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 117 HIS : no HE2:sc= -8.52! C(o=-11!,f=-20!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -153:sc= 0.766 (180deg=-1.47!) USER MOD Set 1.3: A 132 GLN : amide:sc= -3.19 K(o=-11,f=-19!) USER MOD Set 2.1: A 111 MET CE :methyl -139:sc= -6.17! (180deg=-12.3!) USER MOD Set 2.2: A 115 HIS : no HD1:sc= -1.95 K(o=-8.1,f=-14) USER MOD Set 3.1: A 42 CYS SG : rot 74:sc= 0.631 USER MOD Set 3.2: A 69 CYS SG : rot -136:sc= 0.674 USER MOD Set 3.3: A 72 CYS SG : rot -135:sc= -0.464 USER MOD Set 4.1: A 53 SER OG : rot 180:sc= -0.519 USER MOD Set 4.2: A 55 TYR OH : rot -15:sc= -0.394 USER MOD Set 5.1: A 11 GLN :FLIP amide:sc= 0.298 F(o=-0.64,f=0.7) USER MOD Set 5.2: A 14 GLN :FLIP amide:sc= 0.4 F(o=0,f=0.7) USER MOD Single : A 8 THR OG1 : rot 40:sc= 0.243 USER MOD Single : A 15 SER OG : rot 78:sc= 0.276 USER MOD Single : A 22 ASN :FLIP amide:sc= -0.675 F(o=-2.3!,f=-0.68) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -24:sc= 0.461 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 46 HIS :FLIP no HE2:sc= -2.76! C(o=-5.7!,f=-2.8!) USER MOD Single : A 51 ASN : amide:sc= -3.3 X(o=-3.3,f=-3.2) USER MOD Single : A 57 ASN : amide:sc= -5.53! C(o=-5.5!,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= -3.29 K(o=-3.3,f=-7.6!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN :FLIP amide:sc= -9.63! C(o=-11!,f=-9.6!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.0885 X(o=-0.088,f=-0.23) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0381 USER MOD Single : A 89 HIS : no HD1:sc= -0.272 X(o=-0.27,f=-0.055) USER MOD Single : A 91 CYS SG : rot 108:sc= -5.7! USER MOD Single : A 96 GLN : amide:sc= -2.51 K(o=-2.5,f=-6.5!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.0137 USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0.121 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot -130:sc= -0.795 USER MOD Single : A 124 THR OG1 : rot -169:sc= 0.446 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot -55:sc= -0.658! USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 7.681 16.331 18.721 1.00 0.00 N ATOM 119 CA THR A 8 6.553 17.170 18.296 1.00 0.00 C ATOM 120 C THR A 8 7.037 18.605 18.168 1.00 0.00 C ATOM 121 O THR A 8 6.597 19.490 18.895 1.00 0.00 O ATOM 122 CB THR A 8 5.510 17.050 19.407 1.00 0.00 C ATOM 123 OG1 THR A 8 5.182 15.682 19.601 1.00 0.00 O ATOM 124 CG2 THR A 8 4.250 17.831 19.022 1.00 0.00 C ATOM 0 HA THR A 8 6.136 16.867 17.336 1.00 0.00 H new ATOM 0 HB THR A 8 5.917 17.461 20.330 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.994 15.138 19.529 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.510 17.742 19.817 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.503 18.881 18.877 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.839 17.426 18.097 1.00 0.00 H new ATOM 132 N ASP A 9 7.938 18.851 17.249 1.00 0.00 N ATOM 133 CA ASP A 9 8.463 20.241 17.055 1.00 0.00 C ATOM 134 C ASP A 9 7.319 21.249 17.164 1.00 0.00 C ATOM 135 O ASP A 9 7.504 22.385 17.599 1.00 0.00 O ATOM 136 CB ASP A 9 9.062 20.255 15.647 1.00 0.00 C ATOM 137 CG ASP A 9 8.014 19.787 14.634 1.00 0.00 C ATOM 138 OD1 ASP A 9 7.794 18.589 14.548 1.00 0.00 O ATOM 139 OD2 ASP A 9 7.450 20.633 13.959 1.00 0.00 O ATOM 0 H ASP A 9 8.334 18.149 16.623 1.00 0.00 H new ATOM 0 HA ASP A 9 9.203 20.512 17.808 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.401 21.260 15.396 1.00 0.00 H new ATOM 0 HB3 ASP A 9 9.936 19.605 15.607 1.00 0.00 H new ATOM 144 N ASP A 10 6.132 20.840 16.798 1.00 0.00 N ATOM 145 CA ASP A 10 4.968 21.725 16.894 1.00 0.00 C ATOM 146 C ASP A 10 4.758 22.159 18.344 1.00 0.00 C ATOM 147 O ASP A 10 4.688 23.356 18.646 1.00 0.00 O ATOM 148 CB ASP A 10 3.824 20.849 16.407 1.00 0.00 C ATOM 149 CG ASP A 10 3.822 20.810 14.877 1.00 0.00 C ATOM 150 OD1 ASP A 10 3.420 21.796 14.279 1.00 0.00 O ATOM 151 OD2 ASP A 10 4.222 19.797 14.330 1.00 0.00 O ATOM 0 H ASP A 10 5.932 19.909 16.432 1.00 0.00 H new ATOM 0 HA ASP A 10 5.066 22.644 16.316 1.00 0.00 H new ATOM 0 HB2 ASP A 10 3.930 19.840 16.806 1.00 0.00 H new ATOM 0 HB3 ASP A 10 2.874 21.238 16.772 1.00 0.00 H new ATOM 156 N GLN A 11 4.683 21.235 19.267 1.00 0.00 N ATOM 157 CA GLN A 11 4.502 21.686 20.667 1.00 0.00 C ATOM 158 C GLN A 11 5.846 22.028 21.271 1.00 0.00 C ATOM 159 O GLN A 11 5.941 22.932 22.096 1.00 0.00 O ATOM 160 CB GLN A 11 3.838 20.580 21.460 1.00 0.00 C ATOM 161 CG GLN A 11 3.617 21.131 22.869 1.00 0.00 C ATOM 162 CD GLN A 11 2.122 21.146 23.195 1.00 0.00 C ATOM 163 OE1 GLN A 11 1.382 22.131 22.766 1.00 0.00 O flip ATOM 164 NE2 GLN A 11 1.617 20.241 23.856 1.00 0.00 N flip ATOM 0 H GLN A 11 4.737 20.228 19.117 1.00 0.00 H new ATOM 0 HA GLN A 11 3.873 22.576 20.691 1.00 0.00 H new ATOM 0 HB2 GLN A 11 2.892 20.290 21.004 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.466 19.690 21.485 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.150 20.518 23.596 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.024 22.140 22.942 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.195 19.471 24.192 1.00 0.00 H new ATOM 0 HE22 GLN A 11 0.620 20.260 24.069 1.00 0.00 H new ATOM 173 N ARG A 12 6.904 21.373 20.859 1.00 0.00 N ATOM 174 CA ARG A 12 8.224 21.748 21.397 1.00 0.00 C ATOM 175 C ARG A 12 8.301 23.249 21.237 1.00 0.00 C ATOM 176 O ARG A 12 8.710 23.981 22.131 1.00 0.00 O ATOM 177 CB ARG A 12 9.242 21.077 20.483 1.00 0.00 C ATOM 178 CG ARG A 12 9.442 19.584 20.827 1.00 0.00 C ATOM 179 CD ARG A 12 8.172 18.929 21.394 1.00 0.00 C ATOM 180 NE ARG A 12 8.211 19.213 22.858 1.00 0.00 N ATOM 181 CZ ARG A 12 9.094 18.626 23.630 1.00 0.00 C ATOM 182 NH1 ARG A 12 9.960 17.778 23.136 1.00 0.00 N ATOM 183 NH2 ARG A 12 9.109 18.891 24.908 1.00 0.00 N ATOM 0 H ARG A 12 6.901 20.608 20.184 1.00 0.00 H new ATOM 0 HA ARG A 12 8.395 21.459 22.434 1.00 0.00 H new ATOM 0 HB2 ARG A 12 8.914 21.169 19.448 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.197 21.597 20.562 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.753 19.048 19.930 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.250 19.488 21.552 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.275 19.345 20.935 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.161 17.856 21.200 1.00 0.00 H new ATOM 0 HE ARG A 12 7.544 19.870 23.263 1.00 0.00 H new ATOM 0 HH11 ARG A 12 9.954 17.566 22.138 1.00 0.00 H new ATOM 0 HH12 ARG A 12 10.641 17.329 23.749 1.00 0.00 H new ATOM 0 HH21 ARG A 12 8.437 19.551 25.300 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.793 18.438 25.515 1.00 0.00 H new ATOM 197 N TRP A 13 7.847 23.712 20.100 1.00 0.00 N ATOM 198 CA TRP A 13 7.827 25.156 19.852 1.00 0.00 C ATOM 199 C TRP A 13 6.836 25.815 20.794 1.00 0.00 C ATOM 200 O TRP A 13 7.101 26.878 21.348 1.00 0.00 O ATOM 201 CB TRP A 13 7.332 25.332 18.423 1.00 0.00 C ATOM 202 CG TRP A 13 7.428 26.780 18.078 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.435 27.530 17.549 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.559 27.672 18.267 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.897 28.823 17.377 1.00 0.00 N ATOM 206 CE2 TRP A 13 8.199 28.963 17.819 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.851 27.483 18.775 1.00 0.00 C ATOM 208 CZ2 TRP A 13 9.092 30.033 17.881 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.754 28.550 18.837 1.00 0.00 C ATOM 210 CH2 TRP A 13 10.379 29.827 18.396 1.00 0.00 C ATOM 0 H TRP A 13 7.490 23.136 19.338 1.00 0.00 H new ATOM 0 HA TRP A 13 8.811 25.600 20.004 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.932 24.736 17.736 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.303 24.985 18.331 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.444 27.178 17.301 1.00 0.00 H new ATOM 0 HE1 TRP A 13 6.345 29.580 16.974 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.152 26.506 19.122 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 8.794 31.012 17.535 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.748 28.389 19.228 1.00 0.00 H new ATOM 0 HH2 TRP A 13 11.079 30.648 18.453 1.00 0.00 H new ATOM 221 N GLN A 14 5.695 25.199 21.013 1.00 0.00 N ATOM 222 CA GLN A 14 4.721 25.823 21.946 1.00 0.00 C ATOM 223 C GLN A 14 5.405 25.982 23.300 1.00 0.00 C ATOM 224 O GLN A 14 5.189 26.951 24.013 1.00 0.00 O ATOM 225 CB GLN A 14 3.537 24.848 22.011 1.00 0.00 C ATOM 226 CG GLN A 14 2.622 25.205 23.193 1.00 0.00 C ATOM 227 CD GLN A 14 1.207 25.493 22.683 1.00 0.00 C ATOM 228 OE1 GLN A 14 0.975 26.600 22.033 1.00 0.00 O flip ATOM 229 NE2 GLN A 14 0.295 24.696 22.885 1.00 0.00 N flip ATOM 0 H GLN A 14 5.408 24.314 20.595 1.00 0.00 H new ATOM 0 HA GLN A 14 4.376 26.808 21.633 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.972 24.887 21.079 1.00 0.00 H new ATOM 0 HB3 GLN A 14 3.902 23.827 22.120 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.600 24.384 23.909 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.014 26.076 23.718 1.00 0.00 H new ATOM 0 HE21 GLN A 14 0.477 23.831 23.393 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -0.645 24.899 22.544 1.00 0.00 H new ATOM 238 N SER A 15 6.264 25.059 23.640 1.00 0.00 N ATOM 239 CA SER A 15 7.009 25.162 24.918 1.00 0.00 C ATOM 240 C SER A 15 8.029 26.288 24.796 1.00 0.00 C ATOM 241 O SER A 15 8.350 26.988 25.761 1.00 0.00 O ATOM 242 CB SER A 15 7.711 23.814 25.082 1.00 0.00 C ATOM 243 OG SER A 15 6.751 22.770 24.976 1.00 0.00 O ATOM 0 H SER A 15 6.480 24.234 23.080 1.00 0.00 H new ATOM 0 HA SER A 15 6.368 25.380 25.772 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.480 23.696 24.319 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.212 23.767 26.049 1.00 0.00 H new ATOM 0 HG SER A 15 6.528 22.625 24.033 1.00 0.00 H new ATOM 249 N VAL A 16 8.541 26.470 23.613 1.00 0.00 N ATOM 250 CA VAL A 16 9.551 27.531 23.393 1.00 0.00 C ATOM 251 C VAL A 16 8.942 28.896 23.493 1.00 0.00 C ATOM 252 O VAL A 16 9.552 29.859 23.955 1.00 0.00 O ATOM 253 CB VAL A 16 10.093 27.296 21.987 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.223 28.269 21.722 1.00 0.00 C ATOM 255 CG2 VAL A 16 10.630 25.877 21.859 1.00 0.00 C ATOM 0 H VAL A 16 8.300 25.924 22.786 1.00 0.00 H new ATOM 0 HA VAL A 16 10.335 27.487 24.149 1.00 0.00 H new ATOM 0 HB VAL A 16 9.287 27.443 21.268 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.615 28.106 20.718 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.851 29.290 21.805 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.017 28.112 22.452 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.014 25.723 20.851 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.433 25.726 22.580 1.00 0.00 H new ATOM 0 HG23 VAL A 16 9.828 25.165 22.055 1.00 0.00 H new ATOM 265 N LEU A 17 7.763 28.988 23.060 1.00 0.00 N ATOM 266 CA LEU A 17 7.057 30.263 23.096 1.00 0.00 C ATOM 267 C LEU A 17 6.339 30.375 24.428 1.00 0.00 C ATOM 268 O LEU A 17 6.205 31.447 25.014 1.00 0.00 O ATOM 269 CB LEU A 17 6.097 30.125 21.937 1.00 0.00 C ATOM 270 CG LEU A 17 6.850 29.788 20.632 1.00 0.00 C ATOM 271 CD1 LEU A 17 6.143 30.463 19.474 1.00 0.00 C ATOM 272 CD2 LEU A 17 8.311 30.272 20.662 1.00 0.00 C ATOM 0 H LEU A 17 7.230 28.213 22.666 1.00 0.00 H new ATOM 0 HA LEU A 17 7.680 31.153 23.010 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.370 29.343 22.154 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.539 31.053 21.810 1.00 0.00 H new ATOM 0 HG LEU A 17 6.856 28.704 20.520 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.665 30.233 18.545 1.00 0.00 H new ATOM 0 HD12 LEU A 17 5.117 30.100 19.413 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.138 31.542 19.630 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.800 30.012 19.723 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.333 31.354 20.796 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.836 29.793 21.489 1.00 0.00 H new ATOM 284 N ALA A 18 5.905 29.259 24.918 1.00 0.00 N ATOM 285 CA ALA A 18 5.212 29.227 26.235 1.00 0.00 C ATOM 286 C ALA A 18 6.239 29.257 27.371 1.00 0.00 C ATOM 287 O ALA A 18 5.874 29.279 28.540 1.00 0.00 O ATOM 288 CB ALA A 18 4.425 27.917 26.267 1.00 0.00 C ATOM 0 H ALA A 18 5.999 28.352 24.460 1.00 0.00 H new ATOM 0 HA ALA A 18 4.556 30.088 26.364 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.892 27.836 27.214 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.709 27.903 25.445 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.112 27.077 26.164 1.00 0.00 H new ATOM 294 N ARG A 19 7.516 29.220 27.047 1.00 0.00 N ATOM 295 CA ARG A 19 8.582 29.225 28.099 1.00 0.00 C ATOM 296 C ARG A 19 8.333 28.119 29.105 1.00 0.00 C ATOM 297 O ARG A 19 8.526 28.278 30.306 1.00 0.00 O ATOM 298 CB ARG A 19 8.580 30.632 28.737 1.00 0.00 C ATOM 299 CG ARG A 19 7.389 30.832 29.685 1.00 0.00 C ATOM 300 CD ARG A 19 7.748 31.871 30.752 1.00 0.00 C ATOM 301 NE ARG A 19 6.680 32.909 30.654 1.00 0.00 N ATOM 302 CZ ARG A 19 6.697 33.802 29.692 1.00 0.00 C ATOM 303 NH1 ARG A 19 7.652 33.805 28.796 1.00 0.00 N ATOM 304 NH2 ARG A 19 5.751 34.699 29.628 1.00 0.00 N ATOM 0 H ARG A 19 7.864 29.186 26.089 1.00 0.00 H new ATOM 0 HA ARG A 19 9.568 29.025 27.679 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.510 30.782 29.286 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.548 31.386 27.951 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.515 31.161 29.123 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.126 29.886 30.158 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.774 31.424 31.746 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.733 32.300 30.570 1.00 0.00 H new ATOM 0 HE ARG A 19 5.928 32.925 31.343 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.395 33.108 28.840 1.00 0.00 H new ATOM 0 HH12 ARG A 19 7.653 34.505 28.054 1.00 0.00 H new ATOM 0 HH21 ARG A 19 5.004 34.703 30.323 1.00 0.00 H new ATOM 0 HH22 ARG A 19 5.758 35.396 28.883 1.00 0.00 H new ATOM 318 N ASP A 20 7.936 26.985 28.612 1.00 0.00 N ATOM 319 CA ASP A 20 7.694 25.827 29.501 1.00 0.00 C ATOM 320 C ASP A 20 9.036 25.314 30.045 1.00 0.00 C ATOM 321 O ASP A 20 9.830 24.742 29.302 1.00 0.00 O ATOM 322 CB ASP A 20 7.038 24.775 28.604 1.00 0.00 C ATOM 323 CG ASP A 20 6.530 23.612 29.460 1.00 0.00 C ATOM 324 OD1 ASP A 20 6.219 23.844 30.617 1.00 0.00 O ATOM 325 OD2 ASP A 20 6.460 22.510 28.944 1.00 0.00 O ATOM 0 H ASP A 20 7.768 26.811 27.621 1.00 0.00 H new ATOM 0 HA ASP A 20 7.068 26.073 30.358 1.00 0.00 H new ATOM 0 HB2 ASP A 20 6.211 25.220 28.050 1.00 0.00 H new ATOM 0 HB3 ASP A 20 7.756 24.412 27.868 1.00 0.00 H new ATOM 330 N PRO A 21 9.254 25.518 31.320 1.00 0.00 N ATOM 331 CA PRO A 21 10.511 25.056 31.970 1.00 0.00 C ATOM 332 C PRO A 21 10.535 23.525 32.033 1.00 0.00 C ATOM 333 O PRO A 21 11.410 22.924 32.653 1.00 0.00 O ATOM 334 CB PRO A 21 10.442 25.660 33.370 1.00 0.00 C ATOM 335 CG PRO A 21 8.986 25.871 33.621 1.00 0.00 C ATOM 336 CD PRO A 21 8.361 26.179 32.287 1.00 0.00 C ATOM 0 HA PRO A 21 11.410 25.357 31.433 1.00 0.00 H new ATOM 0 HB2 PRO A 21 10.879 24.991 34.112 1.00 0.00 H new ATOM 0 HB3 PRO A 21 10.993 26.599 33.424 1.00 0.00 H new ATOM 0 HG2 PRO A 21 8.536 24.982 34.064 1.00 0.00 H new ATOM 0 HG3 PRO A 21 8.828 26.691 34.322 1.00 0.00 H