15.552 25.720 6.788 1.00 0.00 H new ATOM 0 HH21 ARG A 32 18.179 27.895 6.033 1.00 0.00 H new ATOM 0 HH22 ARG A 32 16.922 26.834 5.389 1.00 0.00 H new ATOM 508 N THR A 33 17.040 32.461 11.598 1.00 0.00 N ATOM 509 CA THR A 33 16.887 33.902 11.248 1.00 0.00 C ATOM 510 C THR A 33 17.904 34.715 12.037 1.00 0.00 C ATOM 511 O THR A 33 18.398 35.747 11.588 1.00 0.00 O ATOM 512 CB THR A 33 15.454 34.256 11.663 1.00 0.00 C ATOM 513 OG1 THR A 33 15.037 35.427 10.975 1.00 0.00 O ATOM 514 CG2 THR A 33 15.381 34.502 13.173 1.00 0.00 C ATOM 0 H THR A 33 16.235 32.047 12.067 1.00 0.00 H new ATOM 0 HA THR A 33 17.056 34.110 10.192 1.00 0.00 H new ATOM 0 HB THR A 33 14.799 33.423 11.408 1.00 0.00 H new ATOM 0 HG1 THR A 33 14.120 35.652 11.239 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.357 34.752 13.452 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.692 33.602 13.704 1.00 0.00 H new ATOM 0 HG23 THR A 33 16.042 35.327 13.440 1.00 0.00 H new ATOM 522 N THR A 34 18.226 34.250 13.208 1.00 0.00 N ATOM 523 CA THR A 34 19.228 34.974 14.050 1.00 0.00 C ATOM 524 C THR A 34 20.472 34.107 14.249 1.00 0.00 C ATOM 525 O THR A 34 21.504 34.574 14.726 1.00 0.00 O ATOM 526 CB THR A 34 18.535 35.228 15.395 1.00 0.00 C ATOM 527 OG1 THR A 34 19.359 36.064 16.195 1.00 0.00 O ATOM 528 CG2 THR A 34 18.307 33.901 16.114 1.00 0.00 C ATOM 0 H THR A 34 17.842 33.401 13.623 1.00 0.00 H new ATOM 0 HA THR A 34 19.552 35.904 13.584 1.00 0.00 H new ATOM 0 HB THR A 34 17.574 35.714 15.224 1.00 0.00 H new ATOM 0 HG1 THR A 34 20.301 35.853 16.026 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.815 34.085 17.069 1.00 0.00 H new ATOM 0 HG22 THR A 34 17.678 33.257 15.499 1.00 0.00 H new ATOM 0 HG23 THR A 34 19.266 33.412 16.288 1.00 0.00 H new ATOM 536 N GLY A 35 20.391 32.849 13.903 1.00 0.00 N ATOM 537 CA GLY A 35 21.557 31.953 14.081 1.00 0.00 C ATOM 538 C GLY A 35 21.715 31.623 15.565 1.00 0.00 C ATOM 539 O GLY A 35 22.824 31.444 16.058 1.00 0.00 O ATOM 0 H GLY A 35 19.562 32.408 13.504 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.419 31.038 13.505 1.00 0.00 H new ATOM 0 HA3 GLY A 35 22.460 32.433 13.705 1.00 0.00 H new ATOM 543 N ILE A 36 20.627 31.532 16.287 1.00 0.00 N ATOM 544 CA ILE A 36 20.726 31.203 17.746 1.00 0.00 C ATOM 545 C ILE A 36 19.867 29.988 18.047 1.00 0.00 C ATOM 546 O ILE A 36 18.980 29.630 17.280 1.00 0.00 O ATOM 547 CB ILE A 36 20.119 32.393 18.505 1.00 0.00 C ATOM 548 CG1 ILE A 36 21.006 33.622 18.392 1.00 0.00 C ATOM 549 CG2 ILE A 36 19.969 32.051 20.003 1.00 0.00 C ATOM 550 CD1 ILE A 36 20.284 34.778 19.082 1.00 0.00 C ATOM 0 H ILE A 36 19.680 31.670 15.935 1.00 0.00 H new ATOM 0 HA ILE A 36 21.760 31.008 18.029 1.00 0.00 H new ATOM 0 HB ILE A 36 19.145 32.600 18.061 1.00 0.00 H new ATOM 0 HG12 ILE A 36 21.973 33.440 18.861 1.00 0.00 H new ATOM 0 HG13 ILE A 36 21.198 33.861 17.346 1.00 0.00 H new ATOM 0 HG21 ILE A 36 19.538 32.903 20.529 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.315 31.186 20.115 1.00 0.00 H new ATOM 0 HG23 ILE A 36 20.948 31.822 20.424 1.00 0.00 H new ATOM 0 HD11 ILE A 36 20.895 35.678 19.019 1.00 0.00 H new ATOM 0 HD12 ILE A 36 19.327 34.954 18.591 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.114 34.528 20.129 1.00 0.00 H new ATOM 562 N PHE A 37 20.062 29.407 19.185 1.00 0.00 N ATOM 563 CA PHE A 37 19.206 28.278 19.594 1.00 0.00 C ATOM 564 C PHE A 37 19.032 28.347 21.098 1.00 0.00 C ATOM 565 O PHE A 37 19.996 28.318 21.863 1.00 0.00 O ATOM 566 CB PHE A 37 19.885 26.988 19.129 1.00 0.00 C ATOM 567 CG PHE A 37 20.942 26.544 20.098 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.563 25.866 21.258 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.292 26.768 19.824 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.527 25.413 22.148 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.261 26.305 20.712 1.00 0.00 C ATOM 572 CZ PHE A 37 22.876 25.625 21.877 1.00 0.00 C ATOM 0 H PHE A 37 20.785 29.669 19.856 1.00 0.00 H new ATOM 0 HA PHE A 37 18.213 28.313 19.145 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.138 26.202 19.018 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.332 27.144 18.147 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.517 25.693 21.463 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.584 27.297 18.929 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.231 24.897 23.049 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.308 26.470 20.503 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.627 25.265 22.565 1.00 0.00 H new ATOM 596 N ARG A 39 16.561 27.554 24.791 1.00 0.00 N ATOM 597 CA ARG A 39 15.848 26.495 25.479 1.00 0.00 C ATOM 598 C ARG A 39 14.363 26.746 25.229 1.00 0.00 C ATOM 599 O ARG A 39 14.008 27.767 24.644 1.00 0.00 O ATOM 600 CB ARG A 39 16.240 26.739 26.925 1.00 0.00 C ATOM 601 CG ARG A 39 17.517 25.955 27.246 1.00 0.00 C ATOM 602 CD ARG A 39 18.434 26.823 28.114 1.00 0.00 C ATOM 603 NE ARG A 39 17.896 26.694 29.501 1.00 0.00 N ATOM 604 CZ ARG A 39 17.480 27.743 30.174 1.00 0.00 C ATOM 605 NH1 ARG A 39 17.518 28.941 29.654 1.00 0.00 N ATOM 606 NH2 ARG A 39 17.019 27.586 31.383 1.00 0.00 N ATOM 0 HA ARG A 39 16.064 25.471 25.174 1.00 0.00 H new ATOM 0 HB2 ARG A 39 16.401 27.804 27.095 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.433 26.429 27.589 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.269 25.031 27.768 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.027 25.674 26.325 1.00 0.00 H new ATOM 0 HD2 ARG A 39 19.468 26.481 28.059 1.00 0.00 H new ATOM 0 HD3 ARG A 39 18.423 27.861 27.782 1.00 0.00 H new ATOM 0 HE ARG A 39 17.850 25.772 29.935 1.00 0.00 H new ATOM 0 HH11 ARG A 39 17.876 29.075 28.708 1.00 0.00 H new ATOM 0 HH12 ARG A 39 17.190 29.742 30.194 1.00 0.00 H new ATOM 0 HH21 ARG A 39 16.984 26.655 31.798 1.00 0.00 H new ATOM 0 HH22 ARG A 39 16.694 28.394 31.914 1.00 0.00 H new ATOM 620 N PRO A 40 13.535 25.848 25.648 1.00 0.00 N ATOM 621 CA PRO A 40 12.092 26.037 25.424 1.00 0.00 C ATOM 622 C PRO A 40 11.551 27.185 26.281 1.00 0.00 C ATOM 623 O PRO A 40 10.464 27.700 26.039 1.00 0.00 O ATOM 624 CB PRO A 40 11.482 24.705 25.842 1.00 0.00 C ATOM 625 CG PRO A 40 12.472 24.116 26.792 1.00 0.00 C ATOM 626 CD PRO A 40 13.829 24.603 26.356 1.00 0.00 C ATOM 0 HA PRO A 40 11.855 26.301 24.393 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.512 24.846 26.318 1.00 0.00 H new ATOM 0 HB3 PRO A 40 11.323 24.055 24.982 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.259 24.426 27.815 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.427 23.027 26.773 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.487 24.772 27.208 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.325 23.881 25.708 1.00 0.00 H new ATOM 634 N SER A 41 12.262 27.575 27.297 1.00 0.00 N ATOM 635 CA SER A 41 11.768 28.649 28.170 1.00 0.00 C ATOM 636 C SER A 41 12.664 29.910 28.111 1.00 0.00 C ATOM 637 O SER A 41 12.773 30.646 29.090 1.00 0.00 O ATOM 638 CB SER A 41 11.752 27.987 29.547 1.00 0.00 C ATOM 639 OG SER A 41 13.018 28.153 30.173 1.00 0.00 O ATOM 0 H SER A 41 13.170 27.188 27.555 1.00 0.00 H new ATOM 0 HA SER A 41 10.788 29.028 27.879 1.00 0.00 H new ATOM 0 HB2 SER A 41 10.970 28.428 30.164 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.520 26.926 29.449 1.00 0.00 H new ATOM 0 HG SER A 41 13.455 27.280 30.264 1.00 0.00 H new ATOM 645 N CYS A 42 13.302 30.181 26.983 1.00 0.00 N ATOM 646 CA CYS A 42 14.172 31.399 26.871 1.00 0.00 C ATOM 647 C CYS A 42 13.458 32.624 27.430 1.00 0.00 C ATOM 648 O CYS A 42 12.269 32.846 27.207 1.00 0.00 O ATOM 649 CB CYS A 42 14.451 31.612 25.382 1.00 0.00 C ATOM 650 SG CYS A 42 15.509 33.081 25.180 1.00 0.00 S ATOM 0 H CYS A 42 13.254 29.608 26.140 1.00 0.00 H new ATOM 0 HA CYS A 42 15.093 31.259 27.437 1.00 0.00 H new ATOM 0 HB2 CYS A 42 14.942 30.734 24.962 1.00 0.00 H new ATOM 0 HB3 CYS A 42 13.515 31.745 24.839 1.00 0.00 H new ATOM 0 HG CYS A 42 15.754 33.269 23.917 1.00 0.00 H new ATOM 655 N ARG A 43 14.178 33.407 28.156 1.00 0.00 N ATOM 656 CA ARG A 43 13.600 34.636 28.772 1.00 0.00 C ATOM 657 C ARG A 43 13.969 35.910 27.991 1.00 0.00 C ATOM 658 O ARG A 43 13.679 37.017 28.443 1.00 0.00 O ATOM 659 CB ARG A 43 14.201 34.680 30.179 1.00 0.00 C ATOM 660 CG ARG A 43 15.731 34.770 30.093 1.00 0.00 C ATOM 661 CD ARG A 43 16.356 33.415 30.448 1.00 0.00 C ATOM 662 NE ARG A 43 16.114 33.249 31.910 1.00 0.00 N ATOM 663 CZ ARG A 43 16.827 32.407 32.618 1.00 0.00 C ATOM 664 NH1 ARG A 43 17.768 31.689 32.060 1.00 0.00 N ATOM 665 NH2 ARG A 43 16.595 32.281 33.897 1.00 0.00 N ATOM 0 H ARG A 43 15.166 33.253 28.360 1.00 0.00 H new ATOM 0 HA ARG A 43 12.511 34.601 28.773 1.00 0.00 H new ATOM 0 HB2 ARG A 43 13.808 35.538 30.725 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.911 33.788 30.735 1.00 0.00 H new ATOM 0 HG2 ARG A 43 16.030 35.066 29.088 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.097 35.538 30.774 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.897 32.607 29.878 1.00 0.00 H new ATOM 0 HD3 ARG A 43 17.422 33.400 30.220 1.00 0.00 H new ATOM 0 HE ARG A 43 15.384 33.798 32.365 1.00 0.00 H new ATOM 0 HH11 ARG A 43 17.955 31.780 31.061 1.00 0.00 H new ATOM 0 HH12 ARG A 43 18.315 31.038 32.624 1.00 0.00 H new ATOM 0 HH21 ARG A 43 15.863 32.836 34.340 1.00 0.00 H new ATOM 0 HH22 ARG A 43 17.146 31.628 34.453 1.00 0.00 H new ATOM 679 N ALA A 44 14.633 35.804 26.867 1.00 0.00 N ATOM 680 CA ALA A 44 15.032 37.057 26.145 1.00 0.00 C ATOM 681 C ALA A 44 13.973 37.525 25.143 1.00 0.00 C ATOM 682 O ALA A 44 13.566 38.685 25.155 1.00 0.00 O ATOM 683 CB ALA A 44 16.326 36.691 25.417 1.00 0.00 C ATOM 0 H ALA A 44 14.912 34.928 26.424 1.00 0.00 H new ATOM 0 HA ALA A 44 15.152 37.885 26.844 1.00 0.00 H new ATOM 0 HB1 ALA A 44 16.688 37.556 24.861 1.00 0.00 H new ATOM 0 HB2 ALA A 44 17.079 36.386 26.144 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.135 35.870 24.726 1.00 0.00 H new ATOM 689 N ARG A 45 13.525 36.653 24.286 1.00 0.00 N ATOM 690 CA ARG A 45 12.489 37.029 23.258 1.00 0.00 C ATOM 691 C ARG A 45 12.340 35.830 22.291 1.00 0.00 C ATOM 692 O ARG A 45 13.014 34.816 22.460 1.00 0.00 O ATOM 693 CB ARG A 45 13.057 38.284 22.549 1.00 0.00 C ATOM 694 CG ARG A 45 11.937 39.080 21.861 1.00 0.00 C ATOM 695 CD ARG A 45 11.935 40.527 22.391 1.00 0.00 C ATOM 696 NE ARG A 45 12.709 41.326 21.384 1.00 0.00 N ATOM 697 CZ ARG A 45 13.089 42.547 21.641 1.00 0.00 C ATOM 698 NH1 ARG A 45 12.808 43.110 22.786 1.00 0.00 N ATOM 699 NH2 ARG A 45 13.758 43.209 20.740 1.00 0.00 N ATOM 0 H ARG A 45 13.830 35.681 24.245 1.00 0.00 H new ATOM 0 HA ARG A 45 11.504 37.249 23.670 1.00 0.00 H new ATOM 0 HB2 ARG A 45 13.566 38.918 23.275 1.00 0.00 H new ATOM 0 HB3 ARG A 45 13.801 37.984 21.811 1.00 0.00 H new ATOM 0 HG2 ARG A 45 12.085 39.077 20.781 1.00 0.00 H new ATOM 0 HG3 ARG A 45 10.972 38.610 22.052 1.00 0.00 H new ATOM 0 HD2 ARG A 45 10.918 40.905 22.494 1.00 0.00 H new ATOM 0 HD3 ARG A 45 12.398 40.584 23.376 1.00 0.00 H new ATOM 0 HE ARG A 45 12.942 40.907 20.484 1.00 0.00 H new ATOM 0 HH11 ARG A 45 12.285 42.594 23.493 1.00 0.00 H new ATOM 0 HH12 ARG A 45 13.112 44.066 22.973 1.00 0.00 H new ATOM 0 HH21 ARG A 45 13.979 42.772 19.845 1.00 0.00 H new ATOM 0 HH22 ARG A 45 14.061 44.165 20.929 1.00 0.00 H new ATOM 713 N HIS A 46 11.468 35.889 21.306 1.00 0.00 N ATOM 714 CA HIS A 46 11.305 34.707 20.393 1.00 0.00 C ATOM 715 C HIS A 46 11.123 35.056 18.924 1.00 0.00 C ATOM 716 O HIS A 46 10.661 36.127 18.553 1.00 0.00 O ATOM 717 CB HIS A 46 10.033 34.021 20.841 1.00 0.00 C ATOM 718 CG HIS A 46 10.338 32.983 21.858 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.515 33.030 23.212 1.00 0.00 N flip ATOM 720 CD2 HIS A 46 10.415 31.657 21.505 1.00 0.00 C flip ATOM 721 CE1 HIS A 46 10.682 31.740 23.698 1.00 0.00 C flip ATOM 722 NE2 HIS A 46 10.606 30.958 22.617 1.00 0.00 N flip ATOM 0 H HIS A 46 10.872 36.690 21.097 1.00 0.00 H new ATOM 0 HA HIS A 46 12.213 34.107 20.459 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.343 34.755 21.257 1.00 0.00 H new ATOM 0 HB3 HIS A 46 9.536 33.566 19.984 1.00 0.00 H new ATOM 0 HD1 HIS A 46 10.523 33.879 23.777 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.335 31.257 20.505 1.00 0.00 H new ATOM 0 HE1 HIS A 46 10.839 31.436 24.722 1.00 0.00 H new ATOM 730 N ALA A 47 11.415 34.090 18.097 1.00 0.00 N ATOM 731 CA ALA A 47 11.229 34.226 16.636 1.00 0.00 C ATOM 732 C ALA A 47 10.250 33.143 16.165 1.00 0.00 C ATOM 733 O ALA A 47 