new ATOM 0 HD2 PRO A 21 7.344 25.791 32.222 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.304 27.253 32.110 1.00 0.00 H new ATOM 344 N ASN A 22 9.572 22.890 31.423 1.00 0.00 N ATOM 345 CA ASN A 22 9.488 21.426 31.449 1.00 0.00 C ATOM 346 C ASN A 22 9.985 20.877 30.128 1.00 0.00 C ATOM 347 O ASN A 22 10.270 19.689 29.985 1.00 0.00 O ATOM 348 CB ASN A 22 8.000 21.221 31.585 1.00 0.00 C ATOM 349 CG ASN A 22 7.674 19.750 31.435 1.00 0.00 C ATOM 350 OD1 ASN A 22 7.682 19.250 30.240 1.00 0.00 O flip ATOM 351 ND2 ASN A 22 7.408 19.050 32.410 1.00 0.00 N flip ATOM 0 H ASN A 22 8.827 23.348 30.898 1.00 0.00 H new ATOM 0 HA ASN A 22 10.074 20.939 32.229 1.00 0.00 H new ATOM 0 HB2 ASN A 22 7.660 21.582 32.556 1.00 0.00 H new ATOM 0 HB3 ASN A 22 7.472 21.800 30.827 1.00 0.00 H new ATOM 0 HD21 ASN A 22 7.406 19.458 33.345 1.00 0.00 H new ATOM 0 HD22 ASN A 22 7.190 18.062 32.284 1.00 0.00 H new ATOM 358 N ALA A 23 10.156 21.742 29.186 1.00 0.00 N ATOM 359 CA ALA A 23 10.711 21.308 27.886 1.00 0.00 C ATOM 360 C ALA A 23 12.148 21.800 27.813 1.00 0.00 C ATOM 361 O ALA A 23 12.912 21.486 26.893 1.00 0.00 O ATOM 362 CB ALA A 23 9.879 21.998 26.821 1.00 0.00 C ATOM 0 H ALA A 23 9.936 22.735 29.257 1.00 0.00 H new ATOM 0 HA ALA A 23 10.689 20.226 27.755 1.00 0.00 H new ATOM 0 HB1 ALA A 23 10.244 21.714 25.834 1.00 0.00 H new ATOM 0 HB2 ALA A 23 8.836 21.697 26.923 1.00 0.00 H new ATOM 0 HB3 ALA A 23 9.958 23.079 26.941 1.00 0.00 H new ATOM 368 N ASP A 24 12.517 22.561 28.801 1.00 0.00 N ATOM 369 CA ASP A 24 13.878 23.106 28.880 1.00 0.00 C ATOM 370 C ASP A 24 14.780 21.959 29.309 1.00 0.00 C ATOM 371 O ASP A 24 14.496 21.291 30.283 1.00 0.00 O ATOM 372 CB ASP A 24 13.753 24.185 29.971 1.00 0.00 C ATOM 373 CG ASP A 24 14.885 25.203 29.872 1.00 0.00 C ATOM 374 OD1 ASP A 24 15.608 25.155 28.904 1.00 0.00 O ATOM 375 OD2 ASP A 24 14.997 26.023 30.768 1.00 0.00 O ATOM 0 H ASP A 24 11.908 22.830 29.574 1.00 0.00 H new ATOM 0 HA ASP A 24 14.286 23.523 27.959 1.00 0.00 H new ATOM 0 HB2 ASP A 24 12.794 24.693 29.875 1.00 0.00 H new ATOM 0 HB3 ASP A 24 13.768 23.715 30.954 1.00 0.00 H new ATOM 380 N GLY A 25 15.819 21.675 28.584 1.00 0.00 N ATOM 381 CA GLY A 25 16.688 20.502 28.955 1.00 0.00 C ATOM 382 C GLY A 25 16.301 19.346 28.030 1.00 0.00 C ATOM 383 O GLY A 25 17.132 18.534 27.630 1.00 0.00 O ATOM 0 H GLY A 25 16.113 22.192 27.755 1.00 0.00 H new ATOM 0 HA2 GLY A 25 17.743 20.752 28.839 1.00 0.00 H new ATOM 0 HA3 GLY A 25 16.539 20.227 29.999 1.00 0.00 H new ATOM 387 N GLU A 26 15.041 19.280 27.669 1.00 0.00 N ATOM 388 CA GLU A 26 14.565 18.217 26.758 1.00 0.00 C ATOM 389 C GLU A 26 14.968 18.556 25.323 1.00 0.00 C ATOM 390 O GLU A 26 15.459 17.708 24.582 1.00 0.00 O ATOM 391 CB GLU A 26 13.041 18.219 26.898 1.00 0.00 C ATOM 392 CG GLU A 26 12.469 16.932 26.302 1.00 0.00 C ATOM 393 CD GLU A 26 12.838 15.746 27.196 1.00 0.00 C ATOM 394 OE1 GLU A 26 12.135 15.521 28.167 1.00 0.00 O ATOM 395 OE2 GLU A 26 13.817 15.085 26.894 1.00 0.00 O ATOM 0 H GLU A 26 14.320 19.932 27.977 1.00 0.00 H new ATOM 0 HA GLU A 26 14.990 17.242 26.997 1.00 0.00 H new ATOM 0 HB2 GLU A 26 12.762 18.300 27.949 1.00 0.00 H new ATOM 0 HB3 GLU A 26 12.620 19.086 26.389 1.00 0.00 H new ATOM 0 HG2 GLU A 26 11.385 17.010 26.213 1.00 0.00 H new ATOM 0 HG3 GLU A 26 12.861 16.779 25.297 1.00 0.00 H new ATOM 402 N PHE A 27 14.771 19.786 24.918 1.00 0.00 N ATOM 403 CA PHE A 27 15.154 20.185 23.526 1.00 0.00 C ATOM 404 C PHE A 27 15.585 21.640 23.476 1.00 0.00 C ATOM 405 O PHE A 27 15.403 22.413 24.414 1.00 0.00 O ATOM 406 CB PHE A 27 13.915 20.007 22.643 1.00 0.00 C ATOM 407 CG PHE A 27 12.901 21.112 22.898 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.118 22.418 22.417 1.00 0.00 C ATOM 409 CD2 PHE A 27 11.735 20.819 23.605 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.164 23.416 22.658 1.00 0.00 C ATOM 411 CE2 PHE A 27 10.779 21.819 23.840 1.00 0.00 C ATOM 412 CZ PHE A 27 10.995 23.112 23.369 1.00 0.00 C ATOM 0 H PHE A 27 14.364 20.528 25.487 1.00 0.00 H new ATOM 0 HA PHE A 27 15.987 19.571 23.185 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.208 20.013 21.593 1.00 0.00 H new ATOM 0 HB3 PHE A 27 13.459 19.037 22.841 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.017 22.650 21.864 1.00 0.00 H new ATOM 0 HD2 PHE A 27 11.567 19.818 23.973 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.330 24.420 22.296 1.00 0.00 H new ATOM 0 HE2 PHE A 27 9.876 21.586 24.386 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.260 23.882 23.552 1.00 0.00 H new ATOM 422 N VAL A 28 16.106 22.016 22.360 1.00 0.00 N ATOM 423 CA VAL A 28 16.525 23.421 22.138 1.00 0.00 C ATOM 424 C VAL A 28 15.887 23.874 20.857 1.00 0.00 C ATOM 425 O VAL A 28 15.298 23.078 20.134 1.00 0.00 O ATOM 426 CB VAL A 28 18.045 23.418 21.965 1.00 0.00 C ATOM 427 CG1 VAL A 28 18.613 22.114 22.485 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.421 23.531 20.492 1.00 0.00 C ATOM 0 H VAL A 28 16.266 21.396 21.566 1.00 0.00 H new ATOM 0 HA VAL A 28 16.237 24.074 22.962 1.00 0.00 H new ATOM 0 HB VAL A 28 18.447 24.268 22.517 1.00 0.00 H new ATOM 0 HG11 VAL A 28 19.696 22.114 22.361 1.00 0.00 H new ATOM 0 HG12 VAL A 28 18.369 22.007 23.542 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.184 21.282 21.927 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.506 23.527 20.392 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.003 22.687 19.944 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.023 24.460 20.085 1.00 0.00 H new ATOM 438 N PHE A 29 16.050 25.099 20.516 1.00 0.00 N ATOM 439 CA PHE A 29 15.504 25.526 19.222 1.00 0.00 C ATOM 440 C PHE A 29 16.491 26.453 18.555 1.00 0.00 C ATOM 441 O PHE A 29 16.903 27.473 19.098 1.00 0.00 O ATOM 442 CB PHE A 29 14.121 26.113 19.487 1.00 0.00 C ATOM 443 CG PHE A 29 14.105 27.632 19.604 1.00 0.00 C ATOM 444 CD1 PHE A 29 14.023 28.430 18.454 1.00 0.00 C ATOM 445 CD2 PHE A 29 14.084 28.236 20.870 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.934 29.826 18.572 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.984 29.631 20.981 1.00 0.00 C ATOM 448 CZ PHE A 29 13.909 30.424 19.833 1.00 0.00 C ATOM 0 H PHE A 29 16.528 25.815 21.063 1.00 0.00 H new ATOM 0 HA PHE A 29 15.366 24.709 18.514 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.450 25.814 18.682 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.726 25.684 20.408 1.00 0.00 H new ATOM 0 HD1 PHE A 29 14.028 27.970 17.477 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.145 27.627 21.760 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.885 30.439 17.684 1.00 0.00 H new ATOM 0 HE2 PHE A 29 13.965 30.093 21.957 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.832 31.498 19.921 1.00 0.00 H new ATOM 458 N ALA A 30 16.927 26.041 17.409 1.00 0.00 N ATOM 459 CA ALA A 30 17.977 26.799 16.676 1.00 0.00 C ATOM 460 C ALA A 30 17.417 27.722 15.606 1.00 0.00 C ATOM 461 O ALA A 30 16.890 27.290 14.584 1.00 0.00 O ATOM 462 CB ALA A 30 18.854 25.728 16.031 1.00 0.00 C ATOM 0 H ALA A 30 16.599 25.199 16.937 1.00 0.00 H new ATOM 0 HA ALA A 30 18.518 27.452 17.361 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.657 26.205 15.469 1.00 0.00 H new ATOM 0 HB2 ALA A 30 19.282 25.093 16.806 1.00 0.00 H new ATOM 0 HB3 ALA A 30 18.250 25.121 15.357 1.00 0.00 H new ATOM 468 N VAL A 31 17.573 28.992 15.819 1.00 0.00 N ATOM 469 CA VAL A 31 17.114 29.990 14.825 1.00 0.00 C ATOM 470 C VAL A 31 18.271 30.237 13.838 1.00 0.00 C ATOM 471 O VAL A 31 19.247 30.923 14.154 1.00 0.00 O ATOM 472 CB VAL A 31 16.820 31.247 15.644 1.00 0.00 C ATOM 473 CG1 VAL A 31 15.889 32.162 14.863 1.00 0.00 C ATOM 474 CG2 VAL A 31 16.147 30.871 16.958 1.00 0.00 C ATOM 0 H VAL A 31 18.006 29.387 16.654 1.00 0.00 H new ATOM 0 HA VAL A 31 16.239 29.679 14.255 1.00 0.00 H new ATOM 0 HB VAL A 31 17.761 31.758 15.848 1.00 0.00 H new ATOM 0 HG11 VAL A 31 15.682 33.057 15.450 1.00 0.00 H new ATOM 0 HG12 VAL A 31 16.362 32.446 13.923 1.00 0.00 H new ATOM 0 HG13 VAL A 31 14.955 31.640 14.656 1.00 0.00 H new ATOM 0 HG21 VAL A 31 15.942 31.774 17.533 1.00 0.00 H new ATOM 0 HG22 VAL A 31 15.211 30.352 16.752 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.806 30.218 17.530 1.00 0.00 H new ATOM 484 N ARG A 32 18.183 29.669 12.665 1.00 0.00 N ATOM 485 CA ARG A 32 19.258 29.830 11.640 1.00 0.00 C ATOM 486 C ARG A 32 19.393 31.280 11.199 1.00 0.00 C ATOM 487 O ARG A 32 20.411 31.701 10.653 1.00 0.00 O ATOM 488 CB ARG A 32 18.732 29.045 10.455 1.00 0.00 C ATOM 489 CG ARG A 32 19.003 27.552 10.641 1.00 0.00 C ATOM 490 CD ARG A 32 18.437 26.774 9.450 1.00 0.00 C ATOM 491 NE ARG A 32 16.954 26.828 9.615 1.00 0.00 N ATOM 492 CZ ARG A 32 16.163 26.298 8.714 1.00 0.00 C ATOM 493 NH1 ARG A 32 16.655 25.713 7.652 1.00 0.00 N ATOM 494 NH2 ARG A 32 14.869 26.357 8.877 1.00 0.00 N ATOM 0 H ARG A 32 17.398 29.090 12.368 1.00 0.00 H new ATOM 0 HA ARG A 32 20.226 29.506 12.022 1.00 0.00 H new ATOM 0 HB2 ARG A 32 17.661 29.216 10.344 1.00 0.00 H new ATOM 0 HB3 ARG A 32 19.207 29.396 9.539 1.00 0.00 H new ATOM 0 HG2 ARG A 32 20.075 27.375 10.727 1.00 0.00 H new ATOM 0 HG3 ARG A 32 18.546 27.202 11.567 1.00 0.00 H new ATOM 0 HD2 ARG A 32 18.744 27.222 8.505 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.795 25.745 9.446 1.00 0.00 H new ATOM 0 HE ARG A 32 16.553 27.281 10.436 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.665 25.665 7.518 1.00 0.00 H new ATOM 0 HH12 ARG A 32 16.029 25.304 6.958 1.00 0.00 H new ATOM 0 HH21 ARG A 32 14.479 26.814 9.702 1.00 0.00 H new ATOM 0 HH22 ARG A 32 14.248 25.947 8.180 1.00 0.00 H new ATOM 508 N THR A 33 18.376 32.036 11.427 1.00 0.00 N ATOM 509 CA THR A 33 18.394 33.472 11.032 1.00 0.00 C ATOM 510 C THR A 33 19.438 34.202 11.865 1.00 0.00 C ATOM 511 O THR A 33 20.053 35.174 11.429 1.00 0.00 O ATOM 512 CB THR A 33 16.982 33.982 11.342 1.00 0.00 C ATOM 513 OG1 THR A 33 16.732 35.166 10.597 1.00 0.00 O ATOM 514 CG2 THR A 33 16.839 34.285 12.838 1.00 0.00 C ATOM 0 H THR A 33 17.515 31.725 11.877 1.00 0.00 H new ATOM 0 HA THR A 33 18.649 33.629 9.984 1.00 0.00 H new ATOM 0 HB THR A 33 16.262 33.211 11.067 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.829 35.492 10.793 1.00 0.00 H new ATOM 0 HG21 THR A 33 15.831 34.646 13.041 1.00 0.00 H new ATOM 0 HG22 THR A 33 17.022 33.377 13.412 1.00 0.00 H new ATOM 0 HG23 THR A 33 17.562 35.048 13.125 1.00 0.00 H new ATOM 522 N THR A 34 19.643 33.738 13.060 1.00 0.00 N ATOM 523 CA THR A 34 20.652 34.385 13.950 1.00 0.00 C ATOM 524 C THR A 34 21.747 33.386 14.333 1.00 0.00 C ATOM 525 O THR A 34 22.656 33.701 15.098 1.00 0.00 O ATOM 526 CB THR A 34 19.869 34.828 15.186 1.00 0.00 C ATOM 527 OG1 THR A 34 20.754 35.436 16.115 1.00 0.00 O ATOM 528 CG2 THR A 34 19.198 33.618 15.830 1.00 0.00 C ATOM 0 H THR A 34 19.157 32.937 13.465 1.00 0.00 H new ATOM 0 HA THR A 34 21.150 35.223 13.463 1.00 0.00 H new ATOM 0 HB THR A 34 19.104 35.547 14.892 1.00 0.00 H new ATOM 0 HG1 THR A 34 21.664 35.107 15.963 1.00 0.00 H new ATOM 0 HG21 THR A 34 18.641 33.937 16.711 1.00 0.00 H new ATOM 0 HG22 THR A 34 18.515 33.157 15.116 1.00 0.00 H new ATOM 0 HG23 THR A 34 19.958 32.894 16.124 1.00 0.00 H new ATOM 536 N GLY A 35 21.680 32.186 13.818 1.00 0.00 N ATOM 537 CA GLY A 35 22.716 31.174 14.151 1.00 0.00 C ATOM 538 C GLY A 35 22.708 30.905 15.657 1.00 0.00 C ATOM 539 O GLY A 35 23.750 30.658 16.260 1.00 0.00 O ATOM 0 H GLY A 35 20.950 31.866 13.181 1.00 0.00 H new ATOM 0 HA2 GLY A 35 22.524 30.250 13.606 1.00 0.00 H new ATOM 0 HA3 GLY A 35 23.699 31.529 13.840 1.00 0.00 H new ATOM 543 N ILE A 36 21.557 30.935 16.277 1.00 0.00 N ATOM 544 CA ILE A 36 21.502 30.665 17.750 1.00 0.00 C ATOM 545 C ILE A 36 20.534 29.523 18.014 1.00 0.00 C ATOM 546 O ILE A 36 19.696 29.189 17.184 1.00 0.00 O ATOM 547 CB ILE A 36 20.917 31.929 18.407 1.00 0.00 C ATOM 548 CG1 ILE A 36 21.892 33.096 18.333 1.00 0.00 C ATOM 549 CG2 ILE A 36 20.621 31.657 19.899 1.00 0.00 C ATOM 550 CD1 ILE A 36 21.215 34.310 18.974 1.00 0.00 C ATOM 0 H ILE A 36 20.659 31.132 15.835 1.00 0.00 H new ATOM 0 HA ILE A 36 22.490 30.413 18.136 1.00 0.00 H new ATOM 0 HB ILE A 36 20.005 32.183 17.867 1.00 0.00 H new ATOM 0 HG12 ILE A 36 22.818 32.854 18.855 1.00 0.00 H new ATOM 0 HG13 ILE A 36 22.156 33.308 17.297 1.00 0.00 H new ATOM 0 HG21 ILE A 36 20.207 32.555 20.358 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.902 30.842 19.985 1.00 0.00 H new ATOM 0 HG23 ILE A 36 21.544 31.382 20.409 1.00 0.00 H new ATOM 0 HD11 ILE A 36 21.890 35.165 18.936 1.00 0.00 H new ATOM 0 HD12 ILE A 36 20.300 34.546 18.430 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.972 34.085 20.012 1.00 0.00 H new ATOM 562 N PHE A 37 20.582 28.980 19.188 1.00 0.00 N ATOM 563 CA PHE A 37 19.613 27.928 19.563 1.00 0.00 C ATOM 564 C PHE A 37 19.347 28.056 21.050 1.00 0.00 C ATOM 565 O PHE A 37 20.247 27.938 21.881 1.00 0.00 O ATOM 566 CB PHE A 37 20.215 26.576 19.177 1.00 0.00 C ATOM 567 CG PHE A 37 21.125 26.049 20.247 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.571 25.413 21.357 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.511 26.149 20.110 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.394 24.880 22.339 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.339 25.603 21.090 1.00 0.00 C ATOM 572 CZ PHE A 37 22.776 24.966 22.206 1.00 0.00 C ATOM 0 H PHE A 37 21.258 29.222 19.912 1.00 0.00 H new ATOM 0 HA PHE A 37 18.659 28.024 19.044 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.414 25.860 18.995 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.770 26.678 18.244 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.498 25.335 21.453 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.938 26.646 19.251 1.00 0.00 H new ATOM 0 HE1 PHE A 37 20.962 24.399 23.205 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.412 25.670 20.990 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.417 24.541 22.964 1.00 0.00 H new ATOM 596 N ARG A 39 16.573 27.577 24.577 1.00 0.00 N ATOM 597 CA ARG A 39 15.704 26.596 25.201 1.00 0.00 C ATOM 598 C ARG A 39 14.276 27.084 24.992 1.00 0.00 C ATOM 599 O ARG A 39 14.071 28.134 24.387 1.00 0.00 O ATOM 600 CB ARG A 39 16.138 26.635 26.651 1.00 0.00 C ATOM 601 CG ARG A 39 17.199 25.551 26.883 1.00 0.00 C ATOM 602 CD ARG A 39 18.589 26.183 26.804 1.00 0.00 C ATOM 603 NE ARG A 39 19.306 25.721 28.028 1.00 0.00 N ATOM 604 CZ ARG A 39 18.933 26.125 29.220 1.00 0.00 C ATOM 605 NH1 ARG A 39 17.922 26.944 29.371 1.00 0.00 N ATOM 606 NH2 ARG A 39 19.582 25.710 30.273 1.00 0.00 N ATOM 0 HA ARG A 39 15.756 25.579 24.812 1.00 0.00 H new ATOM 0 HB2 ARG A 39 16.543 27.617 26.897 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.282 26.470 27.305 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.053 25.085 27.858 1.00 0.00 H new ATOM 0 HG3 ARG A 39 17.101 24.764 26.136 1.00 0.00 H new ATOM 0 HD2 ARG A 39 19.112 25.869 25.901 1.00 0.00 H new ATOM 0 HD3 ARG A 39 18.525 27.271 26.774 1.00 0.00 H new ATOM 0 HE ARG A 39 20.096 25.083 27.937 1.00 0.00 H new ATOM 0 HH11 ARG A 39 17.410 27.278 28.555 1.00 0.00 H new ATOM 0 HH12 ARG A 39 17.646 27.247 30.305 1.00 0.00 H new ATOM 0 HH21 ARG A 39 20.374 25.076 30.167 1.00 0.00 H new ATOM 0 HH22 ARG A 39 19.298 26.020 31.202 1.00 0.00 H new ATOM 620 N PRO A 40 13.326 26.333 25.444 1.00 0.00 N ATOM 621 CA PRO A 40 11.922 26.734 25.234 1.00 0.00 C ATOM 622 C PRO A 40 11.551 27.994 26.023 1.00 0.00 C ATOM 623 O PRO A 40 10.547 28.640 25.737 1.00 0.00 O ATOM 624 CB PRO A 40 11.128 25.536 25.738 1.00 0.00 C ATOM 625 CG PRO A 40 12.044 24.854 26.698 1.00 0.00 C ATOM 626 CD PRO A 40 13.440 25.073 26.181 1.00 0.00 C ATOM 0 HA PRO A 40 11.723 26.983 24.192 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.205 25.849 26.225 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.847 24.874 24.919 1.00 0.00 H new ATOM 0 HG2 PRO A 40 11.932 25.266 27.701 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.816 23.790 26.763 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.164 25.145 26.993 1.00 0.00 H new ATOM 0 HD3 PRO A 40 13.764 24.256 25.536 1.00 0.00 H new ATOM 634 N SER A 41 12.290 28.333 27.035 1.00 0.00 N ATOM 635 CA SER A 41 11.918 29.505 27.844 1.00 0.00 C ATOM 636 C SER A 41 12.933 30.665 27.739 1.00 0.00 C ATOM 637 O SER A 41 13.097 31.435 28.684 1.00 0.00 O ATOM 638 CB SER A 41 11.808 28.923 29.250 1.00 0.00 C ATOM 639 OG SER A 41 13.086 28.928 29.873 1.00 0.00 O ATOM 0 H SER A 41 13.135 27.845 27.333 1.00 0.00 H new ATOM 0 HA SER A 41 10.994 29.976 27.509 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.102 29.507 29.841 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.420 27.906 29.203 1.00 0.00 H new ATOM 0 HG SER A 41 13.011 28.555 30.776 1.00 0.00 H new ATOM 645 N CYS A 42 13.601 30.827 26.611 1.00 0.00 N ATOM 646 CA CYS A 42 14.571 31.961 26.468 1.00 0.00 C ATOM 647 C CYS A 42 13.915 33.270 26.897 1.00 0.00 C ATOM 648 O CYS A 42 12.759 33.550 26.590 1.00 0.00 O ATOM 649 CB CYS A 42 14.941 32.045 24.990 1.00 0.00 C ATOM 650 SG CYS A 42 16.144 33.391 24.763 1.00 0.00 S ATOM 0 H CYS A 42 13.514 30.225 25.792 1.00 0.00 H new ATOM 0 HA CYS A 42 15.450 31.796 27.091 1.00 0.00 H new ATOM 0 HB2 CYS A 42 15.365 31.099 24.653 1.00 0.00 H new ATOM 0 HB3 CYS A 42 14.051 32.228 24.388 1.00 0.00 H new ATOM 0 HG CYS A 42 17.304 33.017 25.215 1.00 0.00 H new ATOM 655 N ARG A 43 14.643 34.058 27.611 1.00 0.00 N ATOM 656 CA ARG A 43 14.107 35.362 28.100 1.00 0.00 C ATOM 657 C ARG A 43 14.595 36.550 27.258 1.00 0.00 C ATOM 658 O ARG A 43 14.355 37.702 27.616 1.00 0.00 O ATOM 659 CB ARG A 43 14.634 35.477 29.529 1.00 0.00 C ATOM 660 CG ARG A 43 16.163 35.594 29.514 1.00 0.00 C ATOM 661 CD ARG A 43 16.573 37.003 29.954 1.00 0.00 C ATOM 662 NE ARG A 43 17.063 37.677 28.714 1.00 0.00 N ATOM 663 CZ ARG A 43 17.653 38.846 28.781 1.00 0.00 C ATOM 664 NH1 ARG A 43 17.825 39.442 29.935 1.00 0.00 N ATOM 665 NH2 ARG A 43 18.076 39.421 27.689 1.00 0.00 N ATOM 0 H ARG A 43 15.605 33.860 27.887 1.00 0.00 H new ATOM 0 HA ARG A 43 13.019 35.389 28.037 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.199 36.349 30.017 1.00 0.00 H new ATOM 0 HB3 ARG A 43 14.333 34.604 30.108 1.00 0.00 H new ATOM 0 HG2 ARG A 43 16.602 34.851 30.181 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.544 35.389 28.514 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.729 37.541 30.387 1.00 0.00 H new ATOM 0 HD3 ARG A 43 17.352 36.966 30.716 1.00 0.00 H new ATOM 0 HE ARG A 43 16.938 37.224 27.809 1.00 0.00 H new ATOM 0 HH11 ARG A 43 17.499 38.997 30.793 1.00 0.00 H new ATOM 0 HH12 ARG A 43 18.285 40.351 29.976 1.00 0.00 H new ATOM 0 HH21 ARG A 43 17.947 38.961 26.788 1.00 0.00 H new ATOM 0 HH22 ARG A 43 18.535 40.330 27.737 1.00 0.00 H new ATOM 679 N ALA A 44 15.305 36.323 26.183 1.00 0.00 N ATOM 680 CA ALA A 44 15.818 37.494 25.402 1.00 0.00 C ATOM 681 C ALA A 44 14.818 37.963 24.344 1.00 0.00 C ATOM 682 O ALA A 44 14.479 39.141 24.276 1.00 0.00 O ATOM 683 CB ALA A 44 17.094 36.984 24.738 1.00 0.00 C ATOM 0 H ALA A 44 15.549 35.403 25.817 1.00 0.00 H new ATOM 0 HA ALA A 44 15.989 38.356 26.047 1.00 0.00 H new ATOM 0 HB1 ALA A 44 17.538 37.782 24.143 1.00 0.00 H new ATOM 0 HB2 ALA A 44 17.801 36.667 25.504 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.855 36.139 24.092 1.00 0.00 H new ATOM 689 N ARG A 45 14.335 37.064 23.539 1.00 0.00 N ATOM 690 CA ARG A 45 13.341 37.424 22.470 1.00 0.00 C ATOM 691 C ARG A 45 13.172 36.185 21.565 1.00 0.00 C ATOM 692 O ARG A 45 13.771 35.143 21.830 1.00 0.00 O ATOM 693 CB ARG A 45 13.948 38.624 21.701 1.00 0.00 C ATOM 694 CG ARG A 45 12.834 39.389 20.962 1.00 0.00 C ATOM 695 CD ARG A 45 13.367 40.691 20.314 1.00 0.00 C ATOM 696 NE ARG A 45 14.488 41.193 21.176 1.00 0.00 N ATOM 697 CZ ARG A 45 14.247 41.731 22.345 1.00 0.00 C ATOM 698 NH1 ARG A 45 13.023 41.845 22.791 1.00 0.00 N ATOM 699 NH2 ARG A 45 15.243 42.156 23.071 1.00 0.00 N ATOM 0 H ARG A 45 14.585 36.076 23.569 1.00 0.00 H new ATOM 0 HA ARG A 45 12.360 37.702 22.856 1.00 0.00 H new ATOM 0 HB2 ARG A 45 14.460 39.290 22.395 1.00 0.00 H new ATOM 0 HB3 ARG A 45 14.694 38.271 20.988 1.00 0.00 H new ATOM 0 HG2 ARG A 45 12.402 38.750 20.192 1.00 0.00 H new ATOM 0 HG3 ARG A 45 12.033 39.631 21.661 1.00 0.00 H new ATOM 0 HD2 ARG A 45 13.718 40.500 19.300 1.00 0.00 H new ATOM 0 HD3 ARG A 45 12.575 41.436 20.242 1.00 0.00 H new ATOM 0 HE ARG A 45 15.450 41.114 20.847 1.00 0.00 H new ATOM 0 HH11 ARG A 45 12.241 41.513 22.226 1.00 0.00 H new ATOM 0 HH12 ARG A 45 12.850 42.266 23.704 1.00 0.00 H new ATOM 0 HH21 ARG A 45 16.199 42.068 22.727 1.00 0.00 H new ATOM 0 HH22 ARG A 45 15.066 42.577 23.983 1.00 0.00 H new ATOM 713 N HIS A 46 12.363 36.237 20.531 1.00 0.00 N ATOM 714 CA HIS A 46 12.179 35.016 19.679 1.00 0.00 C ATOM 715 C HIS A 46 12.127 35.305 18.188 1.00 0.00 C ATOM 716 O HIS A 46 11.779 36.391 17.745 1.00 0.00 O ATOM 717 CB HIS A 46 10.831 34.462 20.077 1.00 0.00 C ATOM 718 CG HIS A 46 10.994 33.487 21.184 1.00 0.00 C ATOM 719 ND1 HIS A 46 11.105 33.637 22.537 1.00 0.00 N flip ATOM 720 CD2 HIS A 46 10.997 32.133 20.944 1.00 0.00 C flip ATOM 721 CE1 HIS A 46 11.160 32.387 23.136 1.00 0.00 C flip ATOM 722 NE2 HIS A 46 11.086 31.523 22.122 1.00 0.00 N flip ATOM 0 H HIS A 46 11.830 37.058 20.243 1.00 0.00 H new ATOM 0 HA HIS A 46 13.024 34.346 19.836 1.00 0.00 H new ATOM 0 HB2 HIS A 46 10.172 35.273 20.388 1.00 0.00 H new ATOM 0 HB3 HIS A 46 10.359 33.979 19.221 1.00 0.00 H new ATOM 0 HD1 HIS A 46 11.142 34.529 23.030 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.938 31.654 19.978 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.244 32.163 24.189 1.00 0.00 H new ATOM 730 N ALA A 47 12.404 34.289 17.419 1.00 0.00 N ATOM 731 CA ALA A 47 12.336 34.391 15.942 1.00 0.00 C ATOM 732 C ALA A 47 11.313 33.377 15.417 1.00 0.00 C ATOM 733 O ALA A 47 11.001 32.390 16.080 1.00 0.00 O ATOM 734 CB ALA A 47 13.742 34.060 15.449 1.00 0.00 C ATOM 0 H ALA A 47 12.681 33.371 17.766 1.00 0.00 H new ATOM 0 HA ALA A 47 12.024 35.377 15.597 1.00 0.00 H new ATOM 0 HB1 ALA A 47 13.768 34.116 14.361 1.00 0.00 H new ATOM 0 HB2 ALA A 47 14.451 34.775 15.866 1.00 0.00 H new ATOM 0 HB3 ALA A 47 14.012 33.053 15.768 1.00 0.00 H new ATOM 740 N LEU A 48 10.762 33.615 14.260 1.00 0.00 N ATOM 741 CA LEU A 48 9.737 32.696 13.707 1.00 0.00 C ATOM 742 C LEU A 48 10.222 31.240 13.654 1.00 0.00 C ATOM 743 O LEU A 48 11.418 30.956 13.648 1.00 0.00 O ATOM 744 CB LEU A 48 9.462 33.213 12.295 1.00 0.00 C ATOM 745 CG LEU A 48 8.777 34.579 12.373 1.00 0.00 C ATOM 746 CD1 LEU A 48 9.258 35.459 11.217 1.00 0.00 C ATOM 747 CD2 LEU A 48 7.261 34.394 12.274 1.00 0.00 C ATOM 0 H LEU A 48 10.983 34.417 13.670 1.00 0.00 H new ATOM 0 HA LEU A 48 8.847 32.686 14.337 1.00 0.00 H new ATOM 0 HB2 LEU A 48 10.396 33.294 11.738 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.830 32.508 11.755 1.00 0.00 H new ATOM 0 HG LEU A 48 9.026 35.056 13.321 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.770 36.432 11.273 1.00 0.00 H new ATOM 0 HD12 LEU A 48 10.338 35.590 11.285 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.009 34.982 10.269 1.00 0.00 H new ATOM 0 HD21 LEU A 48 6.771 35.366 12.329 1.00 0.00 H new ATOM 0 HD22 LEU A 48 7.014 33.917 11.326 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.917 33.767 13.096 1.00 0.00 H new ATOM 759 N ARG A 49 9.294 30.317 13.587 1.00 0.00 N ATOM 760 CA ARG A 49 9.645 28.863 13.501 1.00 0.00 C ATOM 761 C ARG A 49 10.440 28.604 12.236 1.00 0.00 C ATOM 762 O ARG A 49 11.277 27.708 12.149 1.00 0.00 O ATOM 763 CB ARG A 49 8.296 28.194 13.351 1.00 0.00 C ATOM 764 CG ARG A 49 8.396 26.719 13.742 1.00 0.00 C ATOM 765 CD ARG A 49 7.955 26.543 15.192 1.00 0.00 C ATOM 766 NE ARG A 49 6.829 25.562 15.139 1.00 0.00 N ATOM 767 CZ ARG A 49 5.594 25.958 14.937 1.00 0.00 C ATOM 768 NH1 ARG A 49 5.307 27.224 14.776 1.00 0.00 N ATOM 769 NH2 ARG A 49 4.636 25.073 14.896 1.00 0.00 N ATOM 0 H ARG A 49 8.293 30.512 13.588 1.00 0.00 H new ATOM 0 HA ARG A 49 10.230 28.515 14.353 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.560 28.696 13.979 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.949 28.283 12.321 1.00 0.00 H new ATOM 0 HG2 ARG A 49 7.770 26.115 13.085 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.420 26.368 13.618 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.772 26.172 15.811 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.633 27.490 15.624 1.00 0.00 H new ATOM 0 HE ARG A 49 7.023 24.568 15.262 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.049 27.923 14.806 1.00 0.00 H new ATOM 0 HH12 ARG A 49 4.341 27.512 14.620 1.00 0.00 H new ATOM 0 HH21 ARG A 49 4.850 24.084 15.020 1.00 0.00 H new ATOM 0 HH22 ARG A 49 3.673 25.371 14.740 1.00 0.00 H new ATOM 783 N GLU A 50 10.151 29.391 11.256 1.00 0.00 N ATOM 784 CA GLU A 50 10.796 29.301 9.928 1.00 0.00 C ATOM 785 C GLU A 50 12.278 28.975 10.044 1.00 0.00 C ATOM 786 O GLU A 50 12.759 27.944 9.578 1.00 0.00 O ATOM 787 CB GLU A 50 10.614 30.712 9.409 1.00 0.00 C ATOM 788 CG GLU A 50 10.859 30.738 7.929 1.00 0.00 C ATOM 789 CD GLU A 50 12.358 30.679 7.626 1.00 0.00 C ATOM 790 OE1 GLU A 50 12.966 31.733 7.544 1.00 0.00 O ATOM 791 OE2 GLU A 50 12.871 29.582 7.476 1.00 0.00 O ATOM 0 H GLU A 50 9.456 30.134 11.324 1.00 0.00 H new ATOM 0 HA GLU A 50 10.377 28.520 9.294 1.00 0.00 H new ATOM 0 HB2 GLU A 50 9.606 31.064 9.627 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.304 31.388 9.914 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.354 29.895 7.457 1.00 0.00 H new ATOM 0 HG3 GLU A 50 10.432 31.645 7.501 1.00 0.00 H new ATOM 798 N ASN A 51 12.993 29.847 10.669 1.00 0.00 N ATOM 799 CA ASN A 51 14.452 29.640 10.856 1.00 0.00 C ATOM 800 C ASN A 51 14.688 28.968 12.194 1.00 0.00 C ATOM 801 O ASN A 51 15.779 28.993 12.731 1.00 0.00 O ATOM 802 CB ASN A 51 15.031 31.051 10.903 1.00 0.00 C ATOM 803 CG ASN A 51 14.821 31.751 9.562 1.00 0.00 C ATOM 804 OD1 ASN A 51 15.303 31.293 8.529 1.00 0.00 O ATOM 805 ND2 ASN A 51 14.118 32.851 9.528 1.00 0.00 N ATOM 0 H ASN A 51 12.628 30.712 11.068 1.00 0.00 H new ATOM 0 HA ASN A 51 14.896 29.024 10.074 1.00 0.00 H new ATOM 0 HB2 ASN A 51 14.553 31.622 11.699 1.00 0.00 H new ATOM 0 HB3 ASN A 51 16.095 31.008 11.137 1.00 0.00 H new ATOM 0 HD21 ASN A 51 13.968 33.333 8.642 1.00 0.00 H new ATOM 0 HD22 ASN A 51 13.719 33.228 10.388 1.00 0.00 H new ATOM 812 N VAL A 52 13.675 28.393 12.751 1.00 0.00 N ATOM 813 CA VAL A 52 13.826 27.755 14.081 1.00 0.00 C ATOM 814 C VAL A 52 13.615 26.234 14.008 1.00 0.00 C ATOM 815 O VAL A 52 12.590 25.750 13.531 1.00 0.00 O ATOM 816 CB VAL A 52 12.737 28.435 14.914 1.00 0.00 C ATOM 817 CG1 VAL A 52 12.216 27.493 15.993 1.00 0.00 C ATOM 818 CG2 VAL A 52 13.314 29.684 15.584 1.00 0.00 C ATOM 0 H VAL A 52 12.742 28.334 12.344 1.00 0.00 H new ATOM 0 HA VAL A 52 14.824 27.876 14.501 1.00 0.00 H new ATOM 0 HB VAL A 52 11.915 28.706 14.252 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.443 27.997 16.573 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.797 26.602 15.526 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.035 27.206 16.652 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.539 30.169 16.178 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.143 29.399 16.232 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.672 30.374 14.820 1.00 0.00 H new ATOM 828 N SER A 53 14.558 25.481 14.509 1.00 0.00 N ATOM 829 CA SER A 53 14.428 24.000 14.518 1.00 0.00 C ATOM 830 C SER A 53 14.619 23.507 15.949 1.00 0.00 C ATOM 831 O SER A 53 14.889 24.295 16.847 1.00 0.00 O ATOM 832 CB SER A 53 15.541 23.484 13.611 1.00 0.00 C ATOM 833 OG SER A 53 16.723 24.243 13.833 1.00 0.00 O ATOM 0 H SER A 53 15.423 25.837 14.917 1.00 0.00 H new ATOM 0 HA SER A 53 13.455 23.654 14.169 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.730 22.430 13.813 1.00 0.00 H new ATOM 0 HB3 SER A 53 15.238 23.560 12.567 1.00 0.00 H new ATOM 0 HG SER A 53 17.439 23.911 13.252 1.00 0.00 H new ATOM 839 N PHE A 54 14.449 22.238 16.194 1.00 0.00 N ATOM 840 CA PHE A 54 14.582 21.730 17.565 1.00 0.00 C ATOM 841 C PHE A 54 15.666 20.666 17.663 1.00 0.00 C ATOM 842 O PHE A 54 15.952 19.933 16.719 1.00 0.00 O ATOM 843 CB PHE A 54 13.216 21.150 17.848 1.00 0.00 C ATOM 844 CG PHE A 54 12.213 22.262 17.718 1.00 0.00 C ATOM 845 CD1 PHE A 54 11.904 23.058 18.825 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.628 22.528 16.475 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.010 24.122 18.689 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.727 23.586 16.341 1.00 0.00 C ATOM 849 CZ PHE A 54 10.422 24.385 17.446 1.00 0.00 C ATOM 0 H PHE A 54 14.222 21.535 15.491 1.00 0.00 H new ATOM 0 HA PHE A 54 14.877 22.500 18.278 1.00 0.00 H new ATOM 0 HB2 PHE A 54 12.989 20.346 17.148 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.183 20.720 18.849 1.00 0.00 H new ATOM 0 HD1 PHE A 54 12.356 22.850 19.784 1.00 0.00 H new ATOM 0 HD2 PHE A 54 11.873 21.915 15.620 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.773 24.741 19.541 1.00 0.00 H new ATOM 0 HE2 PHE A 54 10.267 23.787 15.385 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.731 25.208 17.341 1.00 0.00 H new ATOM 859 N TYR A 55 16.269 20.589 18.804 1.00 0.00 N ATOM 860 CA TYR A 55 17.353 19.596 19.035 1.00 0.00 C ATOM 861 C TYR A 55 17.074 18.822 20.309 1.00 0.00 C ATOM 862 O TYR A 55 16.384 19.307 21.201 1.00 0.00 O ATOM 863 CB TYR A 55 18.612 20.437 19.224 1.00 0.00 C ATOM 864 CG TYR A 55 19.013 21.030 17.903 1.00 0.00 C ATOM 865 CD1 TYR A 55 18.269 22.078 17.356 1.00 0.00 C ATOM 866 CD2 TYR A 55 20.116 20.518 17.217 1.00 0.00 C ATOM 867 CE1 TYR A 55 18.631 22.618 16.119 1.00 0.00 C ATOM 868 CE2 TYR A 55 20.478 21.053 15.978 1.00 0.00 C ATOM 869 CZ TYR A 55 19.736 22.105 15.427 1.00 0.00 C ATOM 870 OH TYR A 55 20.092 22.634 14.203 1.00 0.00 O ATOM 0 H TYR A 55 16.056 21.182 19.606 1.00 0.00 H new ATOM 0 HA TYR A 55 17.441 18.880 18.218 1.00 0.00 H new ATOM 0 HB2 TYR A 55 18.429 21.228 19.951 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.419 19.821 19.620 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.415 22.470 17.888 1.00 0.00 H new ATOM 0 HD2 TYR A 55 20.689 19.708 17.644 1.00 0.00 H new ATOM 0 HE1 TYR A 55 18.059 23.431 15.696 1.00 0.00 H new ATOM 0 HE2 TYR A 55 21.329 20.655 15.446 1.00 0.00 H new ATOM 0 HH TYR A 55 19.354 23.176 13.854 