10.031 32.148 16.853 1.00 0.00 O ATOM 734 CB ALA A 47 12.614 34.019 16.029 1.00 0.00 C ATOM 0 H ALA A 47 11.786 33.186 18.390 1.00 0.00 H new ATOM 0 HA ALA A 47 10.820 35.193 16.343 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.553 34.106 14.944 1.00 0.00 H new ATOM 0 HB2 ALA A 47 13.297 34.775 16.416 1.00 0.00 H new ATOM 0 HB3 ALA A 47 12.983 33.028 16.293 1.00 0.00 H new ATOM 740 N LEU A 48 9.636 33.324 15.031 1.00 0.00 N ATOM 741 CA LEU A 48 8.654 32.326 14.543 1.00 0.00 C ATOM 742 C LEU A 48 9.233 30.904 14.514 1.00 0.00 C ATOM 743 O LEU A 48 10.442 30.700 14.424 1.00 0.00 O ATOM 744 CB LEU A 48 8.289 32.785 13.130 1.00 0.00 C ATOM 745 CG LEU A 48 7.329 33.974 13.208 1.00 0.00 C ATOM 746 CD1 LEU A 48 7.066 34.509 11.800 1.00 0.00 C ATOM 747 CD2 LEU A 48 6.009 33.524 13.837 1.00 0.00 C ATOM 0 H LEU A 48 9.775 34.128 14.418 1.00 0.00 H new ATOM 0 HA LEU A 48 7.790 32.275 15.205 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.190 33.067 12.584 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.826 31.966 12.579 1.00 0.00 H new ATOM 0 HG LEU A 48 7.773 34.760 13.819 1.00 0.00 H new ATOM 0 HD11 LEU A 48 6.382 35.356 11.854 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.006 34.830 11.351 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.622 33.723 11.189 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.325 34.371 13.893 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.564 32.738 13.227 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.196 33.142 14.841 1.00 0.00 H new ATOM 759 N ARG A 49 8.371 29.920 14.572 1.00 0.00 N ATOM 760 CA ARG A 49 8.818 28.490 14.531 1.00 0.00 C ATOM 761 C ARG A 49 9.489 28.220 13.192 1.00 0.00 C ATOM 762 O ARG A 49 10.379 27.387 13.046 1.00 0.00 O ATOM 763 CB ARG A 49 7.514 27.723 14.579 1.00 0.00 C ATOM 764 CG ARG A 49 7.766 26.291 15.058 1.00 0.00 C ATOM 765 CD ARG A 49 6.456 25.499 15.015 1.00 0.00 C ATOM 766 NE ARG A 49 6.582 24.603 13.829 1.00 0.00 N ATOM 767 CZ ARG A 49 5.710 23.648 13.617 1.00 0.00 C ATOM 768 NH1 ARG A 49 4.711 23.461 14.442 1.00 0.00 N ATOM 769 NH2 ARG A 49 5.838 22.875 12.575 1.00 0.00 N ATOM 0 H ARG A 49 7.362 30.047 14.647 1.00 0.00 H new ATOM 0 HA ARG A 49 9.515 28.228 15.327 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.814 28.222 15.249 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.054 27.709 13.591 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.514 25.811 14.426 1.00 0.00 H new ATOM 0 HG3 ARG A 49 8.164 26.301 16.073 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.313 24.924 15.930 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.597 26.163 14.918 1.00 0.00 H new ATOM 0 HE ARG A 49 7.355 24.735 13.176 1.00 0.00 H new ATOM 0 HH11 ARG A 49 4.605 24.062 15.260 1.00 0.00 H new ATOM 0 HH12 ARG A 49 4.038 22.715 14.267 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.615 23.015 11.929 1.00 0.00 H new ATOM 0 HH22 ARG A 49 5.162 22.130 12.406 1.00 0.00 H new ATOM 783 N GLU A 50 9.029 28.933 12.223 1.00 0.00 N ATOM 784 CA GLU A 50 9.524 28.836 10.835 1.00 0.00 C ATOM 785 C GLU A 50 11.035 28.663 10.772 1.00 0.00 C ATOM 786 O GLU A 50 11.557 27.666 10.276 1.00 0.00 O ATOM 787 CB GLU A 50 9.142 30.194 10.287 1.00 0.00 C ATOM 788 CG GLU A 50 9.219 30.167 8.791 1.00 0.00 C ATOM 789 CD GLU A 50 10.670 30.319 8.330 1.00 0.00 C ATOM 790 OE1 GLU A 50 11.104 31.447 8.170 1.00 0.00 O ATOM 791 OE2 GLU A 50 11.322 29.305 8.142 1.00 0.00 O ATOM 0 H GLU A 50 8.285 29.621 12.343 1.00 0.00 H new ATOM 0 HA GLU A 50 9.116 27.981 10.295 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.133 30.456 10.605 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.810 30.959 10.683 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.808 29.230 8.416 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.612 30.971 8.374 1.00 0.00 H new ATOM 798 N ASN A 51 11.732 29.628 11.272 1.00 0.00 N ATOM 799 CA ASN A 51 13.218 29.571 11.269 1.00 0.00 C ATOM 800 C ASN A 51 13.689 28.904 12.548 1.00 0.00 C ATOM 801 O ASN A 51 14.835 29.027 12.949 1.00 0.00 O ATOM 802 CB ASN A 51 13.654 31.035 11.273 1.00 0.00 C ATOM 803 CG ASN A 51 13.283 31.694 9.946 1.00 0.00 C ATOM 804 OD1 ASN A 51 13.733 31.268 8.884 1.00 0.00 O ATOM 805 ND2 ASN A 51 12.479 32.722 9.952 1.00 0.00 N ATOM 0 H ASN A 51 11.336 30.470 11.691 1.00 0.00 H new ATOM 0 HA ASN A 51 13.621 29.015 10.423 1.00 0.00 H new ATOM 0 HB2 ASN A 51 13.175 31.563 12.097 1.00 0.00 H new ATOM 0 HB3 ASN A 51 14.730 31.102 11.434 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.223 33.174 9.074 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.107 33.073 10.834 1.00 0.00 H new ATOM 812 N VAL A 52 12.811 28.220 13.205 1.00 0.00 N ATOM 813 CA VAL A 52 13.180 27.568 14.485 1.00 0.00 C ATOM 814 C VAL A 52 13.213 26.036 14.356 1.00 0.00 C ATOM 815 O VAL A 52 12.239 25.404 13.952 1.00 0.00 O ATOM 816 CB VAL A 52 12.069 28.030 15.430 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.799 26.979 16.500 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.488 29.335 16.104 1.00 0.00 C ATOM 0 H VAL A 52 11.844 28.081 12.911 1.00 0.00 H new ATOM 0 HA VAL A 52 14.179 27.835 14.830 1.00 0.00 H new ATOM 0 HB VAL A 52 11.159 28.182 14.849 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.006 27.328 17.161 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.492 26.047 16.025 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.706 26.809 17.080 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.698 29.666 16.778 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.405 29.174 16.671 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.661 30.098 15.345 1.00 0.00 H new ATOM 828 N SER A 53 14.312 25.434 14.730 1.00 0.00 N ATOM 829 CA SER A 53 14.424 23.951 14.682 1.00 0.00 C ATOM 830 C SER A 53 14.718 23.447 16.090 1.00 0.00 C ATOM 831 O SER A 53 14.876 24.240 17.012 1.00 0.00 O ATOM 832 CB SER A 53 15.591 23.657 13.743 1.00 0.00 C ATOM 833 OG SER A 53 16.635 24.593 13.979 1.00 0.00 O ATOM 0 H SER A 53 15.145 25.915 15.070 1.00 0.00 H new ATOM 0 HA SER A 53 13.515 23.463 14.331 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.955 22.642 13.904 1.00 0.00 H new ATOM 0 HB3 SER A 53 15.261 23.717 12.706 1.00 0.00 H new ATOM 0 HG SER A 53 17.386 24.404 13.378 1.00 0.00 H new ATOM 839 N PHE A 54 14.762 22.161 16.296 1.00 0.00 N ATOM 840 CA PHE A 54 15.001 21.640 17.646 1.00 0.00 C ATOM 841 C PHE A 54 16.196 20.703 17.677 1.00 0.00 C ATOM 842 O PHE A 54 16.524 20.031 16.703 1.00 0.00 O ATOM 843 CB PHE A 54 13.719 20.906 17.962 1.00 0.00 C ATOM 844 CG PHE A 54 12.595 21.900 17.885 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.219 22.620 19.022 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.961 22.135 16.660 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.209 23.580 18.933 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.946 23.088 16.574 1.00 0.00 C ATOM 849 CZ PHE A 54 10.573 23.812 17.709 1.00 0.00 C ATOM 0 H PHE A 54 14.640 21.452 15.573 1.00 0.00 H new ATOM 0 HA PHE A 54 15.236 22.422 18.368 1.00 0.00 H new ATOM 0 HB2 PHE A 54 13.559 20.092 17.255 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.768 20.460 18.955 1.00 0.00 H new ATOM 0 HD1 PHE A 54 12.708 22.434 19.967 1.00 0.00 H new ATOM 0 HD2 PHE A 54 12.257 21.579 15.782 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.919 24.143 19.808 1.00 0.00 H new ATOM 0 HE2 PHE A 54 10.449 23.266 15.632 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.791 24.554 17.641 1.00 0.00 H new ATOM 859 N TYR A 55 16.849 20.667 18.792 1.00 0.00 N ATOM 860 CA TYR A 55 18.044 19.798 18.947 1.00 0.00 C ATOM 861 C TYR A 55 17.925 18.977 20.220 1.00 0.00 C ATOM 862 O TYR A 55 17.264 19.384 21.170 1.00 0.00 O ATOM 863 CB TYR A 55 19.205 20.780 19.074 1.00 0.00 C ATOM 864 CG TYR A 55 19.416 21.455 17.747 1.00 0.00 C ATOM 865 CD1 TYR A 55 18.536 22.458 17.327 1.00 0.00 C ATOM 866 CD2 TYR A 55 20.476 21.063 16.929 1.00 0.00 C ATOM 867 CE1 TYR A 55 18.719 23.070 16.085 1.00 0.00 C ATOM 868 CE2 TYR A 55 20.659 21.671 15.683 1.00 0.00 C ATOM 869 CZ TYR A 55 19.781 22.676 15.259 1.00 0.00 C ATOM 870 OH TYR A 55 19.958 23.276 14.030 1.00 0.00 O ATOM 0 H TYR A 55 16.605 21.211 19.620 1.00 0.00 H new ATOM 0 HA TYR A 55 18.168 19.100 18.119 1.00 0.00 H new ATOM 0 HB2 TYR A 55 18.990 21.521 19.844 1.00 0.00 H new ATOM 0 HB3 TYR A 55 20.111 20.256 19.379 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.716 22.759 17.962 1.00 0.00 H new ATOM 0 HD2 TYR A 55 21.155 20.290 17.258 1.00 0.00 H new ATOM 0 HE1 TYR A 55 18.042 23.847 15.761 1.00 0.00 H new ATOM 0 HE2 TYR A 55 21.477 21.365 15.048 1.00 0.00 H new ATOM 0 HH TYR A 55 20.062 22.587 13.341 1.00 0.00 H new ATOM 880 N ALA A 56 18.572 17.849 20.279 1.00 0.00 N ATOM 881 CA ALA A 56 18.508 17.046 21.525 1.00 0.00 C ATOM 882 C ALA A 56 19.262 17.806 22.606 1.00 0.00 C ATOM 883 O ALA A 56 18.834 17.887 23.755 1.00 0.00 O ATOM 884 CB ALA A 56 19.203 15.731 21.204 1.00 0.00 C ATOM 0 H ALA A 56 19.136 17.453 19.527 1.00 0.00 H new ATOM 0 HA ALA A 56 17.491 16.866 21.873 1.00 0.00 H new ATOM 0 HB1 ALA A 56 19.191 15.089 22.085 1.00 0.00 H new ATOM 0 HB2 ALA A 56 18.682 15.234 20.386 1.00 0.00 H new ATOM 0 HB3 ALA A 56 20.235 15.927 20.912 1.00 0.00 H new ATOM 890 N ASN A 57 20.375 18.388 22.249 1.00 0.00 N ATOM 891 CA ASN A 57 21.148 19.164 23.230 1.00 0.00 C ATOM 892 C ASN A 57 21.668 20.443 22.602 1.00 0.00 C ATOM 893 O ASN A 57 21.700 20.614 21.377 1.00 0.00 O ATOM 894 CB ASN A 57 22.329 18.298 23.609 1.00 0.00 C ATOM 895 CG ASN A 57 23.099 17.912 22.355 1.00 0.00 C ATOM 896 OD1 ASN A 57 24.061 18.581 21.992 1.00 0.00 O ATOM 897 ND2 ASN A 57 22.719 16.873 21.666 1.00 0.00 N ATOM 0 H ASN A 57 20.775 18.353 21.311 1.00 0.00 H new ATOM 0 HA ASN A 57 20.530 19.429 24.088 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.981 18.835 24.298 1.00 0.00 H new ATOM 0 HB3 ASN A 57 21.985 17.403 24.128 1.00 0.00 H new ATOM 0 HD21 ASN A 57 23.223 16.611 20.818 1.00 0.00 H new ATOM 0 HD22 ASN A 57 21.918 16.322 21.974 1.00 0.00 H new ATOM 904 N ALA A 58 22.102 21.330 23.427 1.00 0.00 N ATOM 905 CA ALA A 58 22.655 22.599 22.928 1.00 0.00 C ATOM 906 C ALA A 58 23.906 22.334 22.091 1.00 0.00 C ATOM 907 O ALA A 58 24.254 23.133 21.241 1.00 0.00 O ATOM 908 CB ALA A 58 23.014 23.393 24.181 1.00 0.00 C ATOM 0 H ALA A 58 22.098 21.230 24.442 1.00 0.00 H new ATOM 0 HA ALA A 58 21.951 23.135 22.292 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.435 24.356 23.893 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.117 23.553 24.780 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.747 22.837 24.766 1.00 0.00 H new ATOM 914 N SER A 59 24.590 21.231 22.296 1.00 0.00 N ATOM 915 CA SER A 59 25.812 20.982 21.474 1.00 0.00 C ATOM 916 C SER A 59 25.394 20.654 20.048 1.00 0.00 C ATOM 917 O SER A 59 26.037 21.065 19.085 1.00 0.00 O ATOM 918 CB SER A 59 26.531 19.800 22.128 1.00 0.00 C ATOM 919 OG SER A 59 27.891 19.795 21.717 1.00 0.00 O ATOM 0 H SER A 59 24.360 20.510 22.980 1.00 0.00 H new ATOM 0 HA SER A 59 26.470 21.850 21.431 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.467 19.875 23.213 1.00 0.00 H new ATOM 0 HB3 SER A 59 26.050 18.864 21.845 1.00 0.00 H new ATOM 0 HG SER A 59 28.356 19.040 22.135 1.00 0.00 H new ATOM 925 N GLU A 60 24.305 19.955 19.891 1.00 0.00 N ATOM 926 CA GLU A 60 23.821 19.644 18.529 1.00 0.00 C ATOM 927 C GLU A 60 23.506 20.978 17.858 1.00 0.00 C ATOM 928 O GLU A 60 23.973 21.291 16.757 1.00 0.00 O ATOM 929 CB GLU A 60 22.558 18.808 18.750 1.00 0.00 C ATOM 930 CG GLU A 60 22.240 18.009 17.488 1.00 0.00 C ATOM 931 CD GLU A 60 23.382 17.032 17.187 1.00 0.00 C ATOM 932 OE1 GLU A 60 24.252 16.885 18.032 1.00 0.00 O ATOM 933 OE2 GLU A 60 23.366 16.446 16.117 1.00 0.00 O ATOM 0 H GLU A 60 23.733 19.588 20.651 1.00 0.00 H new ATOM 0 HA GLU A 60 24.528 19.103 17.900 1.00 0.00 H new ATOM 0 HB2 GLU A 60 22.701 18.132 19.593 1.00 0.00 H new ATOM 0 HB3 GLU A 60 21.720 19.458 19.001 1.00 0.00 H new ATOM 0 HG2 GLU A 60 21.307 17.462 17.619 1.00 0.00 H new ATOM 0 HG3 GLU A 60 22.097 18.685 16.645 1.00 0.00 H new ATOM 940 N ALA A 61 22.771 21.803 18.553 1.00 0.00 N ATOM 941 CA ALA A 61 22.466 23.159 18.020 1.00 0.00 C ATOM 942 C ALA A 61 23.777 23.888 17.794 1.00 0.00 C ATOM 943 O ALA A 61 24.004 24.520 16.765 1.00 0.00 O ATOM 944 CB ALA A 61 21.700 23.841 19.136 1.00 0.00 C ATOM 0 H ALA A 61 22.369 21.595 19.467 1.00 0.00 H new ATOM 0 HA ALA A 61 21.908 23.140 17.084 