1.00 0.00 H new ATOM 880 N ALA A 56 17.620 17.649 20.439 1.00 0.00 N ATOM 881 CA ALA A 56 17.401 16.890 21.692 1.00 0.00 C ATOM 882 C ALA A 56 18.189 17.580 22.798 1.00 0.00 C ATOM 883 O ALA A 56 17.720 17.726 23.924 1.00 0.00 O ATOM 884 CB ALA A 56 17.944 15.493 21.432 1.00 0.00 C ATOM 0 H ALA A 56 18.202 17.189 19.739 1.00 0.00 H new ATOM 0 HA ALA A 56 16.354 16.842 21.990 1.00 0.00 H new ATOM 0 HB1 ALA A 56 17.812 14.880 22.323 1.00 0.00 H new ATOM 0 HB2 ALA A 56 17.405 15.043 20.598 1.00 0.00 H new ATOM 0 HB3 ALA A 56 19.005 15.554 21.188 1.00 0.00 H new ATOM 890 N ASN A 57 19.378 18.030 22.491 1.00 0.00 N ATOM 891 CA ASN A 57 20.182 18.730 23.508 1.00 0.00 C ATOM 892 C ASN A 57 20.884 19.930 22.900 1.00 0.00 C ATOM 893 O ASN A 57 20.996 20.080 21.678 1.00 0.00 O ATOM 894 CB ASN A 57 21.229 17.740 23.973 1.00 0.00 C ATOM 895 CG ASN A 57 22.026 17.244 22.777 1.00 0.00 C ATOM 896 OD1 ASN A 57 23.082 17.790 22.473 1.00 0.00 O ATOM 897 ND2 ASN A 57 21.573 16.243 22.078 1.00 0.00 N ATOM 0 H ASN A 57 19.818 17.938 21.576 1.00 0.00 H new ATOM 0 HA ASN A 57 19.549 19.082 24.323 1.00 0.00 H new ATOM 0 HB2 ASN A 57 21.894 18.211 24.696 1.00 0.00 H new ATOM 0 HB3 ASN A 57 20.752 16.901 24.479 1.00 0.00 H new ATOM 0 HD21 ASN A 57 22.097 15.907 21.270 1.00 0.00 H new ATOM 0 HD22 ASN A 57 20.694 15.795 22.338 1.00 0.00 H new ATOM 904 N ALA A 58 21.381 20.768 23.741 1.00 0.00 N ATOM 905 CA ALA A 58 22.109 21.954 23.261 1.00 0.00 C ATOM 906 C ALA A 58 23.373 21.530 22.515 1.00 0.00 C ATOM 907 O ALA A 58 23.860 22.261 21.672 1.00 0.00 O ATOM 908 CB ALA A 58 22.466 22.737 24.521 1.00 0.00 C ATOM 0 H ALA A 58 21.314 20.682 24.755 1.00 0.00 H new ATOM 0 HA ALA A 58 21.516 22.550 22.567 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.013 23.639 24.246 1.00 0.00 H new ATOM 0 HB2 ALA A 58 21.553 23.013 25.049 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.088 22.119 25.169 1.00 0.00 H new ATOM 914 N SER A 59 23.918 20.364 22.785 1.00 0.00 N ATOM 915 CA SER A 59 25.151 19.962 22.044 1.00 0.00 C ATOM 916 C SER A 59 24.774 19.648 20.606 1.00 0.00 C ATOM 917 O SER A 59 25.502 19.966 19.669 1.00 0.00 O ATOM 918 CB SER A 59 25.691 18.723 22.763 1.00 0.00 C ATOM 919 OG SER A 59 27.066 18.557 22.437 1.00 0.00 O ATOM 0 H SER A 59 23.571 19.692 23.469 1.00 0.00 H new ATOM 0 HA SER A 59 25.908 20.746 22.024 1.00 0.00 H new ATOM 0 HB2 SER A 59 25.571 18.832 23.841 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.125 17.840 22.467 1.00 0.00 H new ATOM 0 HG SER A 59 27.418 17.766 22.896 1.00 0.00 H new ATOM 925 N GLU A 60 23.623 19.071 20.408 1.00 0.00 N ATOM 926 CA GLU A 60 23.165 18.786 19.031 1.00 0.00 C ATOM 927 C GLU A 60 23.056 20.130 18.315 1.00 0.00 C ATOM 928 O GLU A 60 23.603 20.346 17.227 1.00 0.00 O ATOM 929 CB GLU A 60 21.796 18.129 19.214 1.00 0.00 C ATOM 930 CG GLU A 60 21.426 17.343 17.961 1.00 0.00 C ATOM 931 CD GLU A 60 22.152 15.997 17.972 1.00 0.00 C ATOM 932 OE1 GLU A 60 22.087 15.320 18.987 1.00 0.00 O ATOM 933 OE2 GLU A 60 22.762 15.665 16.969 1.00 0.00 O ATOM 0 H GLU A 60 22.981 18.785 21.147 1.00 0.00 H new ATOM 0 HA GLU A 60 23.823 18.141 18.448 1.00 0.00 H new ATOM 0 HB2 GLU A 60 21.814 17.465 20.078 1.00 0.00 H new ATOM 0 HB3 GLU A 60 21.041 18.890 19.413 1.00 0.00 H new ATOM 0 HG2 GLU A 60 20.348 17.187 17.922 1.00 0.00 H new ATOM 0 HG3 GLU A 60 21.699 17.908 17.070 1.00 0.00 H new ATOM 940 N ALA A 61 22.410 21.064 18.956 1.00 0.00 N ATOM 941 CA ALA A 61 22.307 22.431 18.379 1.00 0.00 C ATOM 942 C ALA A 61 23.712 22.974 18.194 1.00 0.00 C ATOM 943 O ALA A 61 24.072 23.523 17.155 1.00 0.00 O ATOM 944 CB ALA A 61 21.594 23.242 19.442 1.00 0.00 C ATOM 0 H ALA A 61 21.948 20.938 19.857 1.00 0.00 H new ATOM 0 HA ALA A 61 21.788 22.457 17.421 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.475 24.269 19.097 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.613 22.808 19.634 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.180 23.233 20.361 1.00 0.00 H new ATOM 950 N LEU A 62 24.518 22.799 19.203 1.00 0.00 N ATOM 951 CA LEU A 62 25.919 23.258 19.140 1.00 0.00 C ATOM 952 C LEU A 62 26.607 22.533 17.977 1.00 0.00 C ATOM 953 O LEU A 62 27.546 23.042 17.367 1.00 0.00 O ATOM 954 CB LEU A 62 26.504 22.837 20.496 1.00 0.00 C ATOM 955 CG LEU A 62 25.947 23.713 21.634 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.248 23.046 22.981 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.581 25.107 21.624 1.00 0.00 C ATOM 0 H LEU A 62 24.254 22.349 20.080 1.00 0.00 H new ATOM 0 HA LEU A 62 26.040 24.328 18.971 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.268 21.791 20.689 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.591 22.918 20.468 1.00 0.00 H new ATOM 0 HG LEU A 62 24.872 23.816 21.486 1.00 0.00 H new ATOM 0 HD11 LEU A 62 25.855 23.664 23.789 1.00 0.00 H new ATOM 0 HD12 LEU A 62 25.777 22.063 23.014 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.326 22.936 23.100 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.167 25.701 22.439 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.660 25.017 21.752 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.368 25.597 20.674 1.00 0.00 H new ATOM 969 N ALA A 63 26.132 21.354 17.650 1.00 0.00 N ATOM 970 CA ALA A 63 26.716 20.589 16.527 1.00 0.00 C ATOM 971 C ALA A 63 26.177 21.120 15.195 1.00 0.00 C ATOM 972 O ALA A 63 26.756 20.884 14.137 1.00 0.00 O ATOM 973 CB ALA A 63 26.274 19.143 16.751 1.00 0.00 C ATOM 0 H ALA A 63 25.356 20.893 18.125 1.00 0.00 H new ATOM 0 HA ALA A 63 27.802 20.675 16.489 1.00 0.00 H new ATOM 0 HB1 ALA A 63 26.671 18.514 15.954 1.00 0.00 H new ATOM 0 HB2 ALA A 63 26.650 18.792 17.712 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.185 19.091 16.747 1.00 0.00 H new ATOM 979 N ALA A 64 25.081 21.843 15.227 1.00 0.00 N ATOM 980 CA ALA A 64 24.520 22.396 13.951 1.00 0.00 C ATOM 981 C ALA A 64 25.321 23.608 13.502 1.00 0.00 C ATOM 982 O ALA A 64 25.040 24.233 12.481 1.00 0.00 O ATOM 983 CB ALA A 64 23.067 22.793 14.241 1.00 0.00 C ATOM 0 H ALA A 64 24.556 22.072 16.071 1.00 0.00 H new ATOM 0 HA ALA A 64 24.570 21.658 13.151 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.615 23.203 13.338 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.507 21.914 14.561 1.00 0.00 H new ATOM 0 HB3 ALA A 64 23.046 23.544 15.030 1.00 0.00 H new ATOM 989 N GLY A 65 26.308 23.938 14.255 1.00 0.00 N ATOM 990 CA GLY A 65 27.166 25.107 13.918 1.00 0.00 C ATOM 991 C GLY A 65 26.499 26.389 14.417 1.00 0.00 C ATOM 992 O GLY A 65 26.558 27.431 13.768 1.00 0.00 O ATOM 0 H GLY A 65 26.571 23.445 15.109 1.00 0.00 H new ATOM 0 HA2 GLY A 65 28.149 24.994 14.375 1.00 0.00 H new ATOM 0 HA3 GLY A 65 27.320 25.160 12.840 1.00 0.00 H new ATOM 996 N PHE A 66 25.869 26.336 15.561 1.00 0.00 N ATOM 997 CA PHE A 66 25.203 27.555 16.101 1.00 0.00 C ATOM 998 C PHE A 66 25.885 28.049 17.369 1.00 0.00 C ATOM 999 O PHE A 66 26.580 27.308 18.061 1.00 0.00 O ATOM 1000 CB PHE A 66 23.768 27.139 16.429 1.00 0.00 C ATOM 1001 CG PHE A 66 22.991 26.909 15.160 1.00 0.00 C ATOM 1002 CD1 PHE A 66 23.029 27.865 14.139 1.00 0.00 C ATOM 1003 CD2 PHE A 66 22.212 25.757 15.016 1.00 0.00 C ATOM 1004 CE1 PHE A 66 22.291 27.667 12.971 1.00 0.00 C ATOM 1005 CE2 PHE A 66 21.469 25.561 13.848 1.00 0.00 C ATOM 1006 CZ PHE A 66 21.511 26.518 12.827 1.00 0.00 C ATOM 0 H PHE A 66 25.788 25.502 16.143 1.00 0.00 H new ATOM 0 HA PHE A 66 25.249 28.366 15.375 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.774 26.230 17.031 1.00 0.00 H new ATOM 0 HB3 PHE A 66 23.284 27.913 17.025 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.629 28.756 14.255 1.00 0.00 H new ATOM 0 HD2 PHE A 66 22.184 25.020 15.805 1.00 0.00 H new ATOM 0 HE1 PHE A 66 22.323 28.401 12.180 1.00 0.00 H new ATOM 0 HE2 PHE A 66 20.864 24.674 13.734 1.00 0.00 H new ATOM 0 HZ PHE A 66 20.938 26.367 11.924 1.00 0.00 H new ATOM 1016 N ARG A 67 25.657 29.286 17.701 1.00 0.00 N ATOM 1017 CA ARG A 67 26.238 29.848 18.942 1.00 0.00 C ATOM 1018 C ARG A 67 25.141 29.833 20.007 1.00 0.00 C ATOM 1019 O ARG A 67 24.104 30.471 19.838 1.00 0.00 O ATOM 1020 CB ARG A 67 26.646 31.281 18.590 1.00 0.00 C ATOM 1021 CG ARG A 67 28.148 31.463 18.835 1.00 0.00 C ATOM 1022 CD ARG A 67 28.939 30.538 17.904 1.00 0.00 C ATOM 1023 NE ARG A 67 29.428 29.431 18.778 1.00 0.00 N ATOM 1024 CZ ARG A 67 30.329 28.583 18.342 1.00 0.00 C ATOM 1025 NH1 ARG A 67 30.818 28.690 17.133 1.00 0.00 N ATOM 1026 NH2 ARG A 67 30.743 27.622 19.121 1.00 0.00 N ATOM 0 H ARG A 67 25.087 29.936 17.159 1.00 0.00 H new ATOM 0 HA ARG A 67 27.096 29.292 19.320 1.00 0.00 H new ATOM 0 HB2 ARG A 67 26.409 31.491 17.547 1.00 0.00 H new ATOM 0 HB3 ARG A 67 26.080 31.990 19.195 1.00 0.00 H new ATOM 0 HG2 ARG A 67 28.432 32.501 18.659 1.00 0.00 H new ATOM 0 HG3 ARG A 67 28.386 31.239 19.875 1.00 0.00 H new ATOM 0 HD2 ARG A 67 28.310 30.157 17.100 1.00 0.00 H new ATOM 0 HD3 ARG A 67 29.769 31.067 17.436 1.00 0.00 H new ATOM 0 HE ARG A 67 29.058 29.333 19.723 1.00 0.00 H new ATOM 0 HH11 ARG A 67 30.499 29.439 16.518 1.00 0.00 H new ATOM 0 HH12 ARG A 67 31.518 28.025 16.805 1.00 0.00 H new ATOM 0 HH21 ARG A 67 30.366 27.532 20.065 1.00 0.00 H new ATOM 0 HH22 ARG A 67 31.443 26.960 18.786 1.00 0.00 H new ATOM 1040 N PRO A 68 25.369 29.093 21.056 1.00 0.00 N ATOM 1041 CA PRO A 68 24.352 28.987 22.125 1.00 0.00 C ATOM 1042 C PRO A 68 24.072 30.357 22.754 1.00 0.00 C ATOM 1043 O PRO A 68 24.971 31.163 22.980 1.00 0.00 O ATOM 1044 CB PRO A 68 24.959 27.973 23.099 1.00 0.00 C ATOM 1045 CG PRO A 68 26.428 28.000 22.825 1.00 0.00 C ATOM 1046 CD PRO A 68 26.576 28.314 21.360 1.00 0.00 C ATOM 0 HA PRO A 68 23.374 28.658 21.774 1.00 0.00 H new ATOM 0 HB2 PRO A 68 24.746 28.244 24.133 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.546 26.977 22.939 1.00 0.00 H new ATOM 0 HG2 PRO A 68 26.924 28.753 23.437 1.00 0.00 H new ATOM 0 HG3 PRO A 68 26.887 27.041 23.066 1.00 0.00 H new ATOM 0 HD2 PRO A 68 27.483 28.884 21.161 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.631 27.407 20.758 1.00 0.00 H new ATOM 1054 N CYS A 69 22.818 30.633 23.006 1.00 0.00 N ATOM 1055 CA CYS A 69 22.417 31.947 23.585 1.00 0.00 C ATOM 1056 C CYS A 69 23.068 32.126 24.961 1.00 0.00 C ATOM 1057 O CYS A 69 22.879 31.321 25.871 1.00 0.00 O ATOM 1058 CB CYS A 69 20.890 31.855 23.643 1.00 0.00 C ATOM 1059 SG CYS A 69 20.161 33.108 24.739 1.00 0.00 S ATOM 0 H CYS A 69 22.044 29.992 22.832 1.00 0.00 H new ATOM 0 HA CYS A 69 22.737 32.815 23.009 1.00 0.00 H new ATOM 0 HB2 CYS A 69 20.483 31.974 22.639 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.601 30.862 23.988 1.00 0.00 H new ATOM 0 HG CYS A 69 19.243 32.558 25.477 1.00 0.00 H new ATOM 1064 N LYS A 70 23.847 33.167 25.114 1.00 0.00 N ATOM 1065 CA LYS A 70 24.563 33.415 26.411 1.00 0.00 C ATOM 1066 C LYS A 70 23.604 33.460 27.602 1.00 0.00 C ATOM 1067 O LYS A 70 24.023 33.614 28.746 1.00 0.00 O ATOM 1068 CB LYS A 70 25.255 34.766 26.235 1.00 0.00 C ATOM 1069 CG LYS A 70 26.515 34.805 27.102 1.00 0.00 C ATOM 1070 CD LYS A 70 27.638 34.027 26.414 1.00 0.00 C ATOM 1071 CE LYS A 70 28.147 34.821 25.208 1.00 0.00 C ATOM 1072 NZ LYS A 70 29.585 34.455 25.082 1.00 0.00 N ATOM 0 H LYS A 70 24.022 33.865 24.391 1.00 0.00 H new ATOM 0 HA LYS A 70 25.264 32.609 26.627 1.00 0.00 H new ATOM 0 HB2 LYS A 70 25.515 34.921 25.188 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.580 35.573 26.518 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.823 35.838 27.267 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.308 34.374 28.081 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.453 33.848 27.115 1.00 0.00 H new ATOM 0 HD3 LYS A 70 27.274 33.051 26.093 1.00 0.00 H new ATOM 0 HE2 LYS A 70 27.594 34.564 24.305 1.00 0.00 H new ATOM 0 HE3 LYS A 70 28.025 35.893 25.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 30.003 34.961 24.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 30.088 34.718 25.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 29.670 33.430 24.929 1.00 0.00 H new ATOM 1086 N ARG A 71 22.336 33.331 27.365 1.00 0.00 N ATOM 1087 CA ARG A 71 21.356 33.359 28.479 1.00 0.00 C ATOM 1088 C ARG A 71 20.777 31.962 28.653 1.00 0.00 C ATOM 1089 O ARG A 71 20.499 31.499 29.757 1.00 0.00 O ATOM 1090 CB ARG A 71 20.274 34.303 27.989 1.00 0.00 C ATOM 1091 CG ARG A 71 19.638 35.028 29.184 1.00 0.00 C ATOM 1092 CD ARG A 71 19.777 36.546 29.009 1.00 0.00 C ATOM 1093 NE ARG A 71 21.178 36.867 29.423 1.00 0.00 N ATOM 1094 CZ ARG A 71 21.424 37.635 30.461 1.00 0.00 C ATOM 1095 NH1 ARG A 71 20.451 38.150 31.173 1.00 0.00 N ATOM 1096 NH2 ARG A 71 22.663 37.890 30.789 1.00 0.00 N ATOM 0 H ARG A 71 21.930 33.206 26.438 1.00 0.00 H new ATOM 0 HA ARG A 71 21.786 33.671 29.431 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.698 35.029 27.295 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.513 33.746 27.442 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.585 34.758 29.266 1.00 0.00 H new ATOM 0 HG3 ARG A 71 20.121 34.714 30.110 1.00 0.00 H new ATOM 0 HD2 ARG A 71 19.596 36.841 27.975 1.00 0.00 H new ATOM 0 HD3 ARG A 71 19.053 37.080 29.624 1.00 0.00 H new ATOM 0 HE ARG A 71 21.958 36.482 28.889 1.00 0.00 H new ATOM 0 HH11 ARG A 71 19.481 37.957 30.925 1.00 0.00 H new ATOM 0 HH12 ARG A 71 20.665 38.743 31.975 1.00 0.00 H new ATOM 0 HH21 ARG A 71 23.427 37.494 30.241 1.00 0.00 H new ATOM 0 HH22 ARG A 71 22.866 38.485 31.593 1.00 0.00 H new ATOM 1110 N CYS A 72 20.599 31.292 27.556 1.00 0.00 N ATOM 1111 CA CYS A 72 20.036 29.908 27.583 1.00 0.00 C ATOM 1112 C CYS A 72 21.154 28.880 27.726 1.00 0.00 C ATOM 1113 O CYS A 72 20.909 27.696 27.947 1.00 0.00 O ATOM 1114 CB CYS A 72 19.358 29.736 26.228 1.00 0.00 C ATOM 1115 SG CYS A 72 17.729 30.505 26.260 1.00 0.00 S ATOM 0 H CYS A 72 20.821 31.644 26.625 1.00 0.00 H new ATOM 0 HA CYS A 72 19.352 29.765 28.419 1.00 0.00 H new ATOM 0 HB2 CYS A 72 19.968 30.187 25.446 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.266 28.677 25.989 1.00 0.00 H new ATOM 0 HG CYS A 72 16.862 29.709 25.707 1.00 0.00 H new ATOM 1120 N GLN A 73 22.375 29.301 27.577 1.00 0.00 N ATOM 1121 CA GLN A 73 23.507 28.343 27.681 1.00 0.00 C ATOM 1122 C GLN A 73 24.007 28.236 29.139 1.00 0.00 C ATOM 1123 O GLN A 73 24.203 27.130 29.637 1.00 0.00 O ATOM 1124 CB GLN A 73 24.564 28.913 26.724 1.00 0.00 C ATOM 1125 CG GLN A 73 25.951 28.365 27.068 1.00 0.00 C ATOM 1126 CD GLN A 73 26.679 29.350 27.984 1.00 0.00 C ATOM 1127 OE1 GLN A 73 26.708 29.172 29.199 1.00 0.00 O ATOM 1128 NE2 GLN A 73 27.273 30.388 27.464 1.00 0.00 N ATOM 0 H GLN A 73 22.639 30.268 27.387 1.00 0.00 H new ATOM 0 HA GLN A 73 23.237 27.322 27.411 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.309 28.655 25.696 1.00 0.00 H new ATOM 0 HB3 GLN A 73 24.571 30.001 26.787 1.00 0.00 H new ATOM 0 HG2 GLN A 73 25.859 27.396 27.559 1.00 0.00 H new ATOM 0 HG3 GLN A 73 26.527 28.207 26.156 1.00 0.00 H new ATOM 0 HE21 GLN A 73 27.250 30.537 26.455 1.00 0.00 H new ATOM 0 HE22 GLN A 73 27.761 31.051 28.066 1.00 0.00 H new ATOM 1137 N PRO A 74 24.196 29.360 29.792 1.00 0.00 N ATOM 1138 CA PRO A 74 24.669 29.342 31.199 1.00 0.00 C ATOM 1139 C PRO A 74 23.505 29.130 32.184 1.00 0.00 C ATOM 1140 O PRO A 74 23.708 29.096 33.397 1.00 0.00 O ATOM 1141 CB PRO A 74 25.275 30.725 31.387 1.00 0.00 C ATOM 1142 CG PRO A 74 24.593 31.607 30.386 1.00 0.00 C ATOM 1143 CD PRO A 74 24.009 30.730 29.302 1.00 0.00 C ATOM 0 HA PRO A 74 25.370 28.530 31.390 1.00 0.00 H new ATOM 0 HB2 PRO A 74 25.114 31.088 32.402 1.00 0.00 H new ATOM 0 HB3 PRO A 74 26.352 30.706 31.222 1.00 0.00 H new ATOM 0 HG2 PRO A 74 23.808 32.191 30.867 1.00 0.00 H new ATOM 0 HG3 PRO A 74 25.302 32.317 29.960 1.00 0.00 H new ATOM 0 HD2 PRO A 74 22.954 30.952 29.138 1.00 0.00 H new ATOM 0 HD3 PRO A 74 24.518 30.884 28.351 1.00 0.00 H new ATOM 1151 N ASP A 75 22.296 28.995 31.701 1.00 0.00 N ATOM 1152 CA ASP A 75 21.137 28.796 32.629 1.00 0.00 C ATOM 1153 C ASP A 75 20.827 27.303 32.798 1.00 0.00 C ATOM 1154 O ASP A 75 21.469 26.446 32.194 1.00 0.00 O ATOM 1155 CB ASP A 75 19.962 29.514 31.960 1.00 0.00 C ATOM 1156 CG ASP A 75 19.543 28.749 30.703 1.00 0.00 C ATOM 1157 OD1 ASP A 75 20.327 27.936 30.241 1.00 0.00 O ATOM 1158 OD2 ASP A 75 18.441 28.979 30.232 1.00 0.00 O ATOM 0 H ASP A 75 22.060 29.014 30.709 1.00 0.00 H new ATOM 0 HA ASP A 75 21.343 29.187 33.625 1.00 0.00 H new ATOM 0 HB2 ASP A 75 19.123 29.584 32.652 1.00 0.00 H new ATOM 0 HB3 ASP A 75 20.246 30.534 31.700 1.00 0.00 H new ATOM 1163 N LYS A 76 19.857 26.977 33.615 1.00 0.00 N ATOM 1164 CA LYS A 76 19.502 25.549 33.834 1.00 0.00 C ATOM 1165 C LYS A 76 18.144 25.219 33.189 1.00 0.00 C ATOM 1166 O LYS A 76 17.200 26.004 33.246 1.00 0.00 O ATOM 1167 CB LYS A 76 19.426 25.408 35.354 1.00 0.00 C ATOM 1168 CG LYS A 76 20.664 26.038 36.013 1.00 0.00 C ATOM 1169 CD LYS A 76 21.944 25.442 35.417 1.00 0.00 C ATOM 1170 CE LYS A 76 22.053 23.965 35.800 1.00 0.00 C ATOM 1171 NZ LYS A 76 23.141 23.424 34.937 1.00 0.00 N ATOM 0 H LYS A 76 19.295 27.646 34.141 1.00 0.00 H new ATOM 0 HA LYS A 76 20.226 24.867 33.387 1.00 0.00 H new ATOM 0 HB2 LYS A 76 18.523 25.891 35.726 1.00 0.00 H new ATOM 0 HB3 LYS A 76 19.358 24.354 35.625 1.00 0.00 H new ATOM 0 HG2 LYS A 76 20.654 27.118 35.864 1.00 0.00 H new ATOM 0 HG3 LYS A 76 20.640 25.864 37.089 1.00 0.00 H new ATOM 0 HD2 LYS A 76 21.934 25.546 34.332 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.814 25.987 35.782 1.00 0.00 H new ATOM 0 HE2 LYS A 76 22.292 23.848 36.857 1.00 0.00 H new ATOM 0 HE3 LYS A 76 21.113 23.441 35.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 23.276 22.413 35.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 22.883 23.544 33.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 24.025 23.937 35.130 1.00 0.00 H new ATOM 1185 N ALA A 77 18.041 24.069 32.574 1.00 0.00 N ATOM 1186 CA ALA A 77 16.761 23.659 31.911 1.00 0.00 C ATOM 1187 C ALA A 77 16.114 22.496 32.695 1.00 0.00 C ATOM 1188 O ALA A 77 16.007 22.565 33.906 1.00 0.00 O ATOM 1189 CB ALA A 77 17.211 23.232 30.513 1.00 0.00 C ATOM 0 H ALA A 77 18.796 23.387 32.501 1.00 0.00 H new ATOM 0 HA ALA A 77 16.006 24.444 31.874 1.00 0.00 H new ATOM 0 HB1 ALA A 77 16.345 22.909 29.935 1.00 0.00 H new ATOM 0 HB2 ALA A 77 17.689 24.074 30.012 1.00 0.00 H new ATOM 0 HB3 ALA A 77 17.920 22.408 30.595 1.00 0.00 H new ATOM 1195 N ASN A 78 15.713 21.409 32.048 1.00 0.00 N ATOM 1196 CA ASN A 78 15.124 20.260 32.820 1.00 0.00 C ATOM 1197 C ASN A 78 16.085 19.822 33.917 1.00 0.00 C ATOM 1198 O ASN A 78 15.650 19.416 34.993 1.00 0.00 O ATOM 1199 CB ASN A 78 14.880 19.106 31.840 1.00 0.00 C ATOM 1200 CG ASN A 78 13.576 19.321 31.057 1.00 0.00 C ATOM 1201 OD1 ASN A 78 12.637 20.100 31.535 1.00 0.00 O flip ATOM 1202 ND2 ASN A 78 13.406 18.759 29.979 1.00 0.00 N flip ATOM 0 H ASN A 78 15.769 21.275 31.038 1.00 0.00 H new ATOM 0 HA ASN A 78 14.187 20.560 33.289 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.717 19.029 31.146 1.00 0.00 H new ATOM 0 HB3 ASN A 78 14.830 18.164 32.386 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.132 18.151 29.601 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.538 18.900 29.462 1.00 0.00 H new ATOM 1209 N PRO A 79 17.363 19.991 33.673 1.00 0.00 N ATOM 1210 CA PRO A 79 18.372 19.691 34.716 1.00 0.00 C ATOM 1211 C PRO A 79 18.056 20.604 35.908 1.00 0.00 C ATOM 1212 O PRO A 79 18.678 20.530 36.966 1.00 0.00 O ATOM 1213 CB PRO A 79 19.687 20.046 34.000 1.00 0.00 C ATOM 1214 CG PRO A 79 19.271 21.030 32.980 1.00 0.00 C ATOM 1215 CD PRO A 79 18.010 20.459 32.442 1.00 0.00 C ATOM 0 HA PRO A 79 18.404 18.673 35.104 1.00 0.00 H new ATOM 0 HB2 PRO A 79 20.418 20.468 34.690 1.00 0.00 H new ATOM 0 HB3 PRO A 79 20.146 19.168 33.546 1.00 0.00 H new ATOM 0 HG2 PRO A 79 19.111 22.016 33.415 1.00 0.00 H new ATOM 0 HG3 PRO A 79 20.025 21.144 32.201 1.00 0.00 H new ATOM 0 HD2 PRO A 79 17.410 21.204 31.919 1.00 0.00 H new ATOM 0 HD3 PRO A 79 18.193 19.647 31.738 1.00 0.00 H new ATOM 1223 N ARG A 80 17.055 21.459 35.733 1.00 0.00 N ATOM 1224 CA ARG A 80 16.612 22.380 36.793 1.00 0.00 C ATOM 1225 C ARG A 80 16.600 21.644 38.130 1.00 0.00 C ATOM 1226 O ARG A 80 17.304 22.010 39.069 1.00 0.00 O ATOM 1227 CB ARG A 80 15.179 22.784 36.435 1.00 0.00 C ATOM 1228 CG ARG A 80 14.814 24.086 37.157 1.00 0.00 C ATOM 1229 CD ARG A 80 14.517 25.178 36.124 1.00 0.00 C ATOM 1230 NE ARG A 80 15.157 26.412 36.666 1.00 0.00 N ATOM 1231 CZ ARG A 80 14.802 27.597 36.230 1.00 0.00 C ATOM 1232 NH1 ARG A 80 13.879 27.726 35.310 1.00 0.00 N ATOM 1233 NH2 ARG A 80 15.377 28.663 36.719 1.00 0.00 N ATOM 0 H ARG A 80 16.527 21.540 34.864 1.00 0.00 H new ATOM 0 HA ARG A 80 17.271 23.245 36.873 1.00 0.00 H new ATOM 0 HB2 ARG A 80 15.087 22.916 35.357 1.00 0.00 H new ATOM 0 HB3 ARG A 80 14.486 21.992 36.719 1.00 0.00 H new ATOM 0 HG2 ARG A 80 13.945 23.929 37.796 1.00 0.00 H new ATOM 0 HG3 ARG A 80 15.633 24.397 37.805 1.00 0.00 H new ATOM 0 HD2 ARG A 80 14.926 24.918 35.148 1.00 0.00 H new ATOM 0 HD3 ARG A 80 13.444 25.316 35.994 1.00 0.00 H new ATOM 0 HE ARG A 80 15.878 26.333 37.383 1.00 0.00 H new ATOM 0 HH11 ARG A 80 13.426 26.898 34.923 1.00 0.00 H new ATOM 0 HH12 ARG A 80 13.613 28.654 34.981 1.00 0.00 H new ATOM 0 HH21 ARG A 80 16.097 28.571 37.435 1.00 0.00 H new ATOM 0 HH22 ARG A 80 15.106 29.588 36.384 1.00 0.00 H new ATOM 1247 N GLN A 81 15.798 20.619 38.235 1.00 0.00 N ATOM 1248 CA GLN A 81 15.709 19.850 39.507 1.00 0.00 C ATOM 1249 C GLN A 81 17.087 19.339 39.972 1.00 0.00 C ATOM 1250 O GLN A 81 17.365 19.268 41.168 1.00 0.00 O ATOM 1251 CB GLN A 81 14.786 18.671 39.192 1.00 0.00 C ATOM 1252 CG GLN A 81 13.338 19.068 39.483 1.00 0.00 C ATOM 1253 CD GLN A 81 12.410 17.899 39.148 1.00 0.00 C ATOM 1254 OE1 GLN A 81 11.897 17.807 38.035 1.00 0.00 O ATOM 1255 NE2 GLN A 81 12.165 16.996 40.057 1.00 0.00 N ATOM 0 H GLN A 81 15.195 20.279 37.486 1.00 0.00 H new ATOM 0 HA GLN A 81 15.335 20.476 40.317 1.00 0.00 H new ATOM 0 HB2 GLN A 81 14.892 18.381 38.147 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.065 17.806 39.793 1.00 0.00 H new ATOM 0 HG2 GLN A 81 13.229 19.343 40.532 1.00 0.00 H new ATOM 0 HG3 GLN A 81 13.065 19.943 38.894 1.00 0.00 H new ATOM 0 HE21 GLN A 81 12.591 17.073 40.980 1.00 0.00 H new ATOM 0 HE22 GLN A 81 11.547 16.213 39.844 1.00 0.00 H new ATOM 1264 N HIS A 82 17.945 18.965 39.056 1.00 0.00 N ATOM 1265 CA HIS A 82 19.293 18.439 39.456 1.00 0.00 C ATOM 1266 C HIS A 82 20.169 19.560 40.039 1.00 0.00 C ATOM 1267 O HIS A 82 20.805 19.400 41.090 1.00 0.00 O ATOM 1268 CB HIS A 82 19.910 17.900 38.161 1.00 0.00 C ATOM 1269 CG HIS A 82 19.845 16.395 38.154 1.00 0.00 C ATOM 1270 ND1 HIS A 82 18.766 15.698 38.674 1.00 0.00 N ATOM 1271 CD2 HIS A 82 20.718 15.442 37.689 1.00 0.00 C ATOM 1272 CE1 HIS A 82 19.015 14.386 38.511 1.00 0.00 C ATOM 1273 NE2 HIS A 82 20.190 14.174 37.916 1.00 0.00 N ATOM 0 H HIS A 82 17.774 19.000 38.051 1.00 0.00 H new ATOM 0 HA HIS A 82 19.215 17.673 40.227 1.00 0.00 H new ATOM 0 HB2 HIS A 82 19.377 18.300 37.299 1.00 0.00 H new ATOM 0 HB3 HIS A 82 20.946 18.229 38.076 1.00 0.00 H new ATOM 0 HD2 HIS A 82 21.669 15.645 37.219 1.00 0.00 H new ATOM 0 HE1 HIS A 82 18.345 13.599 38.824 1.00 0.00 H new ATOM 0 HE2 HIS A 82 20.611 13.276 37.678 1.00 0.00 H new ATOM 1281 N ARG A 83 20.214 20.691 39.389 1.00 0.00 N ATOM 1282 CA ARG A 83 21.053 21.809 39.912 1.00 0.00 C ATOM 1283 C ARG A 83 20.459 22.317 41.221 1.00 0.00 C ATOM 1284 O ARG A 83 21.174 22.807 42.111 1.00 0.00 O ATOM 1285 CB ARG A 83 20.997 22.892 38.832 1.00 0.00 C ATOM 1286 CG ARG A 83 21.812 24.110 39.277 1.00 0.00 C ATOM 1287 CD ARG A 83 23.306 23.814 39.118 1.00 0.00 C ATOM 1288 NE ARG A 83 23.930 25.133 38.797 1.00 0.00 N ATOM 1289 CZ ARG A 83 24.078 26.048 39.724 1.00 0.00 C ATOM 1290 NH1 ARG A 83 23.684 25.826 40.952 1.00 0.00 N ATOM 1291 NH2 ARG A 83 24.626 27.192 39.419 1.00 0.00 N ATOM 0 H ARG A 83 19.710 20.890 38.525 1.00 0.00 H new ATOM 0 HA ARG A 83 22.080 21.506 40.117 1.00 0.00 H new ATOM 0 HB2 ARG A 83 21.390 22.503 37.893 1.00 0.00 H new ATOM 0 HB3 ARG A 83 19.963 23.182 38.648 1.00 0.00 H new ATOM 0 HG2 ARG A 83 21.538 24.981 38.681 1.00 0.00 H new ATOM 0 HG3 ARG A 83 21.587 24.351 40.316 1.00 0.00 H new ATOM 0 HD2 ARG A 83 23.724 23.392 40.032 1.00 0.00 H new ATOM 0 HD3 ARG A 83 23.482 23.090 38.323 1.00 0.00 H new ATOM 0 HE ARG A 83 24.244 25.324 37.846 1.00 0.00 H new ATOM 0 HH11 ARG A 83 23.256 24.933 41.197 1.00 0.00 H new ATOM 0 HH12 ARG A 83 23.805 26.546 41.664 1.00 0.00 H new ATOM 0 HH21 ARG A 83 24.936 27.370 38.464 1.00 0.00 H new ATOM 0 HH22 ARG A 83 24.744 27.908 40.136 1.00 0.00 H new ATOM 1305 N LEU A 84 19.171 22.192 41.384 1.00 0.00 N ATOM 1306 CA LEU A 84 18.588 22.658 42.640 1.00 0.00 C ATOM 1307 C LEU A 84 18.860 21.617 43.724 1.00 0.00 C ATOM 1308 O LEU A 84 19.038 21.958 44.897 1.00 0.00 O ATOM 1309 CB LEU A 84 17.101 22.885 42.430 1.00 0.00 C ATOM 1310 CG LEU A 84 16.765 24.383 42.612 1.00 0.00 C ATOM 1311 CD1 LEU A 84 17.731 25.099 43.604 1.00 0.00 C ATOM 1312 CD2 LEU A 84 16.852 25.064 41.246 1.00 0.00 C ATOM 0 H LEU A 84 18.520 21.793 40.707 1.00 0.00 H new ATOM 0 HA LEU A 84 19.033 23.600 42.959 1.00 0.00 H new ATOM 0 HB2 LEU A 84 16.812 22.558 41.431 1.00 0.00 H new ATOM 0 HB3 LEU A 84 16.529 22.287 43.139 1.00 0.00 H new ATOM 0 HG LEU A 84 15.762 24.455 43.033 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.449 26.148 43.694 1.00 0.00 H new ATOM 0 HD12 LEU A 84 17.668 24.621 44.582 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.753 25.029 43.231 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.618 26.123 41.352 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.861 24.953 40.848 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.139 24.602 40.563 1.00 0.00 H new ATOM 1324 N ASP A 85 18.962 20.360 43.368 1.00 0.00 N ATOM 1325 CA ASP A 85 19.297 19.340 44.404 1.00 0.00 C ATOM 1326 C ASP A 85 20.669 19.694 44.992 1.00 0.00 C ATOM 1327 O ASP A 85 20.916 19.598 46.204 1.00 0.00 O ATOM 1328 CB ASP A 85 19.372 18.018 43.648 1.00 0.00 C ATOM 1329 CG ASP A 85 17.996 17.350 43.641 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.385 17.287 44.696 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.575 16.915 42.582 1.00 0.00 O ATOM 0 H ASP A 85 18.830 20.002 42.422 1.00 0.00 H new ATOM 0 HA ASP A 85 18.573 19.292 45.217 1.00 0.00 H new ATOM 0 HB2 ASP A 85 19.708 18.191 42.626 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.104 17.361 44.117 1.00 0.00 H new ATOM 1336 N LYS A 86 21.553 20.156 44.146 1.00 0.00 N ATOM 1337 CA LYS A 86 22.910 20.575 44.623 1.00 0.00 C ATOM 1338 C LYS A 86 22.763 21.685 45.683 1.00 0.00 C ATOM 1339 O LYS A 86 23.284 21.591 46.798 1.00 0.00 O ATOM 1340 CB LYS A 86 23.622 21.107 43.380 1.00 0.00 C ATOM 1341 CG LYS A 86 25.122 21.236 43.659 1.00 0.00 C ATOM 1342 CD LYS A 86 25.868 20.069 43.008 1.00 0.00 C ATOM 1343 CE LYS A 86 27.220 20.557 42.481 1.00 0.00 C ATOM 1344 NZ LYS A 86 27.527 19.668 41.327 1.00 0.00 N ATOM 0 H LYS A 86 21.396 20.262 43.144 1.00 0.00 H new ATOM 0 HA LYS A 86 23.465 19.758 45.084 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.456 20.435 42.538 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.210 22.076 43.100 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.495 22.183 43.268 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.303 21.242 44.734 1.00 0.00 H new ATOM 0 HD2 LYS A 86 26.016 19.268 43.733 1.00 0.00 H new ATOM 0 HD3 LYS A 86 25.276 19.655 42.192 1.00 0.00 H new ATOM 0 HE2 LYS A 86 27.170 21.601 42.172 1.00 0.00 H new ATOM 0 HE3 LYS A 86 27.991 20.488 43.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 28.441 19.941 40.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 27.575 18.681 41.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 26.780 19.760 40.610 1.00 0.00 H new ATOM 1358 N ILE A 87 22.045 22.725 45.355 1.00 0.00 N ATOM 1359 CA ILE A 87 21.826 23.853 46.325 1.00 0.00 C ATOM 1360 C ILE A 87 21.319 23.322 47.698 1.00 0.00 C ATOM 1361 O ILE A 87 21.805 23.718 48.754 1.00 0.00 O ATOM 1362 CB ILE A 87 20.780 24.715 45.617 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.437 25.458 44.445 1.00 0.00 C ATOM 1364 CG2 ILE A 87 20.197 25.718 46.589 1.00 0.00 C ATOM 1365 CD1 ILE A 87 22.554 26.374 44.962 1.00 0.00 C ATOM 0 H ILE A 87 21.594 22.848 44.449 1.00 0.00 H new ATOM 0 HA ILE A 87 22.734 24.407 46.563 1.00 0.00 H new ATOM 0 HB ILE A 87 19.982 24.075 45.242 1.00 0.00 H new ATOM 0 HG12 ILE A 87 21.845 24.741 43.732 1.00 0.00 H new ATOM 0 HG13 ILE A 87 20.690 26.047 43.913 1.00 0.00 H new ATOM 0 HG21 ILE A 87 19.453 26.329 46.079 1.00 0.00 H new ATOM 0 HG22 ILE A 87 19.726 25.190 47.418 1.00 0.00 H new ATOM 0 HG23 ILE A 87 20.992 26.359 46.971 1.00 0.00 H new ATOM 0 HD11 ILE A 87 23.014 26.896 44.123 1.00 0.00 H new ATOM 0 HD12 ILE A 87 22.135 27.102 45.657 1.00 0.00 H new ATOM 0 HD13 ILE A 87 23.308 25.776 45.474 1.00 0.00 H new ATOM 1377 N THR A 88 20.369 22.417 47.701 1.00 0.00 N ATOM 1378 CA THR A 88 19.878 21.847 48.994 1.00 0.00 C ATOM 1379 C THR A 88 21.096 21.381 49.791 1.00 0.00 C ATOM 1380 O THR A 88 21.255 21.691 50.972 1.00 0.00 O ATOM 1381 CB THR A 88 18.989 20.660 48.607 1.00 0.00 C ATOM 1382 OG1 THR A 88 18.042 21.076 47.631 1.00 0.00 O ATOM 1383 CG2 THR A 88 18.258 20.141 49.848 1.00 0.00 C ATOM 0 H THR A 88 19.914 22.050 46.865 1.00 0.00 H new ATOM 0 HA THR A 88 19.321 22.560 49.602 1.00 0.00 H new ATOM 0 HB THR A 88 19.606 19.862 48.194 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.474 20.317 47.382 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.626 19.297 49.572 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.987 19.820 50.592 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.640 20.936 50.265 1.00 0.00 H new ATOM 1391 N HIS A 89 21.994 20.687 49.138 1.00 0.00 N ATOM 1392 CA HIS A 89 23.245 20.258 49.832 1.00 0.00 C ATOM 1393 C HIS A 89 23.915 21.510 50.415 1.00 0.00 C ATOM 1394 O HIS A 89 24.424 21.504 51.533 1.00 0.00 O ATOM 1395 CB HIS A 89 24.114 19.634 48.739 1.00 0.00 C ATOM 1396 CG HIS A 89 25.103 18.684 49.358 1.00 0.00 C ATOM 1397 ND1 HIS A 89 26.373 18.496 48.835 1.00 0.00 N ATOM 1398 CD2 HIS A 89 25.022 17.859 50.453 1.00 0.00 C ATOM 1399 CE1 HIS A 89 27.000 17.591 49.607 1.00 0.00 C ATOM 1400 NE2 HIS A 89 26.222 17.169 50.608 1.00 0.00 N ATOM 0 H HIS A 89 21.916 20.401 48.162 1.00 