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.433 24.852 18.829 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.793 23.276 19.353 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.322 23.886 20.030 1.00 0.00 H new ATOM 950 N LEU A 62 24.654 23.778 18.748 1.00 0.00 N ATOM 951 CA LEU A 62 25.979 24.417 18.631 1.00 0.00 C ATOM 952 C LEU A 62 26.683 23.827 17.407 1.00 0.00 C ATOM 953 O LEU A 62 27.503 24.478 16.759 1.00 0.00 O ATOM 954 CB LEU A 62 26.691 24.026 19.931 1.00 0.00 C ATOM 955 CG LEU A 62 26.145 24.826 21.126 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.669 24.210 22.424 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.588 26.289 21.061 1.00 0.00 C ATOM 0 H LEU A 62 24.501 23.263 19.615 1.00 0.00 H new ATOM 0 HA LEU A 62 25.952 25.499 18.502 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.560 22.959 20.114 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.762 24.203 19.830 1.00 0.00 H new ATOM 0 HG LEU A 62 25.056 24.789 21.094 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.285 24.773 23.275 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.337 23.174 22.495 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.758 24.243 22.429 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.187 26.829 21.919 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.677 26.341 21.077 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.217 26.741 20.141 1.00 0.00 H new ATOM 969 N ALA A 63 26.356 22.602 17.070 1.00 0.00 N ATOM 970 CA ALA A 63 26.967 21.953 15.890 1.00 0.00 C ATOM 971 C ALA A 63 26.290 22.450 14.609 1.00 0.00 C ATOM 972 O ALA A 63 26.833 22.323 13.513 1.00 0.00 O ATOM 973 CB ALA A 63 26.730 20.453 16.082 1.00 0.00 C ATOM 0 H ALA A 63 25.683 22.026 17.575 1.00 0.00 H new ATOM 0 HA ALA A 63 28.029 22.181 15.798 1.00 0.00 H new ATOM 0 HB1 ALA A 63 27.158 19.907 15.242 1.00 0.00 H new ATOM 0 HB2 ALA A 63 27.204 20.125 17.007 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.659 20.258 16.134 1.00 0.00 H new ATOM 979 N ALA A 64 25.117 23.028 14.726 1.00 0.00 N ATOM 980 CA ALA A 64 24.420 23.545 13.501 1.00 0.00 C ATOM 981 C ALA A 64 25.051 24.853 13.052 1.00 0.00 C ATOM 982 O ALA A 64 24.643 25.470 12.071 1.00 0.00 O ATOM 983 CB ALA A 64 22.953 23.766 13.883 1.00 0.00 C ATOM 0 H ALA A 64 24.616 23.164 15.604 1.00 0.00 H new ATOM 0 HA ALA A 64 24.504 22.837 12.676 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.405 24.143 13.020 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.515 22.822 14.206 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.894 24.490 14.695 1.00 0.00 H new ATOM 989 N GLY A 65 26.037 25.272 13.762 1.00 0.00 N ATOM 990 CA GLY A 65 26.735 26.542 13.421 1.00 0.00 C ATOM 991 C GLY A 65 25.953 27.720 13.999 1.00 0.00 C ATOM 992 O GLY A 65 25.878 28.790 13.400 1.00 0.00 O ATOM 0 H GLY A 65 26.404 24.788 14.581 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.749 26.532 13.822 1.00 0.00 H new ATOM 0 HA3 GLY A 65 26.821 26.644 12.339 1.00 0.00 H new ATOM 996 N PHE A 66 25.372 27.546 15.157 1.00 0.00 N ATOM 997 CA PHE A 66 24.598 28.658 15.776 1.00 0.00 C ATOM 998 C PHE A 66 25.293 29.201 17.016 1.00 0.00 C ATOM 999 O PHE A 66 26.137 28.548 17.627 1.00 0.00 O ATOM 1000 CB PHE A 66 23.244 28.063 16.169 1.00 0.00 C ATOM 1001 CG PHE A 66 22.420 27.780 14.939 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.288 28.764 13.952 1.00 0.00 C ATOM 1003 CD2 PHE A 66 21.764 26.553 14.798 1.00 0.00 C ATOM 1004 CE1 PHE A 66 21.499 28.522 12.825 1.00 0.00 C ATOM 1005 CE2 PHE A 66 20.979 26.310 13.667 1.00 0.00 C ATOM 1006 CZ PHE A 66 20.847 27.296 12.683 1.00 0.00 C ATOM 0 H PHE A 66 25.401 26.682 15.699 1.00 0.00 H new ATOM 0 HA PHE A 66 24.500 29.488 15.076 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.394 27.143 16.734 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.711 28.755 16.821 1.00 0.00 H new ATOM 0 HD1 PHE A 66 22.796 29.711 14.062 1.00 0.00 H new ATOM 0 HD2 PHE A 66 21.864 25.795 15.561 1.00 0.00 H new ATOM 0 HE1 PHE A 66 21.394 29.282 12.065 1.00 0.00 H new ATOM 0 HE2 PHE A 66 20.475 25.362 13.553 1.00 0.00 H new ATOM 0 HZ PHE A 66 20.239 27.108 11.811 1.00 0.00 H new ATOM 1016 N ARG A 67 24.918 30.382 17.411 1.00 0.00 N ATOM 1017 CA ARG A 67 25.503 30.991 18.626 1.00 0.00 C ATOM 1018 C ARG A 67 24.506 30.785 19.765 1.00 0.00 C ATOM 1019 O ARG A 67 23.380 31.275 19.697 1.00 0.00 O ATOM 1020 CB ARG A 67 25.650 32.483 18.307 1.00 0.00 C ATOM 1021 CG ARG A 67 26.313 32.671 16.938 1.00 0.00 C ATOM 1022 CD ARG A 67 27.732 32.101 16.967 1.00 0.00 C ATOM 1023 NE ARG A 67 28.076 31.856 15.535 1.00 0.00 N ATOM 1024 CZ ARG A 67 29.326 31.731 15.156 1.00 0.00 C ATOM 1025 NH1 ARG A 67 30.300 31.819 16.025 1.00 0.00 N ATOM 1026 NH2 ARG A 67 29.599 31.517 13.899 1.00 0.00 N ATOM 0 H ARG A 67 24.222 30.956 16.935 1.00 0.00 H new ATOM 0 HA ARG A 67 26.463 30.561 18.912 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.671 32.961 18.313 1.00 0.00 H new ATOM 0 HB3 ARG A 67 26.247 32.970 19.078 1.00 0.00 H new ATOM 0 HG2 ARG A 67 25.726 32.171 16.168 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.342 33.730 16.680 1.00 0.00 H new ATOM 0 HD2 ARG A 67 28.430 32.801 17.427 1.00 0.00 H new ATOM 0 HD3 ARG A 67 27.776 31.179 17.547 1.00 0.00 H new ATOM 0 HE ARG A 67 27.330 31.785 14.843 1.00 0.00 H new ATOM 0 HH11 ARG A 67 30.092 31.986 17.009 1.00 0.00 H new ATOM 0 HH12 ARG A 67 31.268 31.720 15.718 1.00 0.00 H new ATOM 0 HH21 ARG A 67 28.843 31.448 13.218 1.00 0.00 H new ATOM 0 HH22 ARG A 67 30.568 31.419 13.597 1.00 0.00 H new ATOM 1040 N PRO A 68 24.914 30.057 20.765 1.00 0.00 N ATOM 1041 CA PRO A 68 24.005 29.782 21.897 1.00 0.00 C ATOM 1042 C PRO A 68 23.624 31.082 22.610 1.00 0.00 C ATOM 1043 O PRO A 68 24.456 31.952 22.860 1.00 0.00 O ATOM 1044 CB PRO A 68 24.801 28.814 22.773 1.00 0.00 C ATOM 1045 CG PRO A 68 26.232 29.039 22.402 1.00 0.00 C ATOM 1046 CD PRO A 68 26.235 29.444 20.953 1.00 0.00 C ATOM 0 HA PRO A 68 23.049 29.348 21.603 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.633 29.011 23.832 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.504 27.781 22.590 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.677 29.816 23.024 1.00 0.00 H new ATOM 0 HG3 PRO A 68 26.820 28.134 22.554 1.00 0.00 H new ATOM 0 HD2 PRO A 68 27.039 30.147 20.735 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.376 28.585 20.297 1.00 0.00 H new ATOM 1054 N CYS A 69 22.360 31.230 22.909 1.00 0.00 N ATOM 1055 CA CYS A 69 21.865 32.468 23.573 1.00 0.00 C ATOM 1056 C CYS A 69 22.581 32.660 24.914 1.00 0.00 C ATOM 1057 O CYS A 69 22.486 31.828 25.810 1.00 0.00 O ATOM 1058 CB CYS A 69 20.362 32.212 23.724 1.00 0.00 C ATOM 1059 SG CYS A 69 19.573 33.319 24.935 1.00 0.00 S ATOM 0 H CYS A 69 21.640 30.533 22.717 1.00 0.00 H new ATOM 0 HA CYS A 69 22.056 33.386 23.018 1.00 0.00 H new ATOM 0 HB2 CYS A 69 19.878 32.337 22.755 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.204 31.177 24.028 1.00 0.00 H new ATOM 0 HG CYS A 69 18.283 33.165 24.887 1.00 0.00 H new ATOM 1064 N LYS A 70 23.308 33.739 25.058 1.00 0.00 N ATOM 1065 CA LYS A 70 24.061 33.991 26.329 1.00 0.00 C ATOM 1066 C LYS A 70 23.130 33.992 27.546 1.00 0.00 C ATOM 1067 O LYS A 70 23.565 34.173 28.679 1.00 0.00 O ATOM 1068 CB LYS A 70 24.707 35.365 26.145 1.00 0.00 C ATOM 1069 CG LYS A 70 26.015 35.421 26.942 1.00 0.00 C ATOM 1070 CD LYS A 70 27.201 35.553 25.981 1.00 0.00 C ATOM 1071 CE LYS A 70 28.368 34.701 26.487 1.00 0.00 C ATOM 1072 NZ LYS A 70 29.585 35.518 26.226 1.00 0.00 N ATOM 0 H LYS A 70 23.414 34.462 24.346 1.00 0.00 H new ATOM 0 HA LYS A 70 24.797 33.209 26.515 1.00 0.00 H new ATOM 0 HB2 LYS A 70 24.903 35.549 25.089 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.028 36.147 26.484 1.00 0.00 H new ATOM 0 HG2 LYS A 70 25.997 36.266 27.630 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.123 34.520 27.546 1.00 0.00 H new ATOM 0 HD2 LYS A 70 26.910 35.232 24.981 1.00 0.00 H new ATOM 0 HD3 LYS A 70 27.506 36.597 25.904 1.00 0.00 H new ATOM 0 HE2 LYS A 70 28.263 34.478 27.549 1.00 0.00 H new ATOM 0 HE3 LYS A 70 28.415 33.746 25.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 30.427 34.999 26.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 29.663 35.708 25.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 29.516 36.418 26.742 1.00 0.00 H new ATOM 1086 N ARG A 71 21.865 33.788 27.337 1.00 0.00 N ATOM 1087 CA ARG A 71 20.904 33.760 28.467 1.00 0.00 C ATOM 1088 C ARG A 71 20.522 32.307 28.728 1.00 0.00 C ATOM 1089 O ARG A 71 20.349 31.865 29.861 1.00 0.00 O ATOM 1090 CB ARG A 71 19.700 34.524 27.937 1.00 0.00 C ATOM 1091 CG ARG A 71 18.989 35.245 29.086 1.00 0.00 C ATOM 1092 CD ARG A 71 19.746 36.534 29.421 1.00 0.00 C ATOM 1093 NE ARG A 71 18.725 37.450 30.012 1.00 0.00 N ATOM 1094 CZ ARG A 71 17.856 38.070 29.249 1.00 0.00 C ATOM 1095 NH1 ARG A 71 17.862 37.901 27.951 1.00 0.00 N ATOM 1096 NH2 ARG A 71 16.973 38.864 29.791 1.00 0.00 N ATOM 0 H ARG A 71 21.450 33.637 26.418 1.00 0.00 H new ATOM 0 HA ARG A 71 21.293 34.186 29.392 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.019 35.246 27.186 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.011 33.837 27.446 1.00 0.00 H new ATOM 0 HG2 ARG A 71 17.961 35.476 28.805 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.942 34.599 29.963 1.00 0.00 H new ATOM 0 HD2 ARG A 71 20.556 36.342 30.124 1.00 0.00 H new ATOM 0 HD3 ARG A 71 20.195 36.969 28.528 1.00 0.00 H new ATOM 0 HE ARG A 71 18.703 37.595 31.021 1.00 0.00 H new ATOM 0 HH11 ARG A 71 18.548 37.281 27.521 1.00 0.00 H new ATOM 0 HH12 ARG A 71 17.181 38.389 27.370 1.00 0.00 H new ATOM 0 HH21 ARG A 71 16.961 38.999 30.802 1.00 0.00 H new ATOM 0 HH22 ARG A 71 16.295 39.349 29.204 1.00 0.00 H new ATOM 1110 N CYS A 72 20.392 31.568 27.663 1.00 0.00 N ATOM 1111 CA CYS A 72 20.018 30.123 27.760 1.00 0.00 C ATOM 1112 C CYS A 72 21.264 29.238 27.791 1.00 0.00 C ATOM 1113 O CYS A 72 21.200 28.054 28.119 1.00 0.00 O ATOM 1114 CB CYS A 72 19.243 29.830 26.475 1.00 0.00 C ATOM 1115 SG CYS A 72 17.562 30.470 26.597 1.00 0.00 S ATOM 0 H CYS A 72 20.531 31.907 26.711 1.00 0.00 H new ATOM 0 HA CYS A 72 19.446 29.923 28.666 1.00 0.00 H new ATOM 0 HB2 CYS A 72 19.751 30.284 25.624 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.218 28.755 26.295 1.00 0.00 H new ATOM 0 HG CYS A 72 17.423 31.480 25.791 1.00 0.00 H new ATOM 1120 N GLN A 73 22.385 29.777 27.413 1.00 0.00 N ATOM 1121 CA GLN A 73 23.633 28.969 27.370 1.00 0.00 C ATOM 1122 C GLN A 73 24.302 28.862 28.754 1.00 0.00 C ATOM 1123 O GLN A 73 24.701 27.769 29.153 1.00 0.00 O ATOM 1124 CB GLN A 73 24.512 29.708 26.352 1.00 0.00 C ATOM 1125 CG GLN A 73 25.955 29.198 26.417 1.00 0.00 C ATOM 1126 CD GLN A 73 25.996 27.715 26.038 1.00 0.00 C ATOM 1127 OE1 GLN A 73 25.144 27.236 25.296 1.00 0.00 O ATOM 1128 NE2 GLN A 73 26.950 26.962 26.513 1.00 0.00 N ATOM 0 H GLN A 73 22.492 30.751 27.129 1.00 0.00 H new ATOM 0 HA GLN A 73 23.451 27.933 27.084 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.114 29.564 25.347 1.00 0.00 H new ATOM 0 HB3 GLN A 73 24.489 30.779 26.553 1.00 0.00 H new ATOM 0 HG2 GLN A 73 26.585 29.774 25.739 1.00 0.00 H new ATOM 0 HG3 GLN A 73 26.355 29.338 27.421 1.00 0.00 H new ATOM 0 HE21 GLN A 73 27.657 27.363 27.130 1.00 0.00 H new ATOM 0 HE22 GLN A 73 26.989 25.973 26.268 1.00 0.00 H new ATOM 1137 N PRO A 74 24.426 29.965 29.454 1.00 0.00 N ATOM 1138 CA PRO A 74 25.071 29.925 30.790 1.00 0.00 C ATOM 1139 C PRO A 74 24.143 29.301 31.840 1.00 0.00 C ATOM 1140 O PRO A 74 24.591 28.560 32.713 1.00 0.00 O ATOM 1141 CB PRO A 74 25.339 31.390 31.109 1.00 0.00 C ATOM 1142 CG PRO A 74 24.336 32.153 30.309 1.00 0.00 C ATOM 1143 CD PRO A 74 23.999 31.325 29.093 1.00 0.00 C ATOM 0 HA PRO A 74 25.975 29.316 30.797 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.226 31.588 32.175 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.356 31.673 30.838 1.00 0.00 H new ATOM 0 HG2 PRO A 74 23.441 32.347 30.901 1.00 0.00 H new ATOM 0 HG3 PRO A 74 24.739 33.122 30.013 1.00 0.00 H new ATOM 0 HD2 PRO A 74 22.933 31.362 28.869 1.00 0.00 H new ATOM 0 HD3 PRO A 74 24.523 31.685 28.208 1.00 0.00 H new ATOM 1151 N ASP A 75 22.866 29.584 31.786 1.00 0.00 N ATOM 1152 CA ASP A 75 21.939 28.997 32.800 1.00 0.00 C ATOM 1153 C ASP A 75 21.699 27.515 32.479 1.00 0.00 C ATOM 1154 O ASP A 75 22.221 26.987 31.500 1.00 0.00 O ATOM 1155 CB ASP A 75 20.643 29.820 32.709 1.00 0.00 C ATOM 1156 CG ASP A 75 19.626 29.137 31.791 1.00 0.00 C ATOM 1157 OD1 ASP A 75 19.047 28.152 32.220 1.00 0.00 O ATOM 1158 OD2 ASP A 75 19.438 29.609 30.685 1.00 0.00 O ATOM 0 H ASP A 75 22.429 30.190 31.091 1.00 0.00 H new ATOM 0 HA ASP A 75 22.343 29.037 33.811 1.00 0.00 H new ATOM 0 HB2 ASP A 75 20.215 29.944 33.704 1.00 0.00 H new ATOM 0 HB3 ASP A 75 20.867 30.818 32.332 1.00 0.00 H new ATOM 1163 N LYS A 76 20.938 26.832 33.291 1.00 0.00 N ATOM 1164 CA LYS A 76 20.691 25.384 33.032 1.00 0.00 C ATOM 1165 C LYS A 76 19.221 25.111 32.693 1.00 0.00 C ATOM 1166 O LYS A 76 18.304 25.678 33.281 1.00 0.00 O ATOM 1167 CB LYS A 76 21.077 24.685 34.333 1.00 0.00 C ATOM 1168 CG LYS A 76 22.558 24.303 34.285 1.00 0.00 C ATOM 1169 CD LYS A 76 23.417 25.554 34.484 1.00 0.00 C ATOM 1170 CE LYS A 76 24.611 25.215 35.381 1.00 0.00 C ATOM 1171 NZ LYS A 76 24.772 26.396 36.273 1.00 0.00 N ATOM 0 H LYS A 76 20.479 27.212 34.119 1.00 0.00 H new ATOM 0 HA LYS A 76 21.265 25.028 32.177 1.00 0.00 H new ATOM 0 HB2 LYS A 76 20.887 25.342 35.182 1.00 0.00 H new ATOM 0 HB3 LYS A 76 20.465 23.794 34.476 1.00 0.00 H new ATOM 0 HG2 LYS A 76 22.780 23.570 35.060 1.00 0.00 H new ATOM 0 HG3 LYS A 76 22.793 23.837 33.328 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.766 25.926 33.521 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.823 26.348 34.936 1.00 0.00 H new ATOM 0 HE2 LYS A 76 24.427 24.308 35.957 1.00 0.00 H new ATOM 0 HE3 LYS A 76 25.511 25.041 34.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 25.573 26.238 36.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 24.953 27.243 35.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 23.903 26.533 36.828 1.00 0.00 H new ATOM 1185 N ALA A 77 18.996 24.236 31.750 1.00 0.00 N ATOM 1186 CA ALA A 77 17.607 23.870 31.338 1.00 0.00 C ATOM 1187 C ALA A 77 17.084 22.757 32.270 1.00 0.00 C ATOM 1188 O ALA A 77 16.921 22.981 33.459 1.00 0.00 O ATOM 1189 CB ALA A 77 17.802 23.394 29.902 1.00 0.00 C ATOM 0 H ALA A 77 19.731 23.749 31.237 1.00 0.00 H new ATOM 0 HA ALA A 77 16.874 24.674 31.401 1.00 0.00 H new ATOM 0 HB1 ALA A 77 16.841 23.094 29.484 1.00 0.00 H new ATOM 0 HB2 ALA A 77 18.221 24.204 29.304 1.00 0.00 H new ATOM 0 HB3 ALA A 77 18.484 22.544 29.890 1.00 0.00 H new ATOM 1195 N ASN A 78 16.878 21.539 31.804 1.00 0.00 N ATOM 1196 CA ASN A 78 16.457 20.475 32.767 1.00 0.00 C ATOM 1197 C ASN A 78 17.548 20.329 33.817 1.00 0.00 C ATOM 1198 O ASN A 78 17.259 20.047 34.978 1.00 0.00 O ATOM 1199 CB ASN A 78 16.280 19.153 32.003 1.00 0.00 C ATOM 1200 CG ASN A 78 14.919 19.108 31.297 1.00 0.00 C ATOM 1201 OD1 ASN A 78 13.876 19.674 31.853 1.00 0.00 O flip ATOM 1202 ND2 ASN A 78 14.799 18.539 30.214 1.00 0.00 N flip ATOM 0 H ASN A 78 16.980 21.248 30.832 1.00 0.00 H new ATOM 0 HA ASN A 78 15.514 20.736 33.248 1.00 0.00 H new ATOM 0 HB2 ASN A 78 17.079 19.042 31.270 1.00 0.00 H new ATOM 0 HB3 ASN A 78 16.364 18.315 32.694 1.00 0.00 H new ATOM 0 HD21 ASN A 78 15.608 18.097 29.778 1.00 0.00 H new ATOM 0 HD22 ASN A 78 13.890 18.509 29.752 1.00 0.00 H new ATOM 1209 N PRO A 79 18.774 20.590 33.415 1.00 0.00 N ATOM 1210 CA PRO A 79 19.895 20.554 34.388 1.00 0.00 C ATOM 1211 C PRO A 79 19.611 21.611 35.475 1.00 0.00 C ATOM 1212 O PRO A 79 20.180 21.579 36.565 1.00 0.00 O ATOM 1213 CB PRO A 79 21.097 20.905 33.496 1.00 0.00 C ATOM 1214 CG PRO A 79 20.498 21.679 32.391 1.00 0.00 C ATOM 1215 CD PRO A 79 19.255 20.932 32.071 1.00 0.00 C ATOM 0 HA PRO A 79 20.052 19.615 34.919 1.00 0.00 H new ATOM 0 HB2 PRO A 79 21.840 21.490 34.038 1.00 0.00 H new ATOM 0 HB3 PRO A 79 21.600 20.009 33.131 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.283 22.705 32.691 1.00 0.00 H new ATOM 0 HG3 PRO A 79 21.166 21.732 31.531 1.00 0.00 H new ATOM 0 HD2 PRO A 79 18.539 21.542 31.520 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.451 20.047 31.466 1.00 0.00 H new ATOM 1223 N ARG A 80 18.706 22.537 35.190 1.00 0.00 N ATOM 1224 CA ARG A 80 18.342 23.577 36.183 1.00 0.00 C ATOM 1225 C ARG A 80 17.977 22.897 37.509 1.00 0.00 C ATOM 1226 O ARG A 80 18.642 23.077 38.529 1.00 0.00 O ATOM 1227 CB ARG A 80 17.117 24.305 35.629 1.00 0.00 C ATOM 1228 CG ARG A 80 16.982 25.671 36.305 1.00 0.00 C ATOM 1229 CD ARG A 80 15.559 26.200 36.108 1.00 0.00 C ATOM 1230 NE ARG A 80 15.421 26.409 34.636 1.00 0.00 N ATOM 1231 CZ ARG A 80 14.391 27.055 34.147 1.00 0.00 C ATOM 1232 NH1 ARG A 80 13.463 27.530 34.938 1.00 0.00 N ATOM 1233 NH2 ARG A 80 14.289 27.228 32.857 1.00 0.00 N ATOM 0 H ARG A 80 18.210 22.603 34.301 1.00 0.00 H new ATOM 0 HA ARG A 80 19.165 24.270 36.357 1.00 0.00 H new ATOM 0 HB2 ARG A 80 17.213 24.430 34.550 1.00 0.00 H new ATOM 0 HB3 ARG A 80 16.219 23.712 35.803 1.00 0.00 H new ATOM 0 HG2 ARG A 80 17.206 25.586 37.368 1.00 0.00 H new ATOM 0 HG3 ARG A 80 17.703 26.371 35.882 1.00 0.00 H new ATOM 0 HD2 ARG A 80 14.820 25.489 36.476 1.00 0.00 H new ATOM 0 HD3 ARG A 80 15.405 27.131 36.654 1.00 0.00 H new ATOM 0 HE ARG A 80 16.135 26.045 34.005 1.00 0.00 H new ATOM 0 HH11 ARG A 80 13.537 27.399 35.947 1.00 0.00 H new ATOM 0 HH12 ARG A 80 12.666 28.031 34.546 1.00 0.00 H new ATOM 0 HH21 ARG A 80 15.009 26.861 32.235 1.00 0.00 H new ATOM 0 HH22 ARG A 80 13.489 27.730 32.471 1.00 0.00 H new ATOM 1247 N GLN A 81 16.933 22.107 37.506 1.00 0.00 N ATOM 1248 CA GLN A 81 16.497 21.387 38.747 1.00 0.00 C ATOM 1249 C GLN A 81 17.673 20.631 39.408 1.00 0.00 C ATOM 1250 O GLN A 81 17.745 20.513 40.632 1.00 0.00 O ATOM 1251 CB GLN A 81 15.428 20.398 38.277 1.00 0.00 C ATOM 1252 CG GLN A 81 14.182 21.167 37.824 1.00 0.00 C ATOM 1253 CD GLN A 81 12.923 20.451 38.319 1.00 0.00 C ATOM 1254 OE1 GLN A 81 12.993 19.329 38.816 1.00 0.00 O ATOM 1255 NE2 GLN A 81 11.765 21.043 38.208 1.00 0.00 N ATOM 0 H GLN A 81 16.355 21.926 36.686 1.00 0.00 H new ATOM 0 HA GLN A 81 16.123 22.083 39.498 1.00 0.00 H new ATOM 0 HB2 GLN A 81 15.813 19.793 37.456 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.171 19.713 39.085 1.00 0.00 H new ATOM 0 HG2 GLN A 81 14.210 22.185 38.214 1.00 0.00 H new ATOM 0 HG3 GLN A 81 14.165 21.242 36.737 1.00 0.00 H new ATOM 0 HE21 GLN A 81 11.706 21.974 37.796 1.00 0.00 H new ATOM 0 HE22 GLN A 81 10.919 20.575 38.534 1.00 0.00 H new ATOM 1264 N HIS A 82 18.586 20.109 38.620 1.00 0.00 N ATOM 1265 CA HIS A 82 19.741 19.351 39.199 1.00 0.00 C ATOM 1266 C HIS A 82 20.663 20.330 39.949 1.00 0.00 C ATOM 1267 O HIS A 82 21.119 20.059 41.065 1.00 0.00 O ATOM 1268 CB HIS A 82 20.466 18.744 37.996 1.00 0.00 C ATOM 1269 CG HIS A 82 19.912 17.374 37.713 1.00 0.00 C ATOM 1270 ND1 HIS A 82 18.598 17.036 37.991 1.00 0.00 N ATOM 1271 CD2 HIS A 82 20.485 16.248 37.175 1.00 0.00 C ATOM 1272 CE1 HIS A 82 18.423 15.753 37.622 1.00 0.00 C ATOM 1273 NE2 HIS A 82 19.542 15.226 37.119 1.00 0.00 N ATOM 0 H HIS A 82 18.580 20.176 37.602 1.00 0.00 H new ATOM 0 HA HIS A 82 19.430 18.582 39.906 1.00 0.00 H new ATOM 0 HB2 HIS A 82 20.343 19.385 37.123 1.00 0.00 H new ATOM 0 HB3 HIS A 82 21.535 18.681 38.197 1.00 0.00 H new ATOM 0 HD2 HIS A 82 21.510 16.168 36.846 1.00 0.00 H new ATOM 0 HE1 HIS A 82 17.491 15.216 37.721 1.00 0.00 H new ATOM 0 HE2 HIS A 82 19.677 14.278 36.769 1.00 0.00 H new ATOM 1281 N ARG A 83 20.909 21.480 39.381 1.00 0.00 N ATOM 1282 CA ARG A 83 21.758 22.490 40.078 1.00 0.00 C ATOM 1283 C ARG A 83 21.006 23.004 41.310 1.00 0.00 C ATOM 1284 O ARG A 83 21.607 23.466 42.291 1.00 0.00 O ATOM 1285 CB ARG A 83 21.971 23.616 39.064 1.00 0.00 C ATOM 1286 CG ARG A 83 22.850 24.708 39.683 1.00 0.00 C ATOM 1287 CD ARG A 83 24.218 24.720 38.995 1.00 0.00 C ATOM 1288 NE ARG A 83 24.938 23.533 39.542 1.00 0.00 N ATOM 1289 CZ ARG A 83 26.232 23.404 39.381 1.00 0.00 C ATOM 1290 NH1 ARG A 83 26.920 24.312 38.740 1.00 0.00 N ATOM 1291 NH2 ARG A 83 26.841 22.357 39.868 1.00 0.00 N ATOM 0 H ARG A 83 20.559 21.764 38.466 1.00 0.00 H new ATOM 0 HA ARG A 83 22.711 22.082 40.415 1.00 0.00 H new ATOM 0 HB2 ARG A 83 22.443 23.223 38.163 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.011 24.035 38.764 1.00 0.00 H new ATOM 0 HG2 ARG A 83 22.369 25.680 39.575 1.00 0.00 H new ATOM 0 HG3 ARG A 83 22.971 24.529 40.751 1.00 0.00 H new ATOM 0 HD2 ARG A 83 24.115 24.654 37.912 1.00 0.00 H new ATOM 0 HD3 ARG A 83 24.759 25.642 39.208 1.00 0.00 H new ATOM 0 HE ARG A 83 24.418 22.815 40.046 1.00 0.00 H new ATOM 0 HH11 ARG A 83 26.450 25.133 38.358 1.00 0.00 H new ATOM 0 HH12 ARG A 83 27.927 24.200 38.622 1.00 0.00 H new ATOM 0 HH21 ARG A 83 26.310 21.646 40.370 1.00 0.00 H new ATOM 0 HH22 ARG A 83 27.848 22.250 39.746 1.00 0.00 H new ATOM 1305 N LEU A 84 19.698 22.903 41.302 1.00 0.00 N ATOM 1306 CA LEU A 84 18.940 23.362 42.475 1.00 0.00 C ATOM 1307 C LEU A 84 19.066 22.287 43.554 1.00 0.00 C ATOM 1308 O LEU A 84 19.122 22.581 44.751 1.00 0.00 O ATOM 1309 CB LEU A 84 17.487 23.522 42.032 1.00 0.00 C ATOM 1310 CG LEU A 84 16.837 24.806 42.616 1.00 0.00 C ATOM 1311 CD1 LEU A 84 17.781 25.588 43.571 1.00 0.00 C ATOM 1312 CD2 LEU A 84 16.438 25.715 41.453 1.00 0.00 C ATOM 0 H LEU A 84 19.141 22.525 40.536 1.00 0.00 H new ATOM 0 HA LEU A 84 19.307 24.309 42.872 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.442 23.556 40.943 1.00 0.00 H new ATOM 0 HB3 LEU A 84 16.914 22.650 42.348 1.00 0.00 H new ATOM 0 HG LEU A 84 15.973 24.500 43.206 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.268 26.474 43.945 1.00 0.00 H new ATOM 0 HD12 LEU A 84 18.061 24.950 44.409 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.678 25.890 43.030 1.00 0.00 H new ATOM 0 HD21 LEU A 84 15.979 26.624 41.842 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.324 25.975 40.874 1.00 0.00 H new ATOM 0 HD23 LEU A 84 15.726 25.195 40.812 1.00 0.00 H new ATOM 1324 N ASP A 85 19.185 21.043 43.153 1.00 0.00 N ATOM 1325 CA ASP A 85 19.385 19.962 44.158 1.00 0.00 C ATOM 1326 C ASP A 85 20.719 20.219 44.867 1.00 0.00 C ATOM 1327 O ASP A 85 20.861 20.049 46.086 1.00 0.00 O ATOM 1328 CB ASP A 85 19.454 18.674 43.348 1.00 0.00 C ATOM 1329 CG ASP A 85 18.052 18.081 43.202 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.635 17.366 44.098 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.418 18.355 42.197 1.00 0.00 O ATOM 0 H ASP A 85 19.152 20.736 42.181 1.00 0.00 H new ATOM 0 HA ASP A 85 18.596 19.914 44.909 1.00 0.00 H new ATOM 0 HB2 ASP A 85 19.879 18.874 42.364 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.113 17.958 43.840 1.00 0.00 H new ATOM 1336 N LYS A 86 21.689 20.677 44.121 1.00 0.00 N ATOM 1337 CA LYS A 86 23.020 21.003 44.727 1.00 0.00 C ATOM 1338 C LYS A 86 22.843 22.068 45.827 1.00 0.00 C ATOM 1339 O LYS A 86 23.330 21.922 46.953 1.00 0.00 O ATOM 1340 CB LYS A 86 23.858 21.557 43.573 1.00 0.00 C ATOM 1341 CG LYS A 86 25.336 21.576 43.975 1.00 0.00 C ATOM 1342 CD LYS A 86 26.101 20.520 43.171 1.00 0.00 C ATOM 1343 CE LYS A 86 27.194 19.902 44.047 1.00 0.00 C ATOM 1344 NZ LYS A 86 28.380 19.778 43.154 1.00 0.00 N ATOM 0 H LYS A 86 21.620 20.841 43.117 1.00 0.00 H new ATOM 0 HA LYS A 86 23.493 20.136 45.189 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.721 20.943 42.683 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.526 22.564 43.320 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.760 22.564 43.793 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.436 21.378 45.042 1.00 0.00 H new ATOM 0 HD2 LYS A 86 25.417 19.745 42.825 1.00 0.00 H new ATOM 0 HD3 LYS A 86 26.544 20.973 42.284 1.00 0.00 H new ATOM 0 HE2 LYS A 86 27.413 20.533 44.909 1.00 0.00 H new ATOM 0 HE3 LYS A 86 26.888 18.930 44.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 29.172 19.361 43.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 28.144 19.167 42.