0.00 H new ATOM 0 HA HIS A 89 23.075 19.552 50.645 1.00 0.00 H new ATOM 0 HB2 HIS A 89 23.488 19.105 48.021 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.640 20.415 48.189 1.00 0.00 H new ATOM 0 HD2 HIS A 89 24.160 17.760 51.096 1.00 0.00 H new ATOM 0 HE1 HIS A 89 28.010 17.247 49.438 1.00 0.00 H new ATOM 0 HE2 HIS A 89 26.456 16.488 51.330 1.00 0.00 H new ATOM 1408 N ALA A 90 23.881 22.600 49.676 1.00 0.00 N ATOM 1409 CA ALA A 90 24.470 23.877 50.185 1.00 0.00 C ATOM 1410 C ALA A 90 23.835 24.195 51.530 1.00 0.00 C ATOM 1411 O ALA A 90 24.504 24.623 52.464 1.00 0.00 O ATOM 1412 CB ALA A 90 24.105 24.971 49.156 1.00 0.00 C ATOM 0 H ALA A 90 23.470 22.656 48.744 1.00 0.00 H new ATOM 0 HA ALA A 90 25.551 23.812 50.311 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.513 25.928 49.482 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.523 24.710 48.184 1.00 0.00 H new ATOM 0 HB3 ALA A 90 23.021 25.048 49.076 1.00 0.00 H new ATOM 1418 N CYS A 91 22.550 23.967 51.662 1.00 0.00 N ATOM 1419 CA CYS A 91 21.905 24.253 52.974 1.00 0.00 C ATOM 1420 C CYS A 91 22.530 23.358 54.040 1.00 0.00 C ATOM 1421 O CYS A 91 23.101 23.830 55.028 1.00 0.00 O ATOM 1422 CB CYS A 91 20.416 23.908 52.831 1.00 0.00 C ATOM 1423 SG CYS A 91 19.722 23.607 54.487 1.00 0.00 S ATOM 0 H CYS A 91 21.935 23.604 50.934 1.00 0.00 H new ATOM 0 HA CYS A 91 22.037 25.296 53.260 1.00 0.00 H new ATOM 0 HB2 CYS A 91 19.885 24.724 52.342 1.00 0.00 H new ATOM 0 HB3 CYS A 91 20.292 23.025 52.203 1.00 0.00 H new ATOM 0 HG CYS A 91 18.955 24.601 54.823 1.00 0.00 H new ATOM 1429 N ARG A 92 22.423 22.071 53.857 1.00 0.00 N ATOM 1430 CA ARG A 92 22.995 21.112 54.845 1.00 0.00 C ATOM 1431 C ARG A 92 24.373 21.589 55.308 1.00 0.00 C ATOM 1432 O ARG A 92 24.604 21.800 56.486 1.00 0.00 O ATOM 1433 CB ARG A 92 23.106 19.790 54.078 1.00 0.00 C ATOM 1434 CG ARG A 92 23.769 18.722 54.956 1.00 0.00 C ATOM 1435 CD ARG A 92 24.923 18.074 54.185 1.00 0.00 C ATOM 1436 NE ARG A 92 25.668 17.274 55.199 1.00 0.00 N ATOM 1437 CZ ARG A 92 25.205 16.121 55.618 1.00 0.00 C ATOM 1438 NH1 ARG A 92 24.078 15.642 55.156 1.00 0.00 N ATOM 1439 NH2 ARG A 92 25.877 15.441 56.507 1.00 0.00 N ATOM 0 H ARG A 92 21.960 21.638 53.058 1.00 0.00 H new ATOM 0 HA ARG A 92 22.381 21.016 55.741 1.00 0.00 H new ATOM 0 HB2 ARG A 92 22.115 19.455 53.771 1.00 0.00 H new ATOM 0 HB3 ARG A 92 23.689 19.937 53.169 1.00 0.00 H new ATOM 0 HG2 ARG A 92 24.140 19.172 55.877 1.00 0.00 H new ATOM 0 HG3 ARG A 92 23.038 17.966 55.242 1.00 0.00 H new ATOM 0 HD2 ARG A 92 24.552 17.441 53.379 1.00 0.00 H new ATOM 0 HD3 ARG A 92 25.565 18.828 53.729 1.00 0.00 H new ATOM 0 HE ARG A 92 26.549 17.628 55.571 1.00 0.00 H new ATOM 0 HH11 ARG A 92 23.548 16.167 54.461 1.00 0.00 H new ATOM 0 HH12 ARG A 92 23.730 14.744 55.491 1.00 0.00 H new ATOM 0 HH21 ARG A 92 26.756 15.807 56.871 1.00 0.00 H new ATOM 0 HH22 ARG A 92 25.523 14.543 56.837 1.00 0.00 H new ATOM 1453 N LEU A 93 25.284 21.764 54.401 1.00 0.00 N ATOM 1454 CA LEU A 93 26.652 22.230 54.782 1.00 0.00 C ATOM 1455 C LEU A 93 26.616 23.561 55.562 1.00 0.00 C ATOM 1456 O LEU A 93 27.429 23.775 56.462 1.00 0.00 O ATOM 1457 CB LEU A 93 27.392 22.410 53.451 1.00 0.00 C ATOM 1458 CG LEU A 93 28.581 21.448 53.389 1.00 0.00 C ATOM 1459 CD1 LEU A 93 28.105 20.078 52.901 1.00 0.00 C ATOM 1460 CD2 LEU A 93 29.631 21.996 52.420 1.00 0.00 C ATOM 0 H LEU A 93 25.145 21.605 53.403 1.00 0.00 H new ATOM 0 HA LEU A 93 27.141 21.514 55.443 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.715 22.221 52.618 1.00 0.00 H new ATOM 0 HB3 LEU A 93 27.738 23.439 53.352 1.00 0.00 H new ATOM 0 HG LEU A 93 29.019 21.349 54.382 1.00 0.00 H new ATOM 0 HD11 LEU A 93 28.952 19.393 52.857 1.00 0.00 H new ATOM 0 HD12 LEU A 93 27.357 19.686 53.590 1.00 0.00 H new ATOM 0 HD13 LEU A 93 27.667 20.178 51.908 1.00 0.00 H new ATOM 0 HD21 LEU A 93 30.478 21.311 52.376 1.00 0.00 H new ATOM 0 HD22 LEU A 93 29.193 22.096 51.427 1.00 0.00 H new ATOM 0 HD23 LEU A 93 29.971 22.972 52.766 1.00 0.00 H new ATOM 1472 N LEU A 94 25.716 24.458 55.206 1.00 0.00 N ATOM 1473 CA LEU A 94 25.639 25.821 55.855 1.00 0.00 C ATOM 1474 C LEU A 94 25.168 25.744 57.316 1.00 0.00 C ATOM 1475 O LEU A 94 25.251 26.722 58.055 1.00 0.00 O ATOM 1476 CB LEU A 94 24.553 26.554 55.014 1.00 0.00 C ATOM 1477 CG LEU A 94 25.160 27.625 54.091 1.00 0.00 C ATOM 1478 CD1 LEU A 94 25.470 27.022 52.718 1.00 0.00 C ATOM 1479 CD2 LEU A 94 24.141 28.757 53.895 1.00 0.00 C ATOM 0 H LEU A 94 25.018 24.301 54.479 1.00 0.00 H new ATOM 0 HA LEU A 94 26.612 26.312 55.874 1.00 0.00 H new ATOM 0 HB2 LEU A 94 24.007 25.826 54.414 1.00 0.00 H new ATOM 0 HB3 LEU A 94 23.830 27.021 55.684 1.00 0.00 H new ATOM 0 HG LEU A 94 26.076 28.003 54.545 1.00 0.00 H new ATOM 0 HD11 LEU A 94 25.899 27.788 52.073 1.00 0.00 H new ATOM 0 HD12 LEU A 94 26.181 26.204 52.832 1.00 0.00 H new ATOM 0 HD13 LEU A 94 24.551 26.644 52.271 1.00 0.00 H new ATOM 0 HD21 LEU A 94 24.565 29.519 53.242 1.00 0.00 H new ATOM 0 HD22 LEU A 94 23.234 28.356 53.443 1.00 0.00 H new ATOM 0 HD23 LEU A 94 23.900 29.200 54.861 1.00 0.00 H new ATOM 1491 N GLU A 95 24.696 24.612 57.753 1.00 0.00 N ATOM 1492 CA GLU A 95 24.250 24.512 59.180 1.00 0.00 C ATOM 1493 C GLU A 95 24.577 23.133 59.762 1.00 0.00 C ATOM 1494 O GLU A 95 24.486 22.913 60.967 1.00 0.00 O ATOM 1495 CB GLU A 95 22.740 24.735 59.154 1.00 0.00 C ATOM 1496 CG GLU A 95 22.254 25.024 60.576 1.00 0.00 C ATOM 1497 CD GLU A 95 22.218 26.537 60.805 1.00 0.00 C ATOM 1498 OE1 GLU A 95 23.157 27.201 60.396 1.00 0.00 O ATOM 1499 OE2 GLU A 95 21.253 27.006 61.386 1.00 0.00 O ATOM 0 H GLU A 95 24.598 23.761 57.199 1.00 0.00 H new ATOM 0 HA GLU A 95 24.759 25.244 59.808 1.00 0.00 H new ATOM 0 HB2 GLU A 95 22.494 25.568 58.496 1.00 0.00 H new ATOM 0 HB3 GLU A 95 22.236 23.854 58.756 1.00 0.00 H new ATOM 0 HG2 GLU A 95 21.262 24.599 60.726 1.00 0.00 H new ATOM 0 HG3 GLU A 95 22.916 24.551 61.301 1.00 0.00 H new ATOM 1506 N GLN A 96 24.956 22.206 58.930 1.00 0.00 N ATOM 1507 CA GLN A 96 25.291 20.844 59.422 1.00 0.00 C ATOM 1508 C GLN A 96 26.776 20.758 59.768 1.00 0.00 C ATOM 1509 O GLN A 96 27.163 20.059 60.703 1.00 0.00 O ATOM 1510 CB GLN A 96 24.944 19.900 58.269 1.00 0.00 C ATOM 1511 CG GLN A 96 24.894 18.457 58.783 1.00 0.00 C ATOM 1512 CD GLN A 96 23.619 17.774 58.279 1.00 0.00 C ATOM 1513 OE1 GLN A 96 23.664 16.641 57.804 1.00 0.00 O ATOM 1514 NE2 GLN A 96 22.478 18.403 58.356 1.00 0.00 N ATOM 0 H GLN A 96 25.049 22.335 57.922 1.00 0.00 H new ATOM 0 HA GLN A 96 24.742 20.587 60.328 1.00 0.00 H new ATOM 0 HB2 GLN A 96 23.982 20.176 57.836 1.00 0.00 H new ATOM 0 HB3 GLN A 96 25.687 19.989 57.477 1.00 0.00 H new ATOM 0 HG2 GLN A 96 25.772 17.908 58.441 1.00 0.00 H new ATOM 0 HG3 GLN A 96 24.917 18.448 59.873 1.00 0.00 H new ATOM 0 HE21 GLN A 96 22.439 19.343 58.750 1.00 0.00 H new ATOM 0 HE22 GLN A 96 21.625 17.954 58.022 1.00 0.00 H new ATOM 1523 N GLU A 97 27.628 21.440 59.037 1.00 0.00 N ATOM 1524 CA GLU A 97 29.082 21.352 59.362 1.00 0.00 C ATOM 1525 C GLU A 97 29.400 22.162 60.630 1.00 0.00 C ATOM 1526 O GLU A 97 28.523 22.430 61.449 1.00 0.00 O ATOM 1527 CB GLU A 97 29.775 21.936 58.116 1.00 0.00 C ATOM 1528 CG GLU A 97 29.938 23.472 58.199 1.00 0.00 C ATOM 1529 CD GLU A 97 28.755 24.139 58.921 1.00 0.00 C ATOM 1530 OE1 GLU A 97 27.624 23.801 58.625 1.00 0.00 O ATOM 1531 OE2 GLU A 97 29.008 24.981 59.767 1.00 0.00 O ATOM 0 H GLU A 97 27.384 22.039 58.248 1.00 0.00 H new ATOM 0 HA GLU A 97 29.416 20.337 59.575 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.756 21.475 57.999 1.00 0.00 H new ATOM 0 HB3 GLU A 97 29.195 21.682 57.228 1.00 0.00 H new ATOM 0 HG2 GLU A 97 30.864 23.711 58.723 1.00 0.00 H new ATOM 0 HG3 GLU A 97 30.026 23.882 57.193 1.00 0.00 H new ATOM 1538 N THR A 98 30.624 22.592 60.781 1.00 0.00 N ATOM 1539 CA THR A 98 30.984 23.425 61.964 1.00 0.00 C ATOM 1540 C THR A 98 31.138 24.880 61.492 1.00 0.00 C ATOM 1541 O THR A 98 30.275 25.709 61.771 1.00 0.00 O ATOM 1542 CB THR A 98 32.286 22.824 62.521 1.00 0.00 C ATOM 1543 OG1 THR A 98 31.972 21.681 63.304 1.00 0.00 O ATOM 1544 CG2 THR A 98 33.016 23.851 63.395 1.00 0.00 C ATOM 0 H THR A 98 31.391 22.402 60.135 1.00 0.00 H new ATOM 0 HA THR A 98 30.231 23.428 62.752 1.00 0.00 H new ATOM 0 HB THR A 98 32.933 22.544 61.690 1.00 0.00 H new ATOM 0 HG1 THR A 98 32.798 21.292 63.661 1.00 0.00 H new ATOM 0 HG21 THR A 98 33.935 23.411 63.782 1.00 0.00 H new ATOM 0 HG22 THR A 98 33.258 24.731 62.798 1.00 0.00 H new ATOM 0 HG23 THR A 98 32.375 24.142 64.227 1.00 0.00 H new ATOM 1552 N PRO A 99 32.190 25.163 60.750 1.00 0.00 N ATOM 1553 CA PRO A 99 32.370 26.529 60.210 1.00 0.00 C ATOM 1554 C PRO A 99 31.247 26.787 59.209 1.00 0.00 C ATOM 1555 O PRO A 99 30.881 25.895 58.448 1.00 0.00 O ATOM 1556 CB PRO A 99 33.740 26.484 59.532 1.00 0.00 C ATOM 1557 CG PRO A 99 33.955 25.042 59.220 1.00 0.00 C ATOM 1558 CD PRO A 99 33.281 24.271 60.323 1.00 0.00 C ATOM 0 HA PRO A 99 32.331 27.324 60.955 1.00 0.00 H new ATOM 0 HB2 PRO A 99 33.755 27.092 58.628 1.00 0.00 H new ATOM 0 HB3 PRO A 99 34.521 26.869 60.188 1.00 0.00 H new ATOM 0 HG2 PRO A 99 33.530 24.786 58.250 1.00 0.00 H new ATOM 0 HG3 PRO A 99 35.019 24.808 59.174 1.00 0.00 H new ATOM 0 HD2 PRO A 99 32.901 23.313 59.968 1.00 0.00 H new ATOM 0 HD3 PRO A 99 33.968 24.058 61.142 1.00 0.00 H new ATOM 1566 N VAL A 100 30.682 27.957 59.169 1.00 0.00 N ATOM 1567 CA VAL A 100 29.583 28.174 58.183 1.00 0.00 C ATOM 1568 C VAL A 100 30.215 28.382 56.814 1.00 0.00 C ATOM 1569 O VAL A 100 31.200 29.105 56.673 1.00 0.00 O ATOM 1570 CB VAL A 100 28.821 29.433 58.616 1.00 0.00 C ATOM 1571 CG1 VAL A 100 27.361 29.311 58.176 1.00 0.00 C ATOM 1572 CG2 VAL A 100 28.869 29.603 60.139 1.00 0.00 C ATOM 0 H VAL A 100 30.922 28.755 59.757 1.00 0.00 H new ATOM 0 HA VAL A 100 28.899 27.326 58.138 1.00 0.00 H new ATOM 0 HB VAL A 100 29.289 30.300 58.151 1.00 0.00 H new ATOM 0 HG11 VAL A 100 26.813 30.203 58.481 1.00 0.00 H new ATOM 0 HG12 VAL A 100 27.315 29.210 57.092 1.00 0.00 H new ATOM 0 HG13 VAL A 100 26.913 28.433 58.642 1.00 0.00 H new ATOM 0 HG21 VAL A 100 28.322 30.502 60.422 1.00 0.00 H new ATOM 0 HG22 VAL A 100 28.413 28.736 60.616 1.00 0.00 H new ATOM 0 HG23 VAL A 100 29.906 29.692 60.463 1.00 0.00 H new ATOM 1582 N THR A 101 29.697 27.737 55.806 1.00 0.00 N ATOM 1583 CA THR A 101 30.313 27.882 54.461 1.00 0.00 C ATOM 1584 C THR A 101 29.414 28.678 53.524 1.00 0.00 C ATOM 1585 O THR A 101 28.488 28.162 52.903 1.00 0.00 O ATOM 1586 CB THR A 101 30.482 26.463 53.924 1.00 0.00 C ATOM 1587 OG1 THR A 101 29.893 25.529 54.821 1.00 0.00 O ATOM 1588 CG2 THR A 101 31.970 26.144 53.764 1.00 0.00 C ATOM 0 H THR A 101 28.884 27.123 55.855 1.00 0.00 H new ATOM 0 HA THR A 101 31.261 28.417 54.527 1.00 0.00 H new ATOM 0 HB THR A 101 29.988 26.392 52.955 1.00 0.00 H new ATOM 0 HG1 THR A 101 30.004 24.622 54.468 1.00 0.00 H new ATOM 0 HG21 THR A 101 32.086 25.130 53.381 1.00 0.00 H new ATOM 0 HG22 THR A 101 32.420 26.850 53.066 1.00 0.00 H new ATOM 0 HG23 THR A 101 32.465 26.225 54.732 1.00 0.00 H new ATOM 1596 N LEU A 102 29.728 29.920 53.389 1.00 0.00 N ATOM 1597 CA LEU A 102 28.992 30.818 52.475 1.00 0.00 C ATOM 1598 C LEU A 102 30.043 31.550 51.655 1.00 0.00 C ATOM 1599 O LEU A 102 30.032 31.542 50.426 1.00 0.00 O ATOM 1600 CB LEU A 102 28.213 31.781 53.374 1.00 0.00 C ATOM 1601 CG LEU A 102 26.775 31.276 53.549 1.00 0.00 C ATOM 1602 CD1 LEU A 102 26.389 31.333 55.028 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.813 32.156 52.743 1.00 0.00 C ATOM 0 H LEU A 102 30.493 30.370 53.892 1.00 0.00 H new ATOM 0 HA LEU A 102 28.304 30.309 51.800 1.00 0.00 H new ATOM 0 HB2 LEU A 102 28.701 31.862 54.345 1.00 0.00 H new ATOM 0 HB3 LEU A 102 28.207 32.779 52.936 1.00 0.00 H new ATOM 0 HG LEU A 102 26.712 30.248 53.192 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.367 30.974 55.151 1.00 0.00 H new ATOM 0 HD12 LEU A 102 27.067 30.704 55.605 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.458 32.361 55.383 1.00 0.00 H new ATOM 0 HD21 LEU A 102 24.793 31.793 52.871 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.879 33.185 53.096 1.00 0.00 H new ATOM 0 HD23 LEU A 102 26.082 32.117 51.687 1.00 0.00 H new ATOM 1615 N GLU A 103 30.983 32.162 52.345 1.00 0.00 N ATOM 1616 CA GLU A 103 32.105 32.900 51.678 1.00 0.00 C ATOM 1617 C GLU A 103 32.645 32.147 50.448 1.00 0.00 C ATOM 1618 O GLU A 103 32.860 32.736 49.391 1.00 0.00 O ATOM 1619 CB GLU A 103 33.193 33.015 52.747 1.00 0.00 C ATOM 1620 CG GLU A 103 34.003 34.292 52.515 1.00 0.00 C ATOM 1621 CD GLU A 103 35.461 34.053 52.911 1.00 0.00 C ATOM 1622 OE1 GLU A 103 36.012 33.050 52.490 1.00 0.00 O ATOM 1623 OE2 GLU A 103 36.003 34.879 53.627 1.00 0.00 O ATOM 0 H GLU A 103 31.018 32.180 53.364 1.00 0.00 H new ATOM 0 HA GLU A 103 31.769 33.869 51.309 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.742 33.033 53.739 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.848 32.144 52.710 1.00 0.00 H new ATOM 0 HG2 GLU A 103 33.944 34.587 51.467 1.00 0.00 H new ATOM 0 HG3 GLU A 103 33.586 35.111 53.101 1.00 0.00 H new ATOM 1630 N ALA A 104 32.866 30.858 50.559 1.00 0.00 N ATOM 1631 CA ALA A 104 33.389 30.085 49.391 1.00 0.00 C ATOM 1632 C ALA A 104 32.381 30.143 48.236 1.00 0.00 C ATOM 1633 O ALA A 104 32.748 30.375 47.082 1.00 0.00 O ATOM 1634 CB ALA A 104 33.542 28.650 49.897 1.00 0.00 C ATOM 0 H ALA A 104 32.707 30.311 51.405 1.00 0.00 H new ATOM 0 HA ALA A 104 34.332 30.484 49.017 1.00 0.00 H new ATOM 0 HB1 ALA A 104 33.923 28.020 49.094 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.240 28.632 50.734 1.00 0.00 H new ATOM 0 HB3 ALA A 104 32.573 28.274 50.224 1.00 0.00 H new ATOM 1640 N LEU A 105 31.116 29.947 48.520 1.00 0.00 N ATOM 1641 CA LEU A 105 30.099 30.001 47.429 1.00 0.00 C ATOM 1642 C LEU A 105 29.938 31.446 46.954 1.00 0.00 C ATOM 1643 O LEU A 105 29.705 31.711 45.775 1.00 0.00 O ATOM 1644 CB LEU A 105 28.795 29.472 48.040 1.00 0.00 C ATOM 1645 CG LEU A 105 28.301 28.254 47.238 1.00 0.00 C ATOM 1646 CD1 LEU A 105 28.036 27.086 48.189 1.00 0.00 C ATOM 1647 CD2 LEU A 105 27.001 28.605 46.497 1.00 0.00 C ATOM 0 H LEU A 105 30.748 29.754 49.452 1.00 0.00 H new ATOM 0 HA LEU A 105 30.388 29.405 46.563 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.957 29.192 49.081 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.036 30.255 48.035 1.00 0.00 H new ATOM 0 HG LEU A 105 29.066 27.974 46.514 1.00 0.00 H new ATOM 0 HD11 LEU A 105 27.686 26.225 47.619 1.00 0.00 H new ATOM 0 HD12 LEU A 105 28.957 26.826 48.711 1.00 0.00 H new ATOM 0 HD13 LEU A 105 27.276 27.373 48.915 1.00 0.00 H new ATOM 0 HD21 LEU A 105 26.659 27.738 45.932 1.00 0.00 H new ATOM 0 HD22 LEU A 105 26.237 28.893 47.219 1.00 0.00 H new ATOM 0 HD23 LEU A 105 27.184 29.434 45.813 1.00 0.00 H new ATOM 1659 N ALA A 106 30.074 32.384 47.849 1.00 0.00 N ATOM 1660 CA ALA A 106 29.946 33.816 47.458 1.00 0.00 C ATOM 1661 C ALA A 106 31.095 34.196 46.519 1.00 0.00 C ATOM 1662 O ALA A 106 30.892 34.812 45.473 1.00 0.00 O ATOM 1663 CB ALA A 106 30.046 34.593 48.771 1.00 0.00 C ATOM 0 H ALA A 106 30.269 32.221 48.837 1.00 0.00 H new ATOM 0 HA ALA A 106 29.015 34.028 46.933 