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 28.653 20.720 42.807 1.00 0.00 H new ATOM 1358 N ILE A 87 22.144 23.130 45.527 1.00 0.00 N ATOM 1359 CA ILE A 87 21.910 24.211 46.546 1.00 0.00 C ATOM 1360 C ILE A 87 21.259 23.621 47.826 1.00 0.00 C ATOM 1361 O ILE A 87 21.670 23.914 48.946 1.00 0.00 O ATOM 1362 CB ILE A 87 20.983 25.197 45.838 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.632 25.687 44.534 1.00 0.00 C ATOM 1364 CG2 ILE A 87 20.755 26.388 46.745 1.00 0.00 C ATOM 1365 CD1 ILE A 87 22.712 26.720 44.858 1.00 0.00 C ATOM 0 H ILE A 87 21.720 23.302 44.615 1.00 0.00 H new ATOM 0 HA ILE A 87 22.830 24.690 46.881 1.00 0.00 H new ATOM 0 HB ILE A 87 20.039 24.703 45.608 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.068 24.846 43.994 1.00 0.00 H new ATOM 0 HG13 ILE A 87 20.877 26.127 43.883 1.00 0.00 H new ATOM 0 HG21 ILE A 87 20.094 27.100 46.251 1.00 0.00 H new ATOM 0 HG22 ILE A 87 20.297 26.054 47.676 1.00 0.00 H new ATOM 0 HG23 ILE A 87 21.709 26.868 46.962 1.00 0.00 H new ATOM 0 HD11 ILE A 87 23.172 27.067 43.933 1.00 0.00 H new ATOM 0 HD12 ILE A 87 22.262 27.565 45.379 1.00 0.00 H new ATOM 0 HD13 ILE A 87 23.472 26.265 45.493 1.00 0.00 H new ATOM 1377 N THR A 88 20.280 22.762 47.684 1.00 0.00 N ATOM 1378 CA THR A 88 19.663 22.123 48.890 1.00 0.00 C ATOM 1379 C THR A 88 20.799 21.543 49.745 1.00 0.00 C ATOM 1380 O THR A 88 20.879 21.755 50.957 1.00 0.00 O ATOM 1381 CB THR A 88 18.768 21.007 48.348 1.00 0.00 C ATOM 1382 OG1 THR A 88 17.930 21.528 47.326 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.907 20.443 49.480 1.00 0.00 C ATOM 0 H THR A 88 19.882 22.476 46.790 1.00 0.00 H new ATOM 0 HA THR A 88 19.086 22.816 49.503 1.00 0.00 H new ATOM 0 HB THR A 88 19.389 20.211 47.938 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.357 20.814 46.977 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.270 19.648 49.091 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.552 20.042 50.262 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.285 21.237 49.894 1.00 0.00 H new ATOM 1391 N HIS A 89 21.723 20.859 49.111 1.00 0.00 N ATOM 1392 CA HIS A 89 22.898 20.323 49.863 1.00 0.00 C ATOM 1393 C HIS A 89 23.561 21.502 50.591 1.00 0.00 C ATOM 1394 O HIS A 89 23.978 21.394 51.743 1.00 0.00 O ATOM 1395 CB HIS A 89 23.830 19.737 48.800 1.00 0.00 C ATOM 1396 CG HIS A 89 24.720 18.703 49.432 1.00 0.00 C ATOM 1397 ND1 HIS A 89 24.826 17.415 48.932 1.00 0.00 N ATOM 1398 CD2 HIS A 89 25.552 18.753 50.522 1.00 0.00 C ATOM 1399 CE1 HIS A 89 25.694 16.747 49.714 1.00 0.00 C ATOM 1400 NE2 HIS A 89 26.166 17.516 50.699 1.00 0.00 N ATOM 0 H HIS A 89 21.713 20.651 48.112 1.00 0.00 H new ATOM 0 HA HIS A 89 22.638 19.565 50.602 1.00 0.00 H new ATOM 0 HB2 HIS A 89 23.246 19.288 47.996 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.433 20.528 48.353 1.00 0.00 H new ATOM 0 HD2 HIS A 89 25.707 19.620 51.147 1.00 0.00 H new ATOM 0 HE1 HIS A 89 25.975 15.715 49.564 1.00 0.00 H new ATOM 0 HE2 HIS A 89 26.833 17.253 51.425 1.00 0.00 H new ATOM 1408 N ALA A 90 23.611 22.650 49.944 1.00 0.00 N ATOM 1409 CA ALA A 90 24.184 23.866 50.599 1.00 0.00 C ATOM 1410 C ALA A 90 23.435 24.075 51.904 1.00 0.00 C ATOM 1411 O ALA A 90 24.012 24.466 52.913 1.00 0.00 O ATOM 1412 CB ALA A 90 23.920 25.053 49.641 1.00 0.00 C ATOM 0 H ALA A 90 23.278 22.791 48.990 1.00 0.00 H new ATOM 0 HA ALA A 90 25.251 23.773 50.801 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.321 25.968 50.076 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.406 24.863 48.684 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.847 25.165 49.487 1.00 0.00 H new ATOM 1418 N CYS A 91 22.153 23.786 51.916 1.00 0.00 N ATOM 1419 CA CYS A 91 21.403 23.952 53.190 1.00 0.00 C ATOM 1420 C CYS A 91 21.999 23.007 54.224 1.00 0.00 C ATOM 1421 O CYS A 91 22.290 23.396 55.354 1.00 0.00 O ATOM 1422 CB CYS A 91 19.938 23.574 52.939 1.00 0.00 C ATOM 1423 SG CYS A 91 19.091 23.466 54.547 1.00 0.00 S ATOM 0 H CYS A 91 21.611 23.452 51.119 1.00 0.00 H new ATOM 0 HA CYS A 91 21.466 24.980 53.548 1.00 0.00 H new ATOM 0 HB2 CYS A 91 19.457 24.319 52.306 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.877 22.621 52.413 1.00 0.00 H new ATOM 0 HG CYS A 91 18.591 24.626 54.853 1.00 0.00 H new ATOM 1429 N ARG A 92 22.194 21.771 53.855 1.00 0.00 N ATOM 1430 CA ARG A 92 22.787 20.794 54.814 1.00 0.00 C ATOM 1431 C ARG A 92 24.066 21.377 55.427 1.00 0.00 C ATOM 1432 O ARG A 92 24.215 21.438 56.640 1.00 0.00 O ATOM 1433 CB ARG A 92 23.110 19.555 53.978 1.00 0.00 C ATOM 1434 CG ARG A 92 23.608 18.437 54.894 1.00 0.00 C ATOM 1435 CD ARG A 92 24.410 17.420 54.074 1.00 0.00 C ATOM 1436 NE ARG A 92 23.681 16.128 54.233 1.00 0.00 N ATOM 1437 CZ ARG A 92 23.996 15.090 53.498 1.00 0.00 C ATOM 1438 NH1 ARG A 92 24.956 15.164 52.611 1.00 0.00 N ATOM 1439 NH2 ARG A 92 23.348 13.968 53.653 1.00 0.00 N ATOM 0 H ARG A 92 21.969 21.395 52.934 1.00 0.00 H new ATOM 0 HA ARG A 92 22.112 20.560 55.637 1.00 0.00 H new ATOM 0 HB2 ARG A 92 22.223 19.227 53.436 1.00 0.00 H new ATOM 0 HB3 ARG A 92 23.869 19.794 53.233 1.00 0.00 H new ATOM 0 HG2 ARG A 92 24.231 18.852 55.686 1.00 0.00 H new ATOM 0 HG3 ARG A 92 22.764 17.945 55.377 1.00 0.00 H new ATOM 0 HD2 ARG A 92 24.465 17.715 53.026 1.00 0.00 H new ATOM 0 HD3 ARG A 92 25.435 17.341 54.437 1.00 0.00 H new ATOM 0 HE ARG A 92 22.931 16.052 54.920 1.00 0.00 H new ATOM 0 HH11 ARG A 92 25.469 16.037 52.486 1.00 0.00 H new ATOM 0 HH12 ARG A 92 25.191 14.349 52.045 1.00 0.00 H new ATOM 0 HH21 ARG A 92 22.600 13.902 54.344 1.00 0.00 H new ATOM 0 HH22 ARG A 92 23.589 13.157 53.083 1.00 0.00 H new ATOM 1453 N LEU A 93 24.985 21.809 54.607 1.00 0.00 N ATOM 1454 CA LEU A 93 26.261 22.395 55.129 1.00 0.00 C ATOM 1455 C LEU A 93 25.987 23.573 56.079 1.00 0.00 C ATOM 1456 O LEU A 93 26.658 23.726 57.113 1.00 0.00 O ATOM 1457 CB LEU A 93 27.003 22.881 53.882 1.00 0.00 C ATOM 1458 CG LEU A 93 28.505 22.642 54.046 1.00 0.00 C ATOM 1459 CD1 LEU A 93 28.786 21.137 54.078 1.00 0.00 C ATOM 1460 CD2 LEU A 93 29.251 23.275 52.868 1.00 0.00 C ATOM 0 H LEU A 93 24.910 21.783 53.590 1.00 0.00 H new ATOM 0 HA LEU A 93 26.834 21.667 55.703 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.636 22.355 53.001 1.00 0.00 H new ATOM 0 HB3 LEU A 93 26.810 23.942 53.723 1.00 0.00 H new ATOM 0 HG LEU A 93 28.844 23.092 54.979 1.00 0.00 H new ATOM 0 HD11 LEU A 93 29.857 20.969 54.195 1.00 0.00 H new ATOM 0 HD12 LEU A 93 28.254 20.685 54.916 1.00 0.00 H new ATOM 0 HD13 LEU A 93 28.447 20.684 53.146 1.00 0.00 H new ATOM 0 HD21 LEU A 93 30.322 23.106 52.982 1.00 0.00 H new ATOM 0 HD22 LEU A 93 28.910 22.823 51.936 1.00 0.00 H new ATOM 0 HD23 LEU A 93 29.053 24.347 52.846 1.00 0.00 H new ATOM 1472 N LEU A 94 25.013 24.398 55.749 1.00 0.00 N ATOM 1473 CA LEU A 94 24.679 25.596 56.596 1.00 0.00 C ATOM 1474 C LEU A 94 24.056 25.146 57.935 1.00 0.00 C ATOM 1475 O LEU A 94 23.885 25.934 58.862 1.00 0.00 O ATOM 1476 CB LEU A 94 23.635 26.377 55.754 1.00 0.00 C ATOM 1477 CG LEU A 94 24.310 27.475 54.911 1.00 0.00 C ATOM 1478 CD1 LEU A 94 24.613 26.943 53.505 1.00 0.00 C ATOM 1479 CD2 LEU A 94 23.365 28.680 54.781 1.00 0.00 C ATOM 0 H LEU A 94 24.429 24.290 54.919 1.00 0.00 H new ATOM 0 HA LEU A 94 25.556 26.196 56.840 1.00 0.00 H new ATOM 0 HB2 LEU A 94 23.103 25.687 55.099 1.00 0.00 H new ATOM 0 HB3 LEU A 94 22.893 26.826 56.415 1.00 0.00 H new ATOM 0 HG LEU A 94 25.236 27.773 55.402 1.00 0.00 H new ATOM 0 HD11 LEU A 94 25.090 27.725 52.915 1.00 0.00 H new ATOM 0 HD12 LEU A 94 25.281 26.084 53.577 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.684 26.640 53.022 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.845 29.456 54.184 1.00 0.00 H new ATOM 0 HD22 LEU A 94 22.441 28.367 54.295 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.138 29.073 55.772 1.00 0.00 H new ATOM 1491 N GLU A 95 23.732 23.886 58.036 1.00 0.00 N ATOM 1492 CA GLU A 95 23.138 23.344 59.290 1.00 0.00 C ATOM 1493 C GLU A 95 23.910 22.087 59.714 1.00 0.00 C ATOM 1494 O GLU A 95 23.666 21.515 60.775 1.00 0.00 O ATOM 1495 CB GLU A 95 21.689 22.999 58.917 1.00 0.00 C ATOM 1496 CG GLU A 95 21.063 22.091 59.985 1.00 0.00 C ATOM 1497 CD GLU A 95 21.037 22.817 61.332 1.00 0.00 C ATOM 1498 OE1 GLU A 95 22.098 23.188 61.806 1.00 0.00 O ATOM 1499 OE2 GLU A 95 19.955 22.987 61.868 1.00 0.00 O ATOM 0 H GLU A 95 23.856 23.200 57.292 1.00 0.00 H new ATOM 0 HA GLU A 95 23.181 24.045 60.124 1.00 0.00 H new ATOM 0 HB2 GLU A 95 21.104 23.914 58.820 1.00 0.00 H new ATOM 0 HB3 GLU A 95 21.665 22.501 57.948 1.00 0.00 H new ATOM 0 HG2 GLU A 95 20.051 21.813 59.692 1.00 0.00 H new ATOM 0 HG3 GLU A 95 21.635 21.167 60.070 1.00 0.00 H new ATOM 1506 N GLN A 96 24.843 21.651 58.906 1.00 0.00 N ATOM 1507 CA GLN A 96 25.629 20.442 59.254 1.00 0.00 C ATOM 1508 C GLN A 96 26.782 20.825 60.175 1.00 0.00 C ATOM 1509 O GLN A 96 26.926 20.274 61.265 1.00 0.00 O ATOM 1510 CB GLN A 96 26.161 19.904 57.924 1.00 0.00 C ATOM 1511 CG GLN A 96 27.006 18.652 58.180 1.00 0.00 C ATOM 1512 CD GLN A 96 27.165 17.865 56.877 1.00 0.00 C ATOM 1513 OE1 GLN A 96 27.823 18.396 55.883 1.00 0.00 O flip ATOM 1514 NE2 GLN A 96 26.682 16.741 56.762 1.00 0.00 N flip ATOM 0 H GLN A 96 25.091 22.087 58.018 1.00 0.00 H new ATOM 0 HA GLN A 96 25.030 19.696 59.776 1.00 0.00 H new ATOM 0 HB2 GLN A 96 25.332 19.666 57.258 1.00 0.00 H new ATOM 0 HB3 GLN A 96 26.761 20.665 57.426 1.00 0.00 H new ATOM 0 HG2 GLN A 96 27.985 18.935 58.568 1.00 0.00 H new ATOM 0 HG3 GLN A 96 26.531 18.029 58.937 1.00 0.00 H new ATOM 0 HE21 GLN A 96 26.168 16.325 57.538 1.00 0.00 H new ATOM 0 HE22 GLN A 96 26.796 16.224 55.890 1.00 0.00 H new ATOM 1523 N GLU A 97 27.609 21.760 59.774 1.00 0.00 N ATOM 1524 CA GLU A 97 28.738 22.144 60.677 1.00 0.00 C ATOM 1525 C GLU A 97 28.282 23.234 61.651 1.00 0.00 C ATOM 1526 O GLU A 97 27.093 23.382 61.925 1.00 0.00 O ATOM 1527 CB GLU A 97 29.846 22.654 59.750 1.00 0.00 C ATOM 1528 CG GLU A 97 29.344 23.858 58.947 1.00 0.00 C ATOM 1529 CD GLU A 97 29.337 23.517 57.453 1.00 0.00 C ATOM 1530 OE1 GLU A 97 29.165 22.353 57.132 1.00 0.00 O ATOM 1531 OE2 GLU A 97 29.501 24.426 56.658 1.00 0.00 O ATOM 0 H GLU A 97 27.555 22.261 58.887 1.00 0.00 H new ATOM 0 HA GLU A 97 29.087 21.309 61.284 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.721 22.936 60.336 1.00 0.00 H new ATOM 0 HB3 GLU A 97 30.159 21.860 59.073 1.00 0.00 H new ATOM 0 HG2 GLU A 97 28.340 24.131 59.272 1.00 0.00 H new ATOM 0 HG3 GLU A 97 29.984 24.721 59.130 1.00 0.00 H new ATOM 1538 N THR A 98 29.197 24.016 62.159 1.00 0.00 N ATOM 1539 CA THR A 98 28.805 25.112 63.091 1.00 0.00 C ATOM 1540 C THR A 98 28.901 26.456 62.344 1.00 0.00 C ATOM 1541 O THR A 98 27.879 27.082 62.073 1.00 0.00 O ATOM 1542 CB THR A 98 29.779 25.014 64.280 1.00 0.00 C ATOM 1543 OG1 THR A 98 29.340 23.980 65.150 1.00 0.00 O ATOM 1544 CG2 THR A 98 29.813 26.338 65.049 1.00 0.00 C ATOM 0 H THR A 98 30.197 23.943 61.969 1.00 0.00 H new ATOM 0 HA THR A 98 27.780 25.033 63.453 1.00 0.00 H new ATOM 0 HB THR A 98 30.780 24.796 63.907 1.00 0.00 H new ATOM 0 HG1 THR A 98 29.955 23.909 65.910 1.00 0.00 H new ATOM 0 HG21 THR A 98 30.505 26.255 65.887 1.00 0.00 H new ATOM 0 HG22 THR A 98 30.142 27.137 64.384 1.00 0.00 H new ATOM 0 HG23 THR A 98 28.815 26.567 65.424 1.00 0.00 H new ATOM 1552 N PRO A 99 30.092 26.786 61.893 1.00 0.00 N ATOM 1553 CA PRO A 99 30.288 27.986 61.036 1.00 0.00 C ATOM 1554 C PRO A 99 29.542 27.746 59.714 1.00 0.00 C ATOM 1555 O PRO A 99 29.479 26.620 59.235 1.00 0.00 O ATOM 1556 CB PRO A 99 31.800 28.060 60.837 1.00 0.00 C ATOM 1557 CG PRO A 99 32.273 26.666 61.060 1.00 0.00 C ATOM 1558 CD PRO A 99 31.370 26.088 62.115 1.00 0.00 C ATOM 0 HA PRO A 99 29.908 28.917 61.458 1.00 0.00 H new ATOM 0 HB2 PRO A 99 32.052 28.409 59.836 1.00 0.00 H new ATOM 0 HB3 PRO A 99 32.260 28.753 61.542 1.00 0.00 H new ATOM 0 HG2 PRO A 99 32.221 26.084 60.140 1.00 0.00 H new ATOM 0 HG3 PRO A 99 33.313 26.654 61.387 1.00 0.00 H new ATOM 0 HD2 PRO A 99 31.263 25.009 62.004 1.00 0.00 H new ATOM 0 HD3 PRO A 99 31.757 26.269 63.118 1.00 0.00 H new ATOM 1566 N VAL A 100 28.923 28.742 59.138 1.00 0.00 N ATOM 1567 CA VAL A 100 28.137 28.486 57.885 1.00 0.00 C ATOM 1568 C VAL A 100 29.087 28.335 56.691 1.00 0.00 C ATOM 1569 O VAL A 100 30.190 28.880 56.680 1.00 0.00 O ATOM 1570 CB VAL A 100 27.258 29.728 57.711 1.00 0.00 C ATOM 1571 CG1 VAL A 100 26.195 29.462 56.649 1.00 0.00 C ATOM 1572 CG2 VAL A 100 26.566 30.071 59.035 1.00 0.00 C ATOM 0 H VAL A 100 28.923 29.707 59.469 1.00 0.00 H new ATOM 0 HA VAL A 100 27.547 27.571 57.945 1.00 0.00 H new ATOM 0 HB VAL A 100 27.887 30.563 57.402 1.00 0.00 H new ATOM 0 HG11 VAL A 100 25.572 30.348 56.528 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.679 29.227 55.701 1.00 0.00 H new ATOM 0 HG13 VAL A 100 25.574 28.621 56.958 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.943 30.956 58.902 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.944 29.233 59.348 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.319 30.269 59.798 1.00 0.00 H new ATOM 1582 N THR A 101 28.705 27.541 55.714 1.00 0.00 N ATOM 1583 CA THR A 101 29.623 27.285 54.558 1.00 0.00 C ATOM 1584 C THR A 101 29.079 27.804 53.234 1.00 0.00 C ATOM 1585 O THR A 101 28.217 27.197 52.600 1.00 0.00 O ATOM 1586 CB THR A 101 29.725 25.778 54.439 1.00 0.00 C ATOM 1587 OG1 THR A 101 28.830 25.171 55.352 1.00 0.00 O ATOM 1588 CG2 THR A 101 31.157 25.333 54.746 1.00 0.00 C ATOM 0 H THR A 101 27.805 27.064 55.669 1.00 0.00 H new ATOM 0 HA THR A 101 30.570 27.792 54.743 1.00 0.00 H new ATOM 0 HB THR A 101 29.466 25.476 53.424 1.00 0.00 H new ATOM 0 HG1 THR A 101 29.338 24.734 56.067 1.00 0.00 H new ATOM 0 HG21 THR A 101 31.227 24.249 54.660 1.00 0.00 H new ATOM 0 HG22 THR A 101 31.842 25.799 54.038 1.00 0.00 H new ATOM 0 HG23 THR A 101 31.422 25.634 55.759 1.00 0.00 H new ATOM 1596 N LEU A 102 29.610 28.880 52.801 1.00 0.00 N ATOM 1597 CA LEU A 102 29.229 29.459 51.526 1.00 0.00 C ATOM 1598 C LEU A 102 30.521 29.764 50.770 1.00 0.00 C ATOM 1599 O LEU A 102 30.514 29.976 49.565 1.00 0.00 O ATOM 1600 CB LEU A 102 28.472 30.748 51.863 1.00 0.00 C ATOM 1601 CG LEU A 102 27.232 30.416 52.704 1.00 0.00 C ATOM 1602 CD1 LEU A 102 27.517 30.735 54.174 1.00 0.00 C ATOM 1603 CD2 LEU A 102 26.036 31.250 52.224 1.00 0.00 C ATOM 0 H LEU A 102 30.326 29.404 53.304 1.00 0.00 H new ATOM 0 HA LEU A 102 28.606 28.808 50.913 1.00 0.00 H new ATOM 0 HB2 LEU A 102 29.122 31.430 52.410 1.00 0.00 H new ATOM 0 HB3 LEU A 102 28.175 31.257 50.946 1.00 0.00 H new ATOM 0 HG LEU A 102 26.997 29.357 52.595 1.00 0.00 H new ATOM 0 HD11 LEU A 102 26.638 30.500 54.774 1.00 0.00 H new ATOM 0 HD12 LEU A 102 28.362 30.138 54.519 1.00 0.00 H new ATOM 0 HD13 LEU A 102 27.755 31.794 54.277 1.00 0.00 H new ATOM 0 HD21 LEU A 102 25.160 31.009 52.826 1.00 0.00 H new ATOM 0 HD22 LEU A 102 26.267 32.310 52.328 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.831 31.024 51.178 1.00 0.00 H new ATOM 1615 N GLU A 103 31.648 29.801 51.471 1.00 0.00 N ATOM 1616 CA GLU A 103 32.960 30.118 50.822 1.00 0.00 C ATOM 1617 C GLU A 103 33.119 29.461 49.445 1.00 0.00 C ATOM 1618 O GLU A 103 33.555 30.109 48.495 1.00 0.00 O ATOM 1619 CB GLU A 103 34.011 29.570 51.788 1.00 0.00 C ATOM 1620 CG GLU A 103 35.373 30.188 51.465 1.00 0.00 C ATOM 1621 CD GLU A 103 35.444 31.600 52.049 1.00 0.00 C ATOM 1622 OE1 GLU A 103 35.758 31.720 53.221 1.00 0.00 O ATOM 1623 OE2 GLU A 103 35.183 32.538 51.313 1.00 0.00 O ATOM 0 H GLU A 103 31.704 29.622 52.474 1.00 0.00 H new ATOM 0 HA GLU A 103 33.051 31.189 50.642 1.00 0.00 H new ATOM 0 HB2 GLU A 103 33.730 29.799 52.816 1.00 0.00 H new ATOM 0 HB3 GLU A 103 34.064 28.484 51.707 1.00 0.00 H new ATOM 0 HG2 GLU A 103 36.171 29.571 51.878 1.00 0.00 H new ATOM 0 HG3 GLU A 103 35.522 30.221 50.386 1.00 0.00 H new ATOM 1630 N ALA A 104 32.795 28.201 49.301 1.00 0.00 N ATOM 1631 CA ALA A 104 32.966 27.561 47.962 1.00 0.00 C ATOM 1632 C ALA A 104 31.937 28.153 47.001 1.00 0.00 C ATOM 1633 O ALA A 104 32.233 28.441 45.841 1.00 0.00 O ATOM 1634 CB ALA A 104 32.707 26.071 48.189 1.00 0.00 C ATOM 0 H ALA A 104 32.427 27.598 50.037 1.00 0.00 H new ATOM 0 HA ALA A 104 33.955 27.724 47.533 1.00 0.00 H new ATOM 0 HB1 ALA A 104 32.815 25.535 47.246 1.00 0.00 H new ATOM 0 HB2 ALA A 104 33.425 25.683 48.911 1.00 0.00 H new ATOM 0 HB3 ALA A 104 31.696 25.932 48.572 1.00 0.00 H new ATOM 1640 N LEU A 105 30.731 28.356 47.467 1.00 0.00 N ATOM 1641 CA LEU A 105 29.688 28.944 46.583 1.00 0.00 C ATOM 1642 C LEU A 105 30.025 30.408 46.287 1.00 0.00 C ATOM 1643 O LEU A 105 30.129 30.814 45.132 1.00 0.00 O ATOM 1644 CB LEU A 105 28.366 28.824 47.355 1.00 0.00 C ATOM 1645 CG LEU A 105 27.176 29.101 46.419 1.00 0.00 C ATOM 1646 CD1 LEU A 105 27.193 30.564 45.976 1.00 0.00 C ATOM 1647 CD2 LEU A 105 27.257 28.200 45.181 1.00 0.00 C ATOM 0 H LEU A 105 30.427 28.140 48.417 1.00 0.00 H new ATOM 0 HA LEU A 105 29.624 28.431 45.623 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.276 27.826 47.784 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.356 29.530 48.186 1.00 0.00 H new ATOM 0 HG LEU A 105 26.252 28.892 46.959 1.00 0.00 H new ATOM 0 HD11 LEU A 105 26.348 30.753 45.314 1.00 0.00 H new ATOM 0 HD12 LEU A 105 27.120 31.210 46.851 1.00 0.00 H new ATOM 0 HD13 LEU A 105 28.123 30.773 45.447 1.00 0.00 H new ATOM 0 HD21 LEU A 105 26.410 28.405 44.526 1.00 0.00 H new ATOM 0 HD22 LEU A 105 28.186 28.399 44.646 1.00 0.00 H new ATOM 0 HD23 LEU A 105 27.233 27.155 45.489 1.00 0.00 H new ATOM 1659 N ALA A 106 30.195 31.209 47.306 1.00 0.00 N ATOM 1660 CA ALA A 106 30.524 32.650 47.088 1.00 0.00 C ATOM 1661 C ALA A 106 31.705 32.798 46.117 1.00 0.00 C ATOM 1662 O ALA A 106 31.685 33.637 45.217 1.00 0.00 O ATOM 1663 CB ALA A 106 30.900 33.184 48.471 1.00 0.00 C ATOM 0 H ALA A 106 30.120 30.927 48.283 1.00 0.00 H new ATOM 0 HA ALA A 106 29.689 33.196 46.649 1.00 0.00 H new ATOM 0 HB1 ALA A 106 31.156 34.241 48.396 1.00 0.00 H new ATOM 0 HB2 ALA A 106 30.056 33.063 49.150 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.757 32.630 48.855 1.00 0.00 H new ATOM 1669 N ASP A 107 32.729 31.999 46.278 1.00 0.00 N ATOM 1670 CA ASP A 107 33.902 32.086 45.373 1.00 0.00 C ATOM 1671 C ASP A 107 33.509 31.672 43.949 1.00 0.00 C ATOM 1672 O ASP A 107 33.977 32.245 42.966 1.00 0.00 O ATOM 1673 CB ASP A 107 34.897 31.097 45.969 1.00 0.00 C ATOM 1674 CG ASP A 107 35.794 31.810 46.982 1.00 0.00 C ATOM 1675 OD1 ASP A 107 35.419 31.865 48.140 1.00 0.00 O ATOM 1676 OD2 ASP A 107 36.844 32.286 46.581 1.00 0.00 O ATOM 0 H ASP A 107 32.798 31.287 47.005 1.00 0.00 H new ATOM 0 HA ASP A 107 34.308 33.095 45.298 1.00 0.00 H new ATOM 0 HB2 ASP A 107 34.364 30.279 46.454 1.00 0.00 H new ATOM 0 HB3 ASP A 107 35.504 30.657 45.178 1.00 0.00 H new ATOM 1681 N GLN A 108 32.667 30.680 43.822 1.00 0.00 N ATOM 1682 CA GLN A 108 32.248 30.214 42.467 1.00 0.00 C ATOM 1683 C GLN A 108 31.456 31.300 41.725 1.00 0.00 C ATOM 1684 O GLN A 108 31.623 31.487 40.522 1.00 0.00 O ATOM 1685 CB GLN A 108 31.366 28.992 42.727 1.00 0.00 C ATOM 1686 CG GLN A 108 31.370 28.086 41.492 1.00 0.00 C ATOM 1687 CD GLN A 108 30.184 28.442 40.592 1.00 0.00 C ATOM 1688 OE1 GLN A 108 29.032 28.362 41.014 1.00 0.00 O ATOM 1689 NE2 GLN A 108 30.405 28.832 39.367 1.00 0.00 N ATOM 0 H GLN A 108 32.250 30.171 44.601 1.00 0.00 H new ATOM 0 HA GLN A 108 33.107 29.981 41.838 1.00 0.00 H new ATOM 0 HB2 GLN A 108 31.733 28.444 43.595 1.00 0.00 H new ATOM 0 HB3 GLN A 108 30.348 29.307 42.956 1.00 0.00 H new ATOM 0 HG2 GLN A 108 32.305 28.205 40.944 1.00 0.00 H new ATOM 0 HG3 GLN A 108 31.309 27.041 41.795 1.00 0.00 H new ATOM 0 HE21 GLN A 108 31.361 28.898 39.017 1.00 0.00 H new ATOM 0 HE22 GLN A 108 29.622 29.071 38.759 1.00 0.00 H new ATOM 1698 N VAL A 109 30.588 32.011 42.402 1.00 0.00 N ATOM 1699 CA VAL A 109 29.790 33.065 41.699 1.00 0.00 C ATOM 1700 C VAL A 109 30.427 34.450 41.862 1.00 0.00 C ATOM 1701 O VAL A 109 30.080 35.388 41.147 1.00 0.00 O ATOM 1702 CB VAL A 109 28.404 33.052 42.344 1.00 0.00 C ATOM 1703 CG1 VAL A 109 27.409 33.738 41.404 1.00 0.00 C ATOM 1704 CG2 VAL A 109 27.957 31.610 42.590 1.00 0.00 C ATOM 0 H VAL A 109 30.398 31.910 43.399 1.00 0.00 H new ATOM 0 HA VAL A 109 29.745 32.860 40.629 1.00 0.00 H new ATOM 0 HB VAL A 109 28.443 33.581 43.296 1.00 0.00 H new ATOM 0 HG11 VAL A 109 26.418 33.733 41.857 1.00 0.00 H new ATOM 0 HG12 VAL A 109 27.723 34.767 41.230 1.00 0.00 H new ATOM 0 HG13 VAL A 109 27.377 33.203 40.455 1.00 0.00 H new ATOM 0 HG21 VAL A 109 26.969 31.609 43.050 1.00 0.00 H new ATOM 0 HG22 VAL A 109 27.917 31.075 41.641 1.00 0.00 H new ATOM 0 HG23 VAL A 109 28.667 31.117 43.255 1.00 0.00 H new ATOM 1714 N ALA A 110 31.342 34.600 42.790 1.00 0.00 N ATOM 1715 CA ALA A 110 32.010 35.926 43.016 1.00 0.00 C ATOM 1716 C ALA A 110 31.101 36.846 43.841 1.00 0.00 C ATOM 1717 O ALA A 110 31.060 38.056 43.634 1.00 0.00 O ATOM 1718 CB ALA A 110 32.281 36.524 41.630 1.00 0.00 C ATOM 0 H ALA A 110 31.659 33.853 43.408 1.00 0.00 H new ATOM 0 HA ALA A 110 32.939 35.811 43.574 1.00 0.00 H new ATOM 0 HB1 ALA A 110 32.768 37.493 41.741 1.00 0.00 H new ATOM 0 HB2 ALA A 110 32.930 35.854 41.065 1.00 0.00 H new ATOM 0 HB3 ALA A 110 31.338 36.650 41.098 1.00 0.00 H new ATOM 1724 N MET A 111 30.368 36.283 44.780 1.00 0.00 N ATOM 1725 CA MET A 111 29.461 37.122 45.628 1.00 0.00 C ATOM 1726 C MET A 111 29.471 36.665 47.101 1.00 0.00 C ATOM 1727 O MET A 111 29.986 35.603 47.445 1.00 0.00 O ATOM 1728 CB MET A 111 28.069 36.949 45.016 1.00 0.00 C ATOM 1729 CG MET A 111 27.673 35.472 45.033 1.00 0.00 C ATOM 1730 SD MET A 111 26.249 35.224 43.945 1.00 0.00 S ATOM 1731 CE MET A 111 26.041 33.452 44.242 1.00 0.00 C ATOM 0 H MET A 111 30.361 35.285 44.992 1.00 0.00 H new ATOM 0 HA MET A 111 29.781 38.164 45.640 1.00 0.00 H new ATOM 0 HB2 MET A 111 27.341 37.536 45.575 1.00 0.00 H new ATOM 0 HB3 MET A 111 28.063 37.324 43.993 1.00 0.00 H new ATOM 0 HG2 MET A 111 28.509 34.855 44.703 1.00 0.00 H new ATOM 0 HG3 MET A 111 27.428 35.161 46.049 1.00 0.00 H new ATOM 0 HE1 MET A 111 25.917 32.936 43.290 1.00 0.00 H new ATOM 0 HE2 MET A 111 26.921 33.063 44.754 1.00 0.00 H new ATOM 0 HE3 MET A 111 25.159 33.288 44.861 1.00 0.00 H new ATOM 1741 N SER A 112 28.909 37.473 47.967 1.00 0.00 N ATOM 1742 CA SER A 112 28.858 37.156 49.437 1.00 0.00 C ATOM 1743 C SER A 112 27.840 36.038 49.748 1.00 0.00 C ATOM 1744 O SER A 112 27.074 35.633 48.877 1.00 0.00 O ATOM 1745 CB SER A 112 28.437 38.474 50.094 1.00 0.00 C ATOM 1746 OG SER A 112 27.025 38.496 50.259 1.00 0.00 O ATOM 0 H SER A 112 28.473 38.360 47.715 1.00 0.00 H new ATOM 0 HA SER A 112 29.815 36.787 49.805 1.00 0.00 H new ATOM 0 HB2 SER A 112 28.928 38.583 51.061 1.00 0.00 H new ATOM 0 HB3 SER A 112 28.754 39.316 49.479 1.00 0.00 H new ATOM 0 HG SER A 112 26.758 39.339 50.681 1.00 0.00 H new ATOM 1752 N PRO A 113 27.864 35.566 50.983 1.00 0.00 N ATOM 1753 CA PRO A 113 26.936 34.479 51.415 1.00 0.00 C ATOM 1754 C PRO A 113 25.487 34.950 51.332 1.00 0.00 C ATOM 1755 O PRO A 113 24.589 34.171 50.999 1.00 0.00 O ATOM 1756 CB PRO A 113 27.360 34.196 52.857 1.00 0.00 C ATOM 1757 CG PRO A 113 28.025 35.455 53.303 1.00 0.00 C ATOM 1758 CD PRO A 113 28.726 36.004 52.089 1.00 0.00 C ATOM 0 HA PRO A 113 26.989 33.589 50.789 1.00 0.00 H new ATOM 0 HB2 PRO A 113 26.501 33.957 53.484 1.00 0.00 H new ATOM 0 HB3 PRO A 113 28.041 33.346 52.911 1.00 0.00 H new ATOM 0 HG2 PRO A 113 27.295 36.167 53.688 1.00 0.00 H new ATOM 0 HG3 PRO A 113 28.734 35.259 54.108 1.00 0.00 H new ATOM 0 HD2 PRO A 113 28.811 37.090 52.129 1.00 0.00 H new ATOM 0 HD3 PRO A 113 29.737 35.608 51.994 1.00 0.00 H new ATOM 1766 N PHE A 114 25.226 36.212 51.563 1.00 0.00 N ATOM 1767 CA PHE A 114 23.824 36.676 51.423 1.00 0.00 C ATOM 1768 C PHE A 114 23.436 36.650 49.953 1.00 0.00 C ATOM 1769 O PHE A 114 22.310 36.280 49.620 1.00 0.00 O ATOM 1770 CB PHE A 114 23.727 38.087 51.997 1.00 0.00 C ATOM 1771 CG PHE A 114 23.841 38.062 53.507 1.00 0.00 C ATOM 1772 CD1 PHE A 114 24.159 36.879 54.190 1.00 0.00 C ATOM 1773 CD2 PHE A 114 23.613 39.237 54.223 1.00 0.00 C ATOM 1774 CE1 PHE A 114 24.254 36.881 55.586 1.00 0.00 C ATOM 1775 CE2 PHE A 114 23.705 39.240 55.617 1.00 0.00 C ATOM 1776 CZ PHE A 114 24.028 38.063 56.300 1.00 0.00 C ATOM 0 H PHE A 114 25.907 36.921 51.835 1.00 0.00 H new ATOM 0 HA PHE A 114 23.139 36.025 51.966 1.00 0.00 H new ATOM 0 HB2 PHE A 114 24.517 38.710 51.578 1.00 0.00 H new ATOM 0 HB3 PHE A 114 22.778 38.538 51.707 1.00 0.00 H new ATOM 0 HD1 PHE A 114 24.331 35.966 53.638 1.00 0.00 H new ATOM 0 HD2 PHE A 114 23.365 40.148 53.698 1.00 0.00 H new ATOM 0 HE1 PHE A 114 24.502 35.971 56.112 1.00 0.00 H new ATOM 0 HE2 PHE A 114 23.527 40.152 56.168 1.00 0.00 H new ATOM 0 HZ PHE A 114 24.103 38.066 57.377 1.00 0.00 H new ATOM 1786 N HIS A 115 24.318 36.998 49.042 1.00 0.00 N ATOM 1787 CA HIS A 115 23.883 36.918 47.631 1.00 0.00 C ATOM 1788 C HIS A 115 23.743 35.440 47.204 1.00 0.00 C ATOM 1789 O HIS A 115 22.903 35.108 46.371 1.00 0.00 O ATOM 1790 CB HIS A 115 24.827 37.694 46.732 1.00 0.00 C ATOM 1791 CG HIS A 115 23.945 38.170 45.613 1.00 0.00 C ATOM 1792 ND1 HIS A 115 23.570 37.330 44.579 1.00 0.00 N ATOM 1793 CD2 HIS A 115 23.201 39.313 45.459 1.00 0.00 C ATOM 1794 CE1 HIS A 115 22.625 37.964 43.865 1.00 0.00 C ATOM 1795 NE2 HIS A 115 22.356 39.180 44.357 1.00 0.00 N ATOM 0 H HIS A 115 25.272 37.317 49.211 1.00 0.00 H new ATOM 0 HA HIS A 115 22.902 37.383 47.530 1.00 0.00 H new ATOM 0 HB2 HIS A 115 25.288 38.528 47.261 1.00 0.00 H new ATOM 0 HB3 HIS A 115 25.637 37.064 46.363 1.00 0.00 H new ATOM 0 HD1 HIS A 115 23.943 36.399 44.393 1.00 0.00 H new ATOM 0 HD2 HIS A 115 23.261 40.184 46.095 1.00 0.00 H new ATOM 0 HE1 HIS A 115 22.140 37.543 42.997 1.00 0.00 H new ATOM 