1.00 0.00 H new ATOM 0 HB1 ALA A 106 29.961 35.661 48.569 1.00 0.00 H new ATOM 0 HB2 ALA A 106 29.242 34.284 49.439 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.007 34.389 49.242 1.00 0.00 H new ATOM 1669 N ASP A 107 32.298 33.830 46.872 1.00 0.00 N ATOM 1670 CA ASP A 107 33.465 34.151 46.018 1.00 0.00 C ATOM 1671 C ASP A 107 33.392 33.377 44.697 1.00 0.00 C ATOM 1672 O ASP A 107 33.882 33.831 43.665 1.00 0.00 O ATOM 1673 CB ASP A 107 34.657 33.700 46.853 1.00 0.00 C ATOM 1674 CG ASP A 107 35.139 34.858 47.726 1.00 0.00 C ATOM 1675 OD1 ASP A 107 34.574 35.046 48.792 1.00 0.00 O ATOM 1676 OD2 ASP A 107 36.064 35.539 47.316 1.00 0.00 O ATOM 0 H ASP A 107 32.518 33.317 47.726 1.00 0.00 H new ATOM 0 HA ASP A 107 33.520 35.205 45.746 1.00 0.00 H new ATOM 0 HB2 ASP A 107 34.376 32.852 47.478 1.00 0.00 H new ATOM 0 HB3 ASP A 107 35.463 33.362 46.202 1.00 0.00 H new ATOM 1681 N GLN A 108 32.794 32.213 44.709 1.00 0.00 N ATOM 1682 CA GLN A 108 32.694 31.408 43.453 1.00 0.00 C ATOM 1683 C GLN A 108 31.695 32.045 42.477 1.00 0.00 C ATOM 1684 O GLN A 108 31.913 32.063 41.267 1.00 0.00 O ATOM 1685 CB GLN A 108 32.195 30.036 43.907 1.00 0.00 C ATOM 1686 CG GLN A 108 32.596 28.976 42.878 1.00 0.00 C ATOM 1687 CD GLN A 108 32.916 27.665 43.597 1.00 0.00 C ATOM 1688 OE1 GLN A 108 34.076 27.369 43.875 1.00 0.00 O ATOM 1689 NE2 GLN A 108 31.943 26.854 43.914 1.00 0.00 N ATOM 0 H GLN A 108 32.371 31.785 45.533 1.00 0.00 H new ATOM 0 HA GLN A 108 33.647 31.349 42.928 1.00 0.00 H new ATOM 0 HB2 GLN A 108 32.617 29.789 44.881 1.00 0.00 H new ATOM 0 HB3 GLN A 108 31.111 30.052 44.023 1.00 0.00 H new ATOM 0 HG2 GLN A 108 31.788 28.823 42.163 1.00 0.00 H new ATOM 0 HG3 GLN A 108 33.464 29.314 42.311 1.00 0.00 H new ATOM 0 HE21 GLN A 108 30.980 27.098 43.684 1.00 0.00 H new ATOM 0 HE22 GLN A 108 32.146 25.976 44.392 1.00 0.00 H new ATOM 1698 N VAL A 109 30.600 32.556 42.976 1.00 0.00 N ATOM 1699 CA VAL A 109 29.582 33.177 42.076 1.00 0.00 C ATOM 1700 C VAL A 109 29.827 34.684 41.925 1.00 0.00 C ATOM 1701 O VAL A 109 29.201 35.341 41.096 1.00 0.00 O ATOM 1702 CB VAL A 109 28.236 32.932 42.760 1.00 0.00 C ATOM 1703 CG1 VAL A 109 27.105 33.297 41.798 1.00 0.00 C ATOM 1704 CG2 VAL A 109 28.111 31.459 43.151 1.00 0.00 C ATOM 0 H VAL A 109 30.366 32.570 43.969 1.00 0.00 H new ATOM 0 HA VAL A 109 29.623 32.749 41.074 1.00 0.00 H new ATOM 0 HB VAL A 109 28.172 33.549 43.657 1.00 0.00 H new ATOM 0 HG11 VAL A 109 26.144 33.123 42.283 1.00 0.00 H new ATOM 0 HG12 VAL A 109 27.187 34.348 41.522 1.00 0.00 H new ATOM 0 HG13 VAL A 109 27.176 32.680 40.902 1.00 0.00 H new ATOM 0 HG21 VAL A 109 27.150 31.292 43.638 1.00 0.00 H new ATOM 0 HG22 VAL A 109 28.178 30.838 42.257 1.00 0.00 H new ATOM 0 HG23 VAL A 109 28.916 31.195 43.837 1.00 0.00 H new ATOM 1714 N ALA A 110 30.714 35.246 42.716 1.00 0.00 N ATOM 1715 CA ALA A 110 31.005 36.718 42.635 1.00 0.00 C ATOM 1716 C ALA A 110 29.923 37.510 43.374 1.00 0.00 C ATOM 1717 O ALA A 110 29.629 38.657 43.042 1.00 0.00 O ATOM 1718 CB ALA A 110 31.027 37.083 41.145 1.00 0.00 C ATOM 0 H ALA A 110 31.254 34.744 43.421 1.00 0.00 H new ATOM 0 HA ALA A 110 31.959 36.960 43.103 1.00 0.00 H new ATOM 0 HB1 ALA A 110 31.236 38.147 41.034 1.00 0.00 H new ATOM 0 HB2 ALA A 110 31.803 36.507 40.641 1.00 0.00 H new ATOM 0 HB3 ALA A 110 30.058 36.855 40.700 1.00 0.00 H new ATOM 1724 N MET A 111 29.325 36.912 44.378 1.00 0.00 N ATOM 1725 CA MET A 111 28.260 37.622 45.150 1.00 0.00 C ATOM 1726 C MET A 111 28.373 37.330 46.660 1.00 0.00 C ATOM 1727 O MET A 111 29.051 36.400 47.084 1.00 0.00 O ATOM 1728 CB MET A 111 26.944 37.084 44.586 1.00 0.00 C ATOM 1729 CG MET A 111 26.984 35.555 44.533 1.00 0.00 C ATOM 1730 SD MET A 111 25.323 34.895 44.807 1.00 0.00 S ATOM 1731 CE MET A 111 24.772 34.929 43.083 1.00 0.00 C ATOM 0 H MET A 111 29.530 35.964 44.694 1.00 0.00 H new ATOM 0 HA MET A 111 28.340 38.704 45.050 1.00 0.00 H new ATOM 0 HB2 MET A 111 26.111 37.413 45.207 1.00 0.00 H new ATOM 0 HB3 MET A 111 26.775 37.487 43.587 1.00 0.00 H new ATOM 0 HG2 MET A 111 27.363 35.224 43.566 1.00 0.00 H new ATOM 0 HG3 MET A 111 27.668 35.173 45.291 1.00 0.00 H new ATOM 0 HE1 MET A 111 23.739 35.275 43.038 1.00 0.00 H new ATOM 0 HE2 MET A 111 25.407 35.606 42.511 1.00 0.00 H new ATOM 0 HE3 MET A 111 24.838 33.927 42.660 1.00 0.00 H new ATOM 1741 N SER A 112 27.720 38.129 47.472 1.00 0.00 N ATOM 1742 CA SER A 112 27.762 37.950 48.967 1.00 0.00 C ATOM 1743 C SER A 112 26.935 36.728 49.415 1.00 0.00 C ATOM 1744 O SER A 112 26.210 36.143 48.614 1.00 0.00 O ATOM 1745 CB SER A 112 27.156 39.238 49.527 1.00 0.00 C ATOM 1746 OG SER A 112 26.109 39.679 48.672 1.00 0.00 O ATOM 0 H SER A 112 27.148 38.913 47.159 1.00 0.00 H new ATOM 0 HA SER A 112 28.777 37.772 49.322 1.00 0.00 H new ATOM 0 HB2 SER A 112 26.771 39.065 50.532 1.00 0.00 H new ATOM 0 HB3 SER A 112 27.923 40.008 49.608 1.00 0.00 H new ATOM 0 HG SER A 112 25.719 40.503 49.031 1.00 0.00 H new ATOM 1752 N PRO A 113 27.057 36.371 50.684 1.00 0.00 N ATOM 1753 CA PRO A 113 26.296 35.203 51.227 1.00 0.00 C ATOM 1754 C PRO A 113 24.792 35.437 51.104 1.00 0.00 C ATOM 1755 O PRO A 113 24.038 34.526 50.745 1.00 0.00 O ATOM 1756 CB PRO A 113 26.750 35.137 52.686 1.00 0.00 C ATOM 1757 CG PRO A 113 27.226 36.517 52.992 1.00 0.00 C ATOM 1758 CD PRO A 113 27.870 37.012 51.725 1.00 0.00 C ATOM 0 HA PRO A 113 26.484 34.271 50.693 1.00 0.00 H new ATOM 0 HB2 PRO A 113 25.931 34.845 53.344 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.545 34.404 52.821 1.00 0.00 H new ATOM 0 HG2 PRO A 113 26.398 37.161 53.288 1.00 0.00 H new ATOM 0 HG3 PRO A 113 27.938 36.512 53.818 1.00 0.00 H new ATOM 0 HD2 PRO A 113 27.839 38.099 51.652 1.00 0.00 H new ATOM 0 HD3 PRO A 113 28.918 36.718 51.660 1.00 0.00 H new ATOM 1766 N PHE A 114 24.328 36.637 51.334 1.00 0.00 N ATOM 1767 CA PHE A 114 22.872 36.876 51.166 1.00 0.00 C ATOM 1768 C PHE A 114 22.524 36.797 49.685 1.00 0.00 C ATOM 1769 O PHE A 114 21.458 36.299 49.321 1.00 0.00 O ATOM 1770 CB PHE A 114 22.562 38.261 51.726 1.00 0.00 C ATOM 1771 CG PHE A 114 22.670 38.261 53.235 1.00 0.00 C ATOM 1772 CD1 PHE A 114 23.091 37.118 53.931 1.00 0.00 C ATOM 1773 CD2 PHE A 114 22.344 39.420 53.937 1.00 0.00 C ATOM 1774 CE1 PHE A 114 23.188 37.144 55.326 1.00 0.00 C ATOM 1775 CE2 PHE A 114 22.437 39.447 55.330 1.00 0.00 C ATOM 1776 CZ PHE A 114 22.864 38.310 56.026 1.00 0.00 C ATOM 0 H PHE A 114 24.882 37.443 51.624 1.00 0.00 H new ATOM 0 HA PHE A 114 22.281 36.128 51.695 1.00 0.00 H new ATOM 0 HB2 PHE A 114 23.253 38.992 51.306 1.00 0.00 H new ATOM 0 HB3 PHE A 114 21.558 38.564 51.428 1.00 0.00 H new ATOM 0 HD1 PHE A 114 23.340 36.218 53.389 1.00 0.00 H new ATOM 0 HD2 PHE A 114 22.018 40.300 53.402 1.00 0.00 H new ATOM 0 HE1 PHE A 114 23.513 36.264 55.862 1.00 0.00 H new ATOM 0 HE2 PHE A 114 22.179 40.346 55.871 1.00 0.00 H new ATOM 0 HZ PHE A 114 22.943 38.334 57.103 1.00 0.00 H new ATOM 1786 N HIS A 115 23.395 37.235 48.805 1.00 0.00 N ATOM 1787 CA HIS A 115 23.041 37.106 47.374 1.00 0.00 C ATOM 1788 C HIS A 115 23.079 35.619 46.957 1.00 0.00 C ATOM 1789 O HIS A 115 22.304 35.180 46.110 1.00 0.00 O ATOM 1790 CB HIS A 115 23.979 37.940 46.533 1.00 0.00 C ATOM 1791 CG HIS A 115 23.251 38.096 45.238 1.00 0.00 C ATOM 1792 ND1 HIS A 115 23.741 37.604 44.048 1.00 0.00 N ATOM 1793 CD2 HIS A 115 21.982 38.547 44.971 1.00 0.00 C ATOM 1794 CE1 HIS A 115 22.776 37.749 43.129 1.00 0.00 C ATOM 1795 NE2 HIS A 115 21.677 38.323 43.638 1.00 0.00 N ATOM 0 H HIS A 115 24.299 37.659 49.013 1.00 0.00 H new ATOM 0 HA HIS A 115 22.028 37.476 47.213 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.182 38.905 46.997 1.00 0.00 H new ATOM 0 HB3 HIS A 115 24.940 37.445 46.395 1.00 0.00 H new ATOM 0 HD2 HIS A 115 21.321 39.007 45.691 1.00 0.00 H new ATOM 0 HE1 HIS A 115 22.873 37.439 42.099 1.00 0.00 H new ATOM 0 HE2 HIS A 115 20.808 38.546 43.152 1.00 0.00 H new ATOM 1803 N LEU A 116 23.915 34.823 47.587 1.00 0.00 N ATOM 1804 CA LEU A 116 23.944 33.356 47.287 1.00 0.00 C ATOM 1805 C LEU A 116 22.555 32.803 47.575 1.00 0.00 C ATOM 1806 O LEU A 116 21.977 32.067 46.778 1.00 0.00 O ATOM 1807 CB LEU A 116 24.967 32.767 48.263 1.00 0.00 C ATOM 1808 CG LEU A 116 25.470 31.417 47.743 1.00 0.00 C ATOM 1809 CD1 LEU A 116 24.290 30.450 47.578 1.00 0.00 C ATOM 1810 CD2 LEU A 116 26.164 31.620 46.391 1.00 0.00 C ATOM 0 H LEU A 116 24.579 35.129 48.298 1.00 0.00 H new ATOM 0 HA LEU A 116 24.209 33.123 46.256 1.00 0.00 H new ATOM 0 HB2 LEU A 116 25.804 33.454 48.384 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.513 32.641 49.246 1.00 0.00 H new ATOM 0 HG LEU A 116 26.178 30.996 48.457 1.00 0.00 H new ATOM 0 HD11 LEU A 116 24.654 29.492 47.208 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.801 30.305 48.541 1.00 0.00 H new ATOM 0 HD13 LEU A 116 23.576 30.866 46.867 1.00 0.00 H new ATOM 0 HD21 LEU A 116 26.523 30.661 46.019 1.00 0.00 H new ATOM 0 HD22 LEU A 116 25.456 32.044 45.679 1.00 0.00 H new ATOM 0 HD23 LEU A 116 27.007 32.300 46.513 1.00 0.00 H new ATOM 1822 N HIS A 117 21.992 33.187 48.688 1.00 0.00 N ATOM 1823 CA HIS A 117 20.616 32.731 49.015 1.00 0.00 C ATOM 1824 C HIS A 117 19.656 33.273 47.940 1.00 0.00 C ATOM 1825 O HIS A 117 18.767 32.566 47.466 1.00 0.00 O ATOM 1826 CB HIS A 117 20.336 33.291 50.402 1.00 0.00 C ATOM 1827 CG HIS A 117 21.105 32.460 51.390 1.00 0.00 C ATOM 1828 ND1 HIS A 117 20.767 31.142 51.658 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.216 32.722 52.154 1.00 0.00 C ATOM 1830 CE1 HIS A 117 21.657 30.666 52.547 1.00 0.00 C ATOM 1831 NE2 HIS A 117 22.561 31.588 52.884 1.00 0.00 N ATOM 0 H HIS A 117 22.426 33.795 49.382 1.00 0.00 H new ATOM 0 HA HIS A 117 20.491 31.648 49.022 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.640 34.336 50.462 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.269 33.256 50.621 1.00 0.00 H new ATOM 0 HD1 HIS A 117 19.985 30.627 51.254 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.742 33.665 52.184 1.00 0.00 H new ATOM 0 HE1 HIS A 117 21.642 29.660 52.940 1.00 0.00 H new ATOM 1839 N ARG A 118 19.869 34.488 47.489 1.00 0.00 N ATOM 1840 CA ARG A 118 19.022 35.061 46.386 1.00 0.00 C ATOM 1841 C ARG A 118 19.170 34.187 45.112 1.00 0.00 C ATOM 1842 O ARG A 118 18.210 33.977 44.375 1.00 0.00 O ATOM 1843 CB ARG A 118 19.571 36.467 46.143 1.00 0.00 C ATOM 1844 CG ARG A 118 18.405 37.436 45.911 1.00 0.00 C ATOM 1845 CD ARG A 118 18.364 38.477 47.034 1.00 0.00 C ATOM 1846 NE ARG A 118 18.318 37.693 48.299 1.00 0.00 N ATOM 1847 CZ ARG A 118 17.185 37.209 48.750 1.00 0.00 C ATOM 1848 NH1 ARG A 118 16.064 37.400 48.100 1.00 0.00 N ATOM 1849 NH2 ARG A 118 17.176 36.527 49.862 1.00 0.00 N ATOM 0 H ARG A 118 20.596 35.112 47.838 1.00 0.00 H new ATOM 0 HA ARG A 118 17.963 35.086 46.643 1.00 0.00 H new ATOM 0 HB2 ARG A 118 20.163 36.791 46.999 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.235 36.466 45.278 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.519 37.932 44.947 1.00 0.00 H new ATOM 0 HG3 ARG A 118 17.464 36.886 45.878 1.00 0.00 H new ATOM 0 HD2 ARG A 118 19.242 39.122 47.004 1.00 0.00 H new ATOM 0 HD3 ARG A 118 17.491 39.122 46.940 1.00 0.00 H new ATOM 0 HE ARG A 118 19.179 37.530 48.822 1.00 0.00 H new ATOM 0 HH11 ARG A 118 16.063 37.932 47.230 1.00 0.00 H new ATOM 0 HH12 ARG A 118 15.192 37.017 48.464 1.00 0.00 H new ATOM 0 HH21 ARG A 118 18.045 36.374 50.373 1.00 0.00 H new ATOM 0 HH22 ARG A 118 16.300 36.147 50.220 1.00 0.00 H new ATOM 1863 N LEU A 119 20.345 33.631 44.873 1.00 0.00 N ATOM 1864 CA LEU A 119 20.563 32.713 43.687 1.00 0.00 C ATOM 1865 C LEU A 119 19.797 31.387 43.941 1.00 0.00 C ATOM 1866 O LEU A 119 19.053 30.895 43.095 1.00 0.00 O ATOM 1867 CB LEU A 119 22.096 32.517 43.664 1.00 0.00 C ATOM 1868 CG LEU A 119 22.553 31.336 42.780 1.00 0.00 C ATOM 1869 CD1 LEU A 119 22.781 30.100 43.658 1.00 0.00 C ATOM 1870 CD2 LEU A 119 21.521 31.015 41.691 1.00 0.00 C ATOM 0 H LEU A 119 21.172 33.774 45.453 1.00 0.00 H new ATOM 0 HA LEU A 119 20.200 33.097 42.734 1.00 0.00 H new ATOM 0 HB2 LEU A 119 22.566 33.433 43.305 1.00 0.00 H new ATOM 0 HB3 LEU A 119 22.449 32.356 44.683 1.00 0.00 H new ATOM 0 HG LEU A 119 23.482 31.620 42.287 1.00 0.00 H new ATOM 0 HD11 LEU A 119 23.104 29.266 43.035 1.00 0.00 H new ATOM 0 HD12 LEU A 119 23.549 30.317 44.400 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.852 29.837 44.164 1.00 0.00 H new ATOM 0 HD21 LEU A 119 21.876 30.179 41.088 1.00 0.00 H new ATOM 0 HD22 LEU A 119 20.572 30.750 42.156 1.00 0.00 H new ATOM 0 HD23 LEU A 119 21.381 31.888 41.054 1.00 0.00 H new ATOM 1882 N PHE A 120 19.932 30.855 45.134 1.00 0.00 N ATOM 1883 CA PHE A 120 19.198 29.603 45.573 1.00 0.00 C ATOM 1884 C PHE A 120 17.686 29.777 45.238 1.00 0.00 C ATOM 1885 O PHE A 120 17.033 28.857 44.751 1.00 0.00 O ATOM 1886 CB PHE A 120 19.494 29.634 47.105 1.00 0.00 C ATOM 1887 CG PHE A 120 19.345 28.297 47.828 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.172 27.559 47.682 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.349 27.840 48.728 1.00 0.00 C ATOM 1890 CE1 PHE A 120 17.982 26.373 48.397 1.00 0.00 C ATOM 1891 CE2 PHE A 120 20.147 26.656 49.457 1.00 0.00 C ATOM 1892 CZ PHE A 120 18.962 25.924 49.287 1.00 0.00 C ATOM 0 H PHE A 120 20.541 31.246 45.853 1.00 0.00 H new ATOM 0 HA PHE A 120 19.489 28.663 45.104 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.511 29.997 47.254 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.826 30.357 47.572 1.00 0.00 H new ATOM 0 HD1 PHE A 120 17.402 27.907 47.010 1.00 0.00 H new ATOM 0 HD2 PHE A 120 21.263 28.402 48.850 1.00 0.00 H new ATOM 0 HE1 PHE A 120 17.075 25.802 48.261 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.902 26.310 50.147 1.00 0.00 H new ATOM 0 HZ PHE A 120 18.807 25.012 49.845 1.00 0.00 H new ATOM 1902 N LYS A 121 17.142 30.964 45.447 1.00 0.00 N ATOM 1903 CA LYS A 121 15.695 31.246 45.103 1.00 0.00 C ATOM 1904 C LYS A 121 15.544 31.424 43.584 1.00 0.00 C ATOM 1905 O LYS A 121 14.564 30.995 42.983 1.00 0.00 O ATOM 1906 CB LYS A 121 15.381 32.578 45.784 1.00 0.00 C ATOM 1907 CG LYS A 121 14.055 33.139 45.248 1.00 0.00 C ATOM 1908 CD LYS A 121 14.334 34.096 44.084 1.00 0.00 C ATOM 1909 CE LYS A 121 14.232 35.544 44.572 1.00 0.00 C ATOM 1910 NZ LYS A 121 13.760 36.317 43.388 1.00 0.00 N ATOM 0 H LYS A 121 17.643 31.758 45.845 1.00 0.00 H new ATOM 0 HA LYS A 121 15.037 30.438 45.422 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.317 32.439 46.863 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.187 33.289 45.601 1.00 0.00 H new ATOM 0 HG2 LYS A 121 13.412 32.324 44.916 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.522 33.662 46.042 1.00 0.00 H new ATOM 0 HD2 LYS A 121 15.327 33.908 43.676 1.00 0.00 H new ATOM 0 HD3 LYS A 121 13.621 33.922 43.278 1.00 0.00 H new ATOM 0 HE2 LYS A 121 13.534 35.632 45.405 1.00 0.00 H new ATOM 0 HE3 LYS A 121 15.196 35.911 44.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 13.665 37.321 43.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 14.448 36.220 42.