1803 N LEU A 116 24.485 34.534 47.811 1.00 0.00 N ATOM 1804 CA LEU A 116 24.305 33.082 47.485 1.00 0.00 C ATOM 1805 C LEU A 116 22.853 32.739 47.822 1.00 0.00 C ATOM 1806 O LEU A 116 22.136 32.128 47.032 1.00 0.00 O ATOM 1807 CB LEU A 116 25.309 32.327 48.379 1.00 0.00 C ATOM 1808 CG LEU A 116 24.753 30.962 48.833 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.164 30.193 47.645 1.00 0.00 C ATOM 1810 CD2 LEU A 116 25.888 30.137 49.448 1.00 0.00 C ATOM 0 H LEU A 116 25.199 34.738 48.510 1.00 0.00 H new ATOM 0 HA LEU A 116 24.487 32.821 46.443 1.00 0.00 H new ATOM 0 HB2 LEU A 116 26.241 32.177 47.834 1.00 0.00 H new ATOM 0 HB3 LEU A 116 25.545 32.933 49.254 1.00 0.00 H new ATOM 0 HG LEU A 116 23.965 31.132 49.567 1.00 0.00 H new ATOM 0 HD11 LEU A 116 23.778 29.233 47.988 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.354 30.773 47.202 1.00 0.00 H new ATOM 0 HD13 LEU A 116 24.941 30.026 46.899 1.00 0.00 H new ATOM 0 HD21 LEU A 116 25.501 29.170 49.771 1.00 0.00 H new ATOM 0 HD22 LEU A 116 26.671 29.985 48.705 1.00 0.00 H new ATOM 0 HD23 LEU A 116 26.300 30.668 50.306 1.00 0.00 H new ATOM 1822 N HIS A 117 22.391 33.194 48.959 1.00 0.00 N ATOM 1823 CA HIS A 117 20.962 32.976 49.332 1.00 0.00 C ATOM 1824 C HIS A 117 20.084 33.548 48.201 1.00 0.00 C ATOM 1825 O HIS A 117 19.193 32.880 47.679 1.00 0.00 O ATOM 1826 CB HIS A 117 20.754 33.767 50.628 1.00 0.00 C ATOM 1827 CG HIS A 117 21.795 33.389 51.654 1.00 0.00 C ATOM 1828 ND1 HIS A 117 22.004 34.142 52.799 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.689 32.345 51.727 1.00 0.00 C ATOM 1830 CE1 HIS A 117 22.984 33.549 53.504 1.00 0.00 C ATOM 1831 NE2 HIS A 117 23.436 32.451 52.896 1.00 0.00 N ATOM 0 H HIS A 117 22.943 33.708 49.646 1.00 0.00 H new ATOM 0 HA HIS A 117 20.706 31.926 49.472 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.811 34.836 50.421 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.757 33.571 51.024 1.00 0.00 H new ATOM 0 HD1 HIS A 117 21.505 34.992 53.060 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.795 31.563 50.990 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.359 33.917 54.447 1.00 0.00 H new ATOM 1839 N ARG A 118 20.374 34.762 47.776 1.00 0.00 N ATOM 1840 CA ARG A 118 19.617 35.402 46.639 1.00 0.00 C ATOM 1841 C ARG A 118 19.649 34.490 45.391 1.00 0.00 C ATOM 1842 O ARG A 118 18.659 34.373 44.671 1.00 0.00 O ATOM 1843 CB ARG A 118 20.355 36.716 46.357 1.00 0.00 C ATOM 1844 CG ARG A 118 19.343 37.839 46.089 1.00 0.00 C ATOM 1845 CD ARG A 118 18.390 38.005 47.285 1.00 0.00 C ATOM 1846 NE ARG A 118 19.225 37.781 48.502 1.00 0.00 N ATOM 1847 CZ ARG A 118 20.111 38.670 48.883 1.00 0.00 C ATOM 1848 NH1 ARG A 118 20.283 39.776 48.206 1.00 0.00 N ATOM 1849 NH2 ARG A 118 20.827 38.449 49.950 1.00 0.00 N ATOM 0 H ARG A 118 21.112 35.344 48.173 1.00 0.00 H new ATOM 0 HA ARG A 118 18.568 35.566 46.887 1.00 0.00 H new ATOM 0 HB2 ARG A 118 20.985 36.978 47.207 1.00 0.00 H new ATOM 0 HB3 ARG A 118 21.013 36.596 45.497 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.870 38.775 45.905 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.771 37.613 45.189 1.00 0.00 H new ATOM 0 HD2 ARG A 118 17.943 38.999 47.294 1.00 0.00 H new ATOM 0 HD3 ARG A 118 17.571 37.288 47.235 1.00 0.00 H new ATOM 0 HE ARG A 118 19.105 36.925 49.044 1.00 0.00 H new ATOM 0 HH11 ARG A 118 19.725 39.955 47.371 1.00 0.00 H new ATOM 0 HH12 ARG A 118 20.975 40.459 48.513 1.00 0.00 H new ATOM 0 HH21 ARG A 118 20.696 37.589 50.483 1.00 0.00 H new ATOM 0 HH22 ARG A 118 21.518 39.136 50.252 1.00 0.00 H new ATOM 1863 N LEU A 119 20.749 33.811 45.143 1.00 0.00 N ATOM 1864 CA LEU A 119 20.831 32.866 43.969 1.00 0.00 C ATOM 1865 C LEU A 119 19.904 31.657 44.250 1.00 0.00 C ATOM 1866 O LEU A 119 19.102 31.250 43.413 1.00 0.00 O ATOM 1867 CB LEU A 119 22.305 32.427 43.940 1.00 0.00 C ATOM 1868 CG LEU A 119 22.675 31.766 42.599 1.00 0.00 C ATOM 1869 CD1 LEU A 119 23.983 30.985 42.766 1.00 0.00 C ATOM 1870 CD2 LEU A 119 21.574 30.804 42.141 1.00 0.00 C ATOM 0 H LEU A 119 21.599 33.869 45.704 1.00 0.00 H new ATOM 0 HA LEU A 119 20.523 33.309 43.022 1.00 0.00 H new ATOM 0 HB2 LEU A 119 22.946 33.292 44.109 1.00 0.00 H new ATOM 0 HB3 LEU A 119 22.493 31.728 44.755 1.00 0.00 H new ATOM 0 HG LEU A 119 22.791 32.547 41.848 1.00 0.00 H new ATOM 0 HD11 LEU A 119 24.250 30.515 41.819 1.00 0.00 H new ATOM 0 HD12 LEU A 119 24.778 31.667 43.069 1.00 0.00 H new ATOM 0 HD13 LEU A 119 23.853 30.217 43.529 1.00 0.00 H new ATOM 0 HD21 LEU A 119 21.859 30.350 41.192 1.00 0.00 H new ATOM 0 HD22 LEU A 119 21.438 30.024 42.890 1.00 0.00 H new ATOM 0 HD23 LEU A 119 20.641 31.353 42.015 1.00 0.00 H new ATOM 1882 N PHE A 120 19.988 31.115 45.449 1.00 0.00 N ATOM 1883 CA PHE A 120 19.111 29.959 45.879 1.00 0.00 C ATOM 1884 C PHE A 120 17.635 30.314 45.546 1.00 0.00 C ATOM 1885 O PHE A 120 16.880 29.482 45.053 1.00 0.00 O ATOM 1886 CB PHE A 120 19.371 29.919 47.420 1.00 0.00 C ATOM 1887 CG PHE A 120 19.278 28.519 48.039 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.274 27.636 47.632 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.167 28.123 49.083 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.143 26.380 48.230 1.00 0.00 C ATOM 1891 CE2 PHE A 120 20.020 26.867 49.691 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.007 25.995 49.262 1.00 0.00 C ATOM 0 H PHE A 120 20.641 31.430 46.166 1.00 0.00 H new ATOM 0 HA PHE A 120 19.313 29.003 45.397 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.362 30.327 47.620 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.652 30.571 47.915 1.00 0.00 H new ATOM 0 HD1 PHE A 120 17.592 27.928 46.847 1.00 0.00 H new ATOM 0 HD2 PHE A 120 20.953 28.790 49.405 1.00 0.00 H new ATOM 0 HE1 PHE A 120 17.371 25.703 47.894 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.686 26.571 50.488 1.00 0.00 H new ATOM 0 HZ PHE A 120 18.894 25.027 49.728 1.00 0.00 H new ATOM 1902 N LYS A 121 17.236 31.552 45.766 1.00 0.00 N ATOM 1903 CA LYS A 121 15.834 31.999 45.430 1.00 0.00 C ATOM 1904 C LYS A 121 15.689 32.164 43.916 1.00 0.00 C ATOM 1905 O LYS A 121 14.687 31.778 43.320 1.00 0.00 O ATOM 1906 CB LYS A 121 15.686 33.373 46.079 1.00 0.00 C ATOM 1907 CG LYS A 121 14.375 34.027 45.620 1.00 0.00 C ATOM 1908 CD LYS A 121 14.653 34.972 44.445 1.00 0.00 C ATOM 1909 CE LYS A 121 14.041 36.348 44.734 1.00 0.00 C ATOM 1910 NZ LYS A 121 13.204 36.656 43.541 1.00 0.00 N ATOM 0 H LYS A 121 17.827 32.280 46.168 1.00 0.00 H new ATOM 0 HA LYS A 121 15.090 31.281 45.775 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.694 33.275 47.165 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.532 34.005 45.810 1.00 0.00 H new ATOM 0 HG2 LYS A 121 13.660 33.260 45.321 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.925 34.579 46.445 1.00 0.00 H new ATOM 0 HD2 LYS A 121 15.727 35.067 44.288 1.00 0.00 H new ATOM 0 HD3 LYS A 121 14.232 34.561 43.527 1.00 0.00 H new ATOM 0 HE2 LYS A 121 13.440 36.330 45.643 1.00 0.00 H new ATOM 0 HE3 LYS A 121 14.815 37.102 44.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.751 37.584 43.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 13.804 36.674 42.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.472 35.926 43.433 1.00 0.00 H new ATOM 1924 N ALA A 122 16.681 32.737 43.286 1.00 0.00 N ATOM 1925 CA ALA A 122 16.622 32.935 41.808 1.00 0.00 C ATOM 1926 C ALA A 122 16.395 31.587 41.127 1.00 0.00 C ATOM 1927 O ALA A 122 15.448 31.409 40.364 1.00 0.00 O ATOM 1928 CB ALA A 122 17.984 33.515 41.420 1.00 0.00 C ATOM 0 H ALA A 122 17.532 33.077 43.733 1.00 0.00 H new ATOM 0 HA ALA A 122 15.810 33.597 41.506 1.00 0.00 H new ATOM 0 HB1 ALA A 122 18.013 33.687 40.344 1.00 0.00 H new ATOM 0 HB2 ALA A 122 18.140 34.459 41.942 1.00 0.00 H new ATOM 0 HB3 ALA A 122 18.771 32.813 41.697 1.00 0.00 H new ATOM 1934 N THR A 123 17.253 30.638 41.382 1.00 0.00 N ATOM 1935 CA THR A 123 17.085 29.297 40.732 1.00 0.00 C ATOM 1936 C THR A 123 15.837 28.566 41.300 1.00 0.00 C ATOM 1937 O THR A 123 14.888 28.295 40.567 1.00 0.00 O ATOM 1938 CB THR A 123 18.371 28.531 41.056 1.00 0.00 C ATOM 1939 OG1 THR A 123 19.468 29.435 41.072 1.00 0.00 O ATOM 1940 CG2 THR A 123 18.615 27.466 39.983 1.00 0.00 C ATOM 0 H THR A 123 18.056 30.726 42.004 1.00 0.00 H new ATOM 0 HA THR A 123 16.927 29.378 39.657 1.00 0.00 H new ATOM 0 HB THR A 123 18.272 28.054 42.031 1.00 0.00 H new ATOM 0 HG1 THR A 123 20.247 29.012 40.654 1.00 0.00 H new ATOM 0 HG21 THR A 123 19.530 26.921 40.213 1.00 0.00 H new ATOM 0 HG22 THR A 123 17.775 26.772 39.961 1.00 0.00 H new ATOM 0 HG23 THR A 123 18.714 27.946 39.010 1.00 0.00 H new ATOM 1948 N THR A 124 15.791 28.291 42.592 1.00 0.00 N ATOM 1949 CA THR A 124 14.570 27.640 43.210 1.00 0.00 C ATOM 1950 C THR A 124 13.334 28.416 42.747 1.00 0.00 C ATOM 1951 O THR A 124 12.256 27.860 42.553 1.00 0.00 O ATOM 1952 CB THR A 124 14.767 27.721 44.735 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.056 26.658 45.351 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.250 29.056 45.281 1.00 0.00 C ATOM 0 H THR A 124 16.546 28.489 43.248 1.00 0.00 H new ATOM 0 HA THR A 124 14.437 26.599 42.915 1.00 0.00 H new ATOM 0 HB THR A 124 15.832 27.644 44.955 1.00 0.00 H new ATOM 0 HG1 THR A 124 13.703 26.958 46.215 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.400 29.090 46.360 1.00 0.00 H new ATOM 0 HG22 THR A 124 14.795 29.876 44.813 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.187 29.153 45.059 1.00 0.00 H new ATOM 1962 N GLY A 125 13.494 29.705 42.549 1.00 0.00 N ATOM 1963 CA GLY A 125 12.367 30.564 42.077 1.00 0.00 C ATOM 1964 C GLY A 125 11.847 31.561 43.133 1.00 0.00 C ATOM 1965 O GLY A 125 11.562 32.699 42.767 1.00 0.00 O ATOM 0 H GLY A 125 14.372 30.202 42.698 1.00 0.00 H new ATOM 0 HA2 GLY A 125 12.692 31.120 41.198 1.00 0.00 H new ATOM 0 HA3 GLY A 125 11.544 29.923 41.762 1.00 0.00 H new ATOM 1969 N MET A 126 11.714 31.244 44.404 1.00 0.00 N ATOM 1970 CA MET A 126 11.203 32.329 45.323 1.00 0.00 C ATOM 1971 C MET A 126 11.518 32.115 46.815 1.00 0.00 C ATOM 1972 O MET A 126 10.641 32.285 47.662 1.00 0.00 O ATOM 1973 CB MET A 126 9.685 32.313 45.124 1.00 0.00 C ATOM 1974 CG MET A 126 9.305 33.173 43.918 1.00 0.00 C ATOM 1975 SD MET A 126 7.651 33.867 44.166 1.00 0.00 S ATOM 1976 CE MET A 126 6.775 32.298 44.379 1.00 0.00 C ATOM 0 H MET A 126 11.921 30.340 44.830 1.00 0.00 H new ATOM 0 HA MET A 126 11.690 33.271 45.072 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.341 31.290 44.974 1.00 0.00 H new ATOM 0 HB3 MET A 126 9.189 32.688 46.019 1.00 0.00 H new ATOM 0 HG2 MET A 126 10.031 33.975 43.787 1.00 0.00 H new ATOM 0 HG3 MET A 126 9.326 32.572 43.009 1.00 0.00 H new ATOM 0 HE1 MET A 126 5.714 32.443 44.177 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.178 31.559 43.686 1.00 0.00 H new ATOM 0 HE3 MET A 126 6.904 31.945 45.402 1.00 0.00 H new ATOM 1986 N THR A 127 12.740 31.813 47.175 1.00 0.00 N ATOM 1987 CA THR A 127 13.076 31.664 48.619 1.00 0.00 C ATOM 1988 C THR A 127 14.596 31.538 48.801 1.00 0.00 C ATOM 1989 O THR A 127 15.115 30.429 48.805 1.00 0.00 O ATOM 1990 CB THR A 127 12.398 30.375 49.075 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.161 30.189 48.401 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.138 30.492 50.560 1.00 0.00 C ATOM 0 H THR A 127 13.517 31.664 46.531 1.00 0.00 H new ATOM 0 HA THR A 127 12.742 32.527 49.195 1.00 0.00 H new ATOM 0 HB THR A 127 13.041 29.524 48.850 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.608 30.991 48.505 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.653 29.584 50.917 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.083 30.629 51.085 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.490 31.348 50.750 1.00 0.00 H new ATOM 2000 N PRO A 128 15.288 32.640 48.953 1.00 0.00 N ATOM 2001 CA PRO A 128 16.763 32.537 49.107 1.00 0.00 C ATOM 2002 C PRO A 128 17.185 31.928 50.448 1.00 0.00 C ATOM 2003 O PRO A 128 17.043 30.725 50.666 1.00 0.00 O ATOM 2004 CB PRO A 128 17.213 33.998 48.970 1.00 0.00 C ATOM 2005 CG PRO A 128 16.027 34.818 49.376 1.00 0.00 C ATOM 2006 CD PRO A 128 14.797 34.022 49.028 1.00 0.00 C ATOM 0 HA PRO A 128 17.217 31.869 48.376 1.00 0.00 H new ATOM 0 HB2 PRO A 128 18.072 34.206 49.608 1.00 0.00 H new ATOM 0 HB3 PRO A 128 17.514 34.222 47.947 1.00 0.00 H new ATOM 0 HG2 PRO A 128 16.056 35.035 50.444 1.00 0.00 H new ATOM 0 HG3 PRO A 128 16.025 35.776 48.856 1.00 0.00 H new ATOM 0 HD2 PRO A 128 14.021 34.131 49.786 1.00 0.00 H new ATOM 0 HD3 PRO A 128 14.365 34.346 48.081 1.00 0.00 H new ATOM 2014 N LYS A 129 17.728 32.716 51.345 1.00 0.00 N ATOM 2015 CA LYS A 129 18.182 32.155 52.645 1.00 0.00 C ATOM 2016 C LYS A 129 17.007 31.520 53.405 1.00 0.00 C ATOM 2017 O LYS A 129 17.201 30.663 54.263 1.00 0.00 O ATOM 2018 CB LYS A 129 18.792 33.325 53.408 1.00 0.00 C ATOM 2019 CG LYS A 129 19.035 32.933 54.870 1.00 0.00 C ATOM 2020 CD LYS A 129 19.907 31.672 54.930 1.00 0.00 C ATOM 2021 CE LYS A 129 21.104 31.914 55.851 1.00 0.00 C ATOM 2022 NZ LYS A 129 20.703 31.333 57.162 1.00 0.00 N ATOM 0 H LYS A 129 17.874 33.719 51.229 1.00 0.00 H new ATOM 0 HA LYS A 129 18.913 31.357 52.513 1.00 0.00 H new ATOM 0 HB2 LYS A 129 19.732 33.622 52.942 1.00 0.00 H new ATOM 0 HB3 LYS A 129 18.126 34.187 53.361 1.00 0.00 H new ATOM 0 HG2 LYS A 129 19.524 33.751 55.399 1.00 0.00 H new ATOM 0 HG3 LYS A 129 18.084 32.753 55.371 1.00 0.00 H new ATOM 0 HD2 LYS A 129 19.320 30.830 55.295 1.00 0.00 H new ATOM 0 HD3 LYS A 129 20.253 31.410 53.930 1.00 0.00 H new ATOM 0 HE2 LYS A 129 22.003 31.434 55.465 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.324 32.978 55.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 21.474 31.460 57.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 19.848 31.814 57.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 20.506 30.318 57.046 1.00 0.00 H new ATOM 2036 N ALA A 130 15.799 31.895 53.089 1.00 0.00 N ATOM 2037 CA ALA A 130 14.629 31.271 53.782 1.00 0.00 C ATOM 2038 C ALA A 130 14.521 29.799 53.337 1.00 0.00 C ATOM 2039 O ALA A 130 14.232 28.919 54.146 1.00 0.00 O ATOM 2040 CB ALA A 130 13.411 32.068 53.313 1.00 0.00 C ATOM 0 H ALA A 130 15.569 32.599 52.388 1.00 0.00 H new ATOM 0 HA ALA A 130 14.716 31.288 54.868 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.512 31.667 53.781 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.531 33.114 53.594 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.321 31.991 52.229 1.00 0.00 H new ATOM 2046 N TRP A 131 14.806 29.495 52.075 1.00 0.00 N ATOM 2047 CA TRP A 131 14.771 28.062 51.646 1.00 0.00 C ATOM 2048 C TRP A 131 15.856 27.323 52.403 1.00 0.00 C ATOM 2049 O TRP A 131 15.677 26.185 52.835 1.00 0.00 O ATOM 2050 CB TRP A 131 15.102 28.053 50.156 1.00 0.00 C ATOM 2051 CG TRP A 131 14.051 27.329 49.370 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.304 26.654 48.226 1.00 0.00 C ATOM 2053 CD2 TRP A 131 12.619 27.170 49.629 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.127 26.105 47.757 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.061 26.392 48.584 1.00 0.00 C ATOM 2056 CE3 TRP A 131 11.754 27.618 50.647 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 10.705 26.072 48.552 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.389 27.297 50.616 1.00 0.00 C ATOM 2059 CH2 TRP A 131 9.865 26.526 49.570 1.00 0.00 C ATOM 0 H TRP A 131 15.054 30.167 51.349 1.00 0.00 H new ATOM 0 HA TRP A 131 13.806 27.593 51.838 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.189 29.078 49.794 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.070 27.576 49.999 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.271 26.559 47.755 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.055 25.554 46.902 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.145 28.214 51.458 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 10.306 25.476 47.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 9.738 27.646 51.403 1.00 0.00 H new ATOM 0 HH2 TRP A 131 8.813 26.283 49.551 1.00 0.00 H new ATOM 2070 N GLN A 132 16.971 27.960 52.606 1.00 0.00 N ATOM 2071 CA GLN A 132 18.075 27.319 53.377 1.00 0.00 C ATOM 2072 C GLN A 132 17.571 26.992 54.789 1.00 0.00 C ATOM 2073 O GLN A 132 17.762 25.891 55.304 1.00 0.00 O ATOM 2074 CB GLN A 132 19.179 28.393 53.403 1.00 0.00 C ATOM 2075 CG GLN A 132 20.027 28.283 54.677 1.00 0.00 C ATOM 2076 CD GLN A 132 20.853 27.004 54.627 1.00 0.00 C ATOM 2077 OE1 GLN A 132 21.713 26.858 53.766 1.00 0.00 O ATOM 2078 NE2 GLN A 132 20.639 26.063 55.506 1.00 0.00 N ATOM 0 H GLN A 132 17.169 28.903 52.270 1.00 0.00 H new ATOM 0 HA GLN A 132 18.435 26.384 52.947 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.818 28.283 52.527 1.00 0.00 H new ATOM 0 HB3 GLN A 132 18.728 29.384 53.347 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.683 29.149 54.766 1.00 0.00 H new ATOM 0 HG3 GLN A 132 19.383 28.279 55.556 1.00 0.00 H new ATOM 0 HE21 GLN A 132 19.923 26.187 56.222 1.00 0.00 H new ATOM 0 HE22 GLN A 132 21.188 25.204 55.477 1.00 0.00 H new ATOM 2087 N GLN A 133 16.934 27.940 55.422 1.00 0.00 N ATOM 2088 CA GLN A 133 16.417 27.712 56.804 1.00 0.00 C ATOM 2089 C GLN A 133 15.349 26.614 56.812 1.00 0.00 C ATOM 2090 O GLN A 133 15.406 25.683 57.613 1.00 0.00 O ATOM 2091 CB GLN A 133 15.811 29.052 57.227 1.00 0.00 C ATOM 2092 CG GLN A 133 15.463 29.007 58.716 1.00 0.00 C ATOM 2093 CD GLN A 133 13.975 28.696 58.886 1.00 0.00 C ATOM 2094 OE1 GLN A 133 13.369 28.050 58.035 1.00 0.00 O ATOM 2095 NE2 GLN A 133 13.351 29.123 59.949 1.00 0.00 N ATOM 0 H GLN A 133 16.748 28.867 55.040 1.00 0.00 H new ATOM 0 HA GLN A 133 17.204 27.384 57.483 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.516 29.860 57.032 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.917 29.260 56.640 1.00 0.00 H new ATOM 0 HG2 GLN A 133 16.063 28.248 59.217 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.701 29.962 59.184 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.855 29.659 60.655 1.00 0.00 H new ATOM 0 HE22 GLN A 133 12.359 28.920 60.074 1.00 0.00 H new ATOM 2104 N ALA A 134 14.372 26.705 55.948 1.00 0.00 N ATOM 2105 CA ALA A 134 13.299 25.664 55.923 1.00 0.00 C ATOM 2106 C ALA A 134 13.909 24.277 55.740 1.00 0.00 C ATOM 2107 O ALA A 134 13.760 23.400 56.590 1.00 0.00 O ATOM 2108 CB ALA A 134 12.409 26.027 54.734 1.00 0.00 C ATOM 0 H ALA A 134 14.270 27.452 55.261 1.00 0.00 H new ATOM 0 HA ALA A 134 12.733 25.638 56.854 1.00 0.00 H new ATOM 0 HB1 ALA A 134 11.597 25.304 54.653 1.00 0.00 H new ATOM 0 HB2 ALA A 134 11.994 27.024 54.881 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.001 26.012 53.819 1.00 0.00 H new ATOM 2114 N TRP A 135 14.604 24.067 54.658 1.00 0.00 N ATOM 2115 CA TRP A 135 15.253 22.738 54.420 1.00 0.00 C ATOM 2116 C TRP A 135 15.962 22.273 55.695 1.00 0.00 C ATOM 2117 O TRP A 135 15.797 21.147 56.156 1.00 0.00 O ATOM 2118 CB TRP A 135 16.282 23.040 53.357 1.00 0.00 C ATOM 2119 CG TRP A 135 15.640 23.356 52.055 1.00 0.00 C ATOM 2120 CD1 TRP A 135 16.320 23.857 51.020 1.00 0.00 C ATOM 2121 CD2 TRP A 135 14.258 23.187 51.608 1.00 0.00 C ATOM 2122 NE1 TRP A 135 15.459 24.032 49.952 1.00 0.00 N ATOM 2123 CE2 TRP A 135 14.174 23.627 50.263 1.00 0.00 C ATOM 2124 CE3 TRP A 135 13.081 22.708 52.220 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 12.973 23.592 49.555 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 11.872 22.672 51.507 1.00 0.00 C ATOM 2127 CH2 TRP A 135 11.818 23.112 50.178 1.00 0.00 C ATOM 0 H TRP A 135 14.754 24.758 53.923 1.00 0.00 H new ATOM 0 HA TRP A 135 14.546 21.959 54.134 1.00 0.00 H new ATOM 0 HB2 TRP A 135 16.899 23.881 53.674 1.00 0.00 H new ATOM 0 HB3 TRP A 135 16.947 22.184 53.238 1.00 0.00 H new ATOM 0 HD1 TRP A 135 17.375 24.089 51.018 1.00 0.00 H new ATOM 0 HE1 TRP A 135 15.737 24.412 49.047 1.00 0.00 H new ATOM 0 HE3 TRP A 135 13.110 22.367 53.244 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 12.936 23.934 48.531 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 10.977 22.303 51.986 1.00 0.00 H new ATOM 0 HH2 TRP A 135 10.885 23.080 49.636 1.00 0.00 H new ATOM 2138 N ARG A 136 16.738 23.142 56.268 1.00 0.00 N ATOM 2139 CA ARG A 136 17.478 22.811 57.534 1.00 0.00 C ATOM 2140 C ARG A 136 16.487 22.458 58.659 1.00 0.00 C ATOM 2141 O ARG A 136 16.771 21.631 59.522 1.00 0.00 O ATOM 2142 CB ARG A 136 18.251 24.102 57.853 1.00 0.00 C ATOM 2143 CG ARG A 136 18.447 24.269 59.366 1.00 0.00 C ATOM 2144 CD ARG A 136 19.151 25.601 59.643 1.00 0.00 C ATOM 2145 NE ARG A 136 19.763 25.447 60.995 1.00 0.00 N ATOM 2146 CZ ARG A 136 19.033 25.541 62.082 1.00 0.00 C ATOM 2147 NH1 ARG A 136 17.747 25.771 62.008 1.00 0.00 N ATOM 2148 NH2 ARG A 136 19.595 25.401 63.251 1.00 0.00 N ATOM 0 H ARG A 136 16.900 24.085 55.915 1.00 0.00 H new ATOM 0 HA ARG A 136 18.136 21.948 57.435 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.222 24.080 57.358 1.00 0.00 H new ATOM 0 HB3 ARG A 136 17.710 24.961 57.456 1.00 0.00 H new ATOM 0 HG2 ARG A 136 17.483 24.242 59.874 1.00 0.00 H new ATOM 0 HG3 ARG A 136 19.039 23.443 59.761 1.00 0.00 H new ATOM 0 HD2 ARG A 136 19.910 25.809 58.889 1.00 0.00 H new ATOM 0 HD3 ARG A 136 18.445 26.431 59.623 1.00 0.00 H new ATOM 0 HE ARG A 136 20.764 25.266 61.076 1.00 0.00 H new ATOM 0 HH11 ARG A 136 17.300 25.880 61.098 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.192 25.842 62.861 1.00 0.00 H new ATOM 0 HH21 ARG A 136 20.597 25.220 63.317 1.00 0.00 H new ATOM 0 HH22 ARG A 136 19.033 25.473 64.099 1.00 0.00 H new ATOM 2162 N ALA A 137 15.338 23.083 58.665 1.00 0.00 N ATOM 2163 CA ALA A 137 14.333 22.804 59.737 1.00 0.00 C ATOM 2164 C ALA A 137 13.689 21.432 59.524 1.00 0.00 C ATOM 2165 O ALA A 137 13.268 20.772 60.471 1.00 0.00 O ATOM 2166 CB ALA A 137 13.289 23.913 59.595 1.00 0.00 C ATOM 0 H ALA A 137 15.051 23.776 57.973 1.00 0.00 H new ATOM 0 HA ALA A 137 14.784 22.788 60.729 1.00 0.00 H new ATOM 0 HB1 ALA A 137 12.513 23.781 60.349 1.00 0.00 H new ATOM 0 HB2 ALA A 137 13.767 24.883 59.733 1.00 0.00 H new ATOM 0 HB3 ALA A 137 12.842 23.867 58.602 1.00 0.00 H new ATOM 2172 N ARG A 138 13.620 20.988 58.302 1.00 0.00 N ATOM 2173 CA ARG A 138 13.021 19.653 58.018 1.00 0.00 C ATOM 2174 C ARG A 138 14.136 18.627 57.820 1.00 0.00 C ATOM 2175 O ARG A 138 13.899 17.420 57.873 1.00 0.00 O ATOM 2176 CB ARG A 138 12.232 19.845 56.722 1.00 0.00 C ATOM 2177 CG ARG A 138 11.472 18.560 56.387 1.00 0.00 C ATOM 2178 CD ARG A 138 11.325 18.439 54.868 1.00 0.00 C ATOM 2179 NE ARG A 138 12.721 18.293 54.358 1.00 0.00 N ATOM 2180 CZ ARG A 138 12.947 17.904 53.127 1.00 0.00 C ATOM 2181 NH1 ARG A 138 11.955 17.632 52.317 1.00 0.00 N ATOM 2182 NH2 ARG A 138 14.176 17.784 52.704 1.00 0.00 N ATOM 0 H ARG A 138 13.954 21.494 57.482 1.00 0.00 H new ATOM 0 HA ARG A 138 12.387 19.293 58.828 1.00 0.00 H new ATOM 0 HB2 ARG A 138 11.533 20.675 56.830 1.00 0.00 H new ATOM 0 HB3 ARG A 138 12.909 20.102 55.907 1.00 0.00 H new ATOM 0 HG2 ARG A 138 12.005 17.695 56.782 1.00 0.00 H new ATOM 0 HG3 ARG A 138 10.490 18.572 56.859 1.00 0.00 H new ATOM 0 HD2 ARG A 138 10.713 17.578 54.597 1.00 0.00 H new ATOM 0 HD3 ARG A 138 10.840 19.320 54.446 1.00 0.00 H new ATOM 0 HE ARG A 138 13.507 18.498 54.974 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.992 17.722 52.642 1.00 0.00 H new ATOM 0 HH12 ARG A 138 12.145 17.330 51.361 1.00 0.00 H new ATOM 0 HH21 ARG A 138 14.954 17.992 53.330 1.00 0.00 H new ATOM 0 HH22 ARG A 138 14.359 17.482 51.747 1.00 0.00 H new ATOM 2196 N ARG A 139 15.348 19.067 57.606 1.00 0.00 N ATOM 2197 CA ARG A 139 16.465 18.095 57.421 1.00 0.00 C ATOM 2198 C ARG A 139 17.208 17.891 58.744 1.00 0.00 C ATOM 2199 O ARG A 139 17.373 16.748 59.139 1.00 0.00 O ATOM 2200 CB ARG A 139 17.389 18.724 56.378 1.00 0.00 C ATOM 2201 CG ARG A 139 18.224 17.625 55.717 1.00 0.00 C ATOM 2202 CD ARG A 139 19.577 18.194 55.283 1.00 0.00 C ATOM 2203 NE ARG A 139 20.580 17.186 55.735 1.00 0.00 N ATOM 2204 CZ ARG A 139 20.900 17.081 57.004 1.00 0.00 C ATOM 2205 NH1 ARG A 139 20.347 17.858 57.899 1.00 0.00 N ATOM 2206 NH2 ARG A 139 21.778 16.191 57.377 1.00 0.00 N ATOM 2207 OXT ARG A 139 17.599 18.881 59.341 1.00 0.00 O ATOM 0 H ARG A 139 15.612 20.051 57.552 1.00 0.00 H new ATOM 0 HA ARG A 139 16.106 17.117 57.099 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.802 19.253 55.627 1.00 0.00 H new ATOM 0 HB3 ARG A 139 18.041 19.459 56.849 1.00 0.00 H new ATOM 0 HG2 ARG A 139 18.372 16.800 56.413 1.00 0.00 H new ATOM 0 HG3 ARG A 139 17.694 17.222 54.854 1.00 0.00 H new ATOM 0 HD2 ARG A 139 19.618 18.335 54.203 1.00 0.00 H new ATOM 0 HD3 ARG A 139 19.761 19.167 55.739 1.00 0.00 H new ATOM 0 HE ARG A 139 21.022 16.572 55.051 1.00 0.00 H new ATOM 0 HH11 ARG A 139 19.659 18.555 57.614 1.00 0.00 H new ATOM 0 HH12 ARG A 139 20.604 17.767 58.882 1.00 0.00 H new ATOM 0 HH21 ARG A 139 22.212 15.581 56.684 1.00 0.00 H new ATOM 0 HH22 ARG A 139 22.030 16.105 58.362 1.00 0.00 H new