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.837 35.950 43.079 1.00 0.00 H new ATOM 1924 N ALA A 122 16.511 32.053 42.959 1.00 0.00 N ATOM 1925 CA ALA A 122 16.450 32.262 41.483 1.00 0.00 C ATOM 1926 C ALA A 122 16.370 30.901 40.794 1.00 0.00 C ATOM 1927 O ALA A 122 15.463 30.633 40.010 1.00 0.00 O ATOM 1928 CB ALA A 122 17.754 32.978 41.123 1.00 0.00 C ATOM 0 H ALA A 122 17.342 32.431 43.413 1.00 0.00 H new ATOM 0 HA ALA A 122 15.583 32.843 41.170 1.00 0.00 H new ATOM 0 HB1 ALA A 122 17.781 33.166 40.050 1.00 0.00 H new ATOM 0 HB2 ALA A 122 17.809 33.926 41.659 1.00 0.00 H new ATOM 0 HB3 ALA A 122 18.602 32.353 41.404 1.00 0.00 H new ATOM 1934 N THR A 123 17.307 30.038 41.077 1.00 0.00 N ATOM 1935 CA THR A 123 17.283 28.683 40.435 1.00 0.00 C ATOM 1936 C THR A 123 16.093 27.852 40.978 1.00 0.00 C ATOM 1937 O THR A 123 15.192 27.491 40.225 1.00 0.00 O ATOM 1938 CB THR A 123 18.618 28.033 40.807 1.00 0.00 C ATOM 1939 OG1 THR A 123 19.630 29.026 40.850 1.00 0.00 O ATOM 1940 CG2 THR A 123 18.985 26.984 39.756 1.00 0.00 C ATOM 0 H THR A 123 18.083 30.205 41.718 1.00 0.00 H new ATOM 0 HA THR A 123 17.156 28.744 39.354 1.00 0.00 H new ATOM 0 HB THR A 123 18.530 27.557 41.783 1.00 0.00 H new ATOM 0 HG1 THR A 123 20.401 28.730 40.323 1.00 0.00 H new ATOM 0 HG21 THR A 123 19.936 26.521 40.021 1.00 0.00 H new ATOM 0 HG22 THR A 123 18.208 26.221 39.717 1.00 0.00 H new ATOM 0 HG23 THR A 123 19.073 27.462 38.780 1.00 0.00 H new ATOM 1948 N THR A 124 16.034 27.591 42.272 1.00 0.00 N ATOM 1949 CA THR A 124 14.855 26.841 42.857 1.00 0.00 C ATOM 1950 C THR A 124 13.571 27.521 42.374 1.00 0.00 C ATOM 1951 O THR A 124 12.548 26.882 42.141 1.00 0.00 O ATOM 1952 CB THR A 124 15.011 26.925 44.386 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.428 25.773 44.978 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.322 28.177 44.937 1.00 0.00 C ATOM 0 H THR A 124 16.748 27.863 42.948 1.00 0.00 H new ATOM 0 HA THR A 124 14.812 25.796 42.550 1.00 0.00 H new ATOM 0 HB THR A 124 16.073 26.978 44.625 1.00 0.00 H new ATOM 0 HG1 THR A 124 14.370 25.897 45.948 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.446 28.214 46.019 1.00 0.00 H new ATOM 0 HG22 THR A 124 14.769 29.065 44.490 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.260 28.144 44.694 1.00 0.00 H new ATOM 1962 N GLY A 125 13.628 28.822 42.198 1.00 0.00 N ATOM 1963 CA GLY A 125 12.445 29.585 41.703 1.00 0.00 C ATOM 1964 C GLY A 125 11.805 30.512 42.759 1.00 0.00 C ATOM 1965 O GLY A 125 11.417 31.623 42.403 1.00 0.00 O ATOM 0 H GLY A 125 14.456 29.390 42.380 1.00 0.00 H new ATOM 0 HA2 GLY A 125 12.746 30.184 40.844 1.00 0.00 H new ATOM 0 HA3 GLY A 125 11.693 28.879 41.351 1.00 0.00 H new ATOM 1969 N MET A 126 11.665 30.153 44.018 1.00 0.00 N ATOM 1970 CA MET A 126 11.016 31.155 44.945 1.00 0.00 C ATOM 1971 C MET A 126 11.311 30.941 46.443 1.00 0.00 C ATOM 1972 O MET A 126 10.392 30.977 47.262 1.00 0.00 O ATOM 1973 CB MET A 126 9.514 30.976 44.701 1.00 0.00 C ATOM 1974 CG MET A 126 9.074 31.815 43.501 1.00 0.00 C ATOM 1975 SD MET A 126 7.352 32.327 43.719 1.00 0.00 S ATOM 1976 CE MET A 126 6.889 32.315 41.970 1.00 0.00 C ATOM 0 H MET A 126 11.951 29.265 44.430 1.00 0.00 H new ATOM 0 HA MET A 126 11.405 32.150 44.729 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.289 29.925 44.522 1.00 0.00 H new ATOM 0 HB3 MET A 126 8.955 31.275 45.588 1.00 0.00 H new ATOM 0 HG2 MET A 126 9.715 32.691 43.402 1.00 0.00 H new ATOM 0 HG3 MET A 126 9.179 31.238 42.582 1.00 0.00 H new ATOM 0 HE1 MET A 126 5.844 32.606 41.868 1.00 0.00 H new ATOM 0 HE2 MET A 126 7.517 33.018 41.423 1.00 0.00 H new ATOM 0 HE3 MET A 126 7.027 31.313 41.564 1.00 0.00 H new ATOM 1986 N THR A 127 12.548 30.773 46.842 1.00 0.00 N ATOM 1987 CA THR A 127 12.843 30.613 48.296 1.00 0.00 C ATOM 1988 C THR A 127 14.357 30.670 48.549 1.00 0.00 C ATOM 1989 O THR A 127 15.008 29.633 48.614 1.00 0.00 O ATOM 1990 CB THR A 127 12.317 29.235 48.676 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.139 28.924 47.946 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.003 29.252 50.155 1.00 0.00 C ATOM 0 H THR A 127 13.361 30.740 46.226 1.00 0.00 H new ATOM 0 HA THR A 127 12.380 31.408 48.881 1.00 0.00 H new ATOM 0 HB THR A 127 13.067 28.479 48.443 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.474 29.631 48.081 1.00 0.00 H new ATOM 0 HG21 THR A 127 11.623 28.276 50.458 1.00 0.00 H new ATOM 0 HG22 THR A 127 12.909 29.479 50.717 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.250 30.013 50.358 1.00 0.00 H new ATOM 2000 N PRO A 128 14.898 31.854 48.690 1.00 0.00 N ATOM 2001 CA PRO A 128 16.364 31.956 48.903 1.00 0.00 C ATOM 2002 C PRO A 128 16.810 31.439 50.275 1.00 0.00 C ATOM 2003 O PRO A 128 16.820 30.235 50.520 1.00 0.00 O ATOM 2004 CB PRO A 128 16.622 33.459 48.733 1.00 0.00 C ATOM 2005 CG PRO A 128 15.322 34.126 49.060 1.00 0.00 C ATOM 2006 CD PRO A 128 14.226 33.161 48.694 1.00 0.00 C ATOM 0 HA PRO A 128 16.934 31.337 48.211 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.416 33.799 49.398 1.00 0.00 H new ATOM 0 HB3 PRO A 128 16.937 33.691 47.716 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.275 34.379 50.119 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.216 35.058 48.504 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.410 33.189 49.416 1.00 0.00 H new ATOM 0 HD3 PRO A 128 13.797 33.393 47.719 1.00 0.00 H new ATOM 2014 N LYS A 129 17.222 32.311 51.165 1.00 0.00 N ATOM 2015 CA LYS A 129 17.708 31.845 52.491 1.00 0.00 C ATOM 2016 C LYS A 129 16.610 31.082 53.241 1.00 0.00 C ATOM 2017 O LYS A 129 16.892 30.269 54.121 1.00 0.00 O ATOM 2018 CB LYS A 129 18.109 33.102 53.243 1.00 0.00 C ATOM 2019 CG LYS A 129 19.252 32.779 54.199 1.00 0.00 C ATOM 2020 CD LYS A 129 19.718 34.067 54.877 1.00 0.00 C ATOM 2021 CE LYS A 129 21.247 34.190 54.791 1.00 0.00 C ATOM 2022 NZ LYS A 129 21.796 32.893 55.291 1.00 0.00 N ATOM 0 H LYS A 129 17.241 33.321 51.026 1.00 0.00 H new ATOM 0 HA LYS A 129 18.545 31.154 52.391 1.00 0.00 H new ATOM 0 HB2 LYS A 129 18.416 33.877 52.540 1.00 0.00 H new ATOM 0 HB3 LYS A 129 17.257 33.494 53.798 1.00 0.00 H new ATOM 0 HG2 LYS A 129 18.923 32.058 54.948 1.00 0.00 H new ATOM 0 HG3 LYS A 129 20.078 32.320 53.656 1.00 0.00 H new ATOM 0 HD2 LYS A 129 19.249 34.928 54.400 1.00 0.00 H new ATOM 0 HD3 LYS A 129 19.404 34.071 55.921 1.00 0.00 H new ATOM 0 HE2 LYS A 129 21.566 34.379 53.766 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.605 35.024 55.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 22.746 33.047 55.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 21.171 32.514 56.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 21.854 32.214 54.505 1.00 0.00 H new ATOM 2036 N ALA A 130 15.371 31.315 52.907 1.00 0.00 N ATOM 2037 CA ALA A 130 14.262 30.584 53.604 1.00 0.00 C ATOM 2038 C ALA A 130 14.304 29.099 53.208 1.00 0.00 C ATOM 2039 O ALA A 130 14.158 28.223 54.060 1.00 0.00 O ATOM 2040 CB ALA A 130 12.970 31.236 53.102 1.00 0.00 C ATOM 0 H ALA A 130 15.074 31.974 52.187 1.00 0.00 H new ATOM 0 HA ALA A 130 14.341 30.639 54.690 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.113 30.752 53.570 1.00 0.00 H new ATOM 0 HB2 ALA A 130 12.973 32.295 53.359 1.00 0.00 H new ATOM 0 HB3 ALA A 130 12.903 31.125 52.020 1.00 0.00 H new ATOM 2046 N TRP A 131 14.551 28.777 51.947 1.00 0.00 N ATOM 2047 CA TRP A 131 14.647 27.332 51.587 1.00 0.00 C ATOM 2048 C TRP A 131 15.847 26.732 52.299 1.00 0.00 C ATOM 2049 O TRP A 131 15.832 25.570 52.697 1.00 0.00 O ATOM 2050 CB TRP A 131 14.841 27.274 50.076 1.00 0.00 C ATOM 2051 CG TRP A 131 13.814 26.386 49.438 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.043 25.667 48.317 1.00 0.00 C ATOM 2053 CD2 TRP A 131 12.436 26.087 49.842 1.00 0.00 C ATOM 2054 NE1 TRP A 131 12.901 24.957 47.994 1.00 0.00 N ATOM 2055 CE2 TRP A 131 11.886 25.179 48.901 1.00 0.00 C ATOM 2056 CE3 TRP A 131 11.614 26.504 50.908 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 10.577 24.707 49.016 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 10.297 26.029 51.025 1.00 0.00 C ATOM 2059 CH2 TRP A 131 9.781 25.132 50.080 1.00 0.00 C ATOM 0 H TRP A 131 14.685 29.437 51.181 1.00 0.00 H new ATOM 0 HA TRP A 131 13.758 26.774 51.880 1.00 0.00 H new ATOM 0 HB2 TRP A 131 14.770 28.278 49.657 1.00 0.00 H new ATOM 0 HB3 TRP A 131 15.840 26.903 49.848 1.00 0.00 H new ATOM 0 HD1 TRP A 131 14.969 25.650 47.762 1.00 0.00 H new ATOM 0 HE1 TRP A 131 12.819 24.344 47.183 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.000 27.195 51.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 10.183 24.017 48.285 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 9.679 26.357 51.848 1.00 0.00 H new ATOM 0 HH2 TRP A 131 8.768 24.770 50.175 1.00 0.00 H new ATOM 2070 N GLN A 132 16.877 27.505 52.508 1.00 0.00 N ATOM 2071 CA GLN A 132 18.059 26.970 53.243 1.00 0.00 C ATOM 2072 C GLN A 132 17.641 26.672 54.689 1.00 0.00 C ATOM 2073 O GLN A 132 17.985 25.642 55.262 1.00 0.00 O ATOM 2074 CB GLN A 132 19.100 28.094 53.200 1.00 0.00 C ATOM 2075 CG GLN A 132 20.318 27.707 54.046 1.00 0.00 C ATOM 2076 CD GLN A 132 20.606 28.808 55.069 1.00 0.00 C ATOM 2077 OE1 GLN A 132 21.755 29.206 55.252 1.00 0.00 O ATOM 2078 NE2 GLN A 132 19.619 29.328 55.749 1.00 0.00 N ATOM 0 H GLN A 132 16.952 28.476 52.205 1.00 0.00 H new ATOM 0 HA GLN A 132 18.454 26.050 52.811 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.405 28.280 52.170 1.00 0.00 H new ATOM 0 HB3 GLN A 132 18.664 29.020 53.575 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.133 26.762 54.557 1.00 0.00 H new ATOM 0 HG3 GLN A 132 21.186 27.558 53.404 1.00 0.00 H new ATOM 0 HE21 GLN A 132 18.666 28.998 55.597 1.00 0.00 H new ATOM 0 HE22 GLN A 132 19.802 30.064 56.431 1.00 0.00 H new ATOM 2087 N GLN A 133 16.892 27.563 55.280 1.00 0.00 N ATOM 2088 CA GLN A 133 16.435 27.352 56.682 1.00 0.00 C ATOM 2089 C GLN A 133 15.510 26.132 56.756 1.00 0.00 C ATOM 2090 O GLN A 133 15.547 25.363 57.715 1.00 0.00 O ATOM 2091 CB GLN A 133 15.675 28.630 57.044 1.00 0.00 C ATOM 2092 CG GLN A 133 15.800 28.893 58.546 1.00 0.00 C ATOM 2093 CD GLN A 133 15.353 30.325 58.850 1.00 0.00 C ATOM 2094 OE1 GLN A 133 16.105 31.105 59.429 1.00 0.00 O ATOM 2095 NE2 GLN A 133 14.162 30.713 58.487 1.00 0.00 N ATOM 0 H GLN A 133 16.576 28.432 54.849 1.00 0.00 H new ATOM 0 HA GLN A 133 17.262 27.163 57.366 1.00 0.00 H new ATOM 0 HB2 GLN A 133 16.075 29.474 56.482 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.625 28.532 56.768 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.188 28.183 59.103 1.00 0.00 H new ATOM 0 HG3 GLN A 133 16.831 28.746 58.868 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.539 30.064 58.006 1.00 0.00 H new ATOM 0 HE22 GLN A 133 13.854 31.665 58.684 1.00 0.00 H new ATOM 2104 N ALA A 134 14.681 25.939 55.762 1.00 0.00 N ATOM 2105 CA ALA A 134 13.757 24.766 55.783 1.00 0.00 C ATOM 2106 C ALA A 134 14.547 23.473 55.612 1.00 0.00 C ATOM 2107 O ALA A 134 14.536 22.606 56.484 1.00 0.00 O ATOM 2108 CB ALA A 134 12.804 24.977 54.606 1.00 0.00 C ATOM 0 H ALA A 134 14.604 26.540 54.941 1.00 0.00 H new ATOM 0 HA ALA A 134 13.216 24.687 56.726 1.00 0.00 H new ATOM 0 HB1 ALA A 134 12.095 24.151 54.560 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.262 25.913 54.740 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.375 25.018 53.678 1.00 0.00 H new ATOM 2114 N TRP A 135 15.245 23.331 54.516 1.00 0.00 N ATOM 2115 CA TRP A 135 16.062 22.094 54.295 1.00 0.00 C ATOM 2116 C TRP A 135 16.830 21.745 55.570 1.00 0.00 C ATOM 2117 O TRP A 135 16.822 20.612 56.042 1.00 0.00 O ATOM 2118 CB TRP A 135 17.049 22.501 53.226 1.00 0.00 C ATOM 2119 CG TRP A 135 16.388 22.691 51.910 1.00 0.00 C ATOM 2120 CD1 TRP A 135 17.012 23.246 50.867 1.00 0.00 C ATOM 2121 CD2 TRP A 135 15.047 22.331 51.453 1.00 0.00 C ATOM 2122 NE1 TRP A 135 16.153 23.274 49.784 1.00 0.00 N ATOM 2123 CE2 TRP A 135 14.927 22.716 50.094 1.00 0.00 C ATOM 2124 CE3 TRP A 135 13.936 21.723 52.068 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 13.752 22.504 49.374 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 12.751 21.508 51.344 1.00 0.00 C ATOM 2127 CH2 TRP A 135 12.659 21.897 50.001 1.00 0.00 C ATOM 0 H TRP A 135 15.287 24.017 53.762 1.00 0.00 H new ATOM 0 HA TRP A 135 15.454 21.231 54.022 1.00 0.00 H new ATOM 0 HB2 TRP A 135 17.544 23.426 53.521 1.00 0.00 H new ATOM 0 HB3 TRP A 135 17.824 21.739 53.137 1.00 0.00 H new ATOM 0 HD1 TRP A 135 18.027 23.615 50.870 1.00 0.00 H new ATOM 0 HE1 TRP A 135 16.394 23.658 48.870 1.00 0.00 H new ATOM 0 HE3 TRP A 135 13.995 21.420 53.103 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 13.686 22.806 48.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 11.905 21.040 51.826 1.00 0.00 H new ATOM 0 HH2 TRP A 135 11.745 21.728 49.451 1.00 0.00 H new ATOM 2138 N ARG A 136 17.482 22.719 56.129 1.00 0.00 N ATOM 2139 CA ARG A 136 18.263 22.501 57.392 1.00 0.00 C ATOM 2140 C ARG A 136 17.322 22.020 58.511 1.00 0.00 C ATOM 2141 O ARG A 136 17.665 21.145 59.303 1.00 0.00 O ATOM 2142 CB ARG A 136 18.845 23.888 57.708 1.00 0.00 C ATOM 2143 CG ARG A 136 19.239 24.003 59.187 1.00 0.00 C ATOM 2144 CD ARG A 136 19.085 25.461 59.634 1.00 0.00 C ATOM 2145 NE ARG A 136 18.242 25.409 60.865 1.00 0.00 N ATOM 2146 CZ ARG A 136 18.032 26.491 61.575 1.00 0.00 C ATOM 2147 NH1 ARG A 136 18.554 27.636 61.219 1.00 0.00 N ATOM 2148 NH2 ARG A 136 17.292 26.425 62.648 1.00 0.00 N ATOM 0 H ARG A 136 17.513 23.672 55.767 1.00 0.00 H new ATOM 0 HA ARG A 136 19.040 21.742 57.298 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.718 24.070 57.082 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.112 24.657 57.464 1.00 0.00 H new ATOM 0 HG2 ARG A 136 18.609 23.354 59.796 1.00 0.00 H new ATOM 0 HG3 ARG A 136 20.268 23.673 59.329 1.00 0.00 H new ATOM 0 HD2 ARG A 136 20.055 25.914 59.840 1.00 0.00 H new ATOM 0 HD3 ARG A 136 18.611 26.062 58.858 1.00 0.00 H new ATOM 0 HE ARG A 136 17.826 24.524 61.156 1.00 0.00 H new ATOM 0 HH11 ARG A 136 19.132 27.694 60.381 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.383 28.471 61.780 1.00 0.00 H new ATOM 0 HH21 ARG A 136 16.881 25.535 62.930 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.125 27.263 63.205 1.00 0.00 H new ATOM 2162 N ALA A 137 16.146 22.589 58.589 1.00 0.00 N ATOM 2163 CA ALA A 137 15.179 22.184 59.655 1.00 0.00 C ATOM 2164 C ALA A 137 14.790 20.712 59.494 1.00 0.00 C ATOM 2165 O ALA A 137 14.571 20.002 60.474 1.00 0.00 O ATOM 2166 CB ALA A 137 13.961 23.086 59.452 1.00 0.00 C ATOM 0 H ALA A 137 15.813 23.319 57.959 1.00 0.00 H new ATOM 0 HA ALA A 137 15.603 22.290 60.654 1.00 0.00 H new ATOM 0 HB1 ALA A 137 13.204 22.849 60.199 1.00 0.00 H new ATOM 0 HB2 ALA A 137 14.259 24.129 59.556 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.550 22.924 58.455 1.00 0.00 H new ATOM 2172 N ARG A 138 14.723 20.235 58.282 1.00 0.00 N ATOM 2173 CA ARG A 138 14.376 18.804 58.055 1.00 0.00 C ATOM 2174 C ARG A 138 15.656 18.011 57.783 1.00 0.00 C ATOM 2175 O ARG A 138 15.628 16.789 57.648 1.00 0.00 O ATOM 2176 CB ARG A 138 13.468 18.801 56.827 1.00 0.00 C ATOM 2177 CG ARG A 138 12.766 17.447 56.713 1.00 0.00 C ATOM 2178 CD ARG A 138 12.433 17.167 55.247 1.00 0.00 C ATOM 2179 NE ARG A 138 11.484 18.249 54.854 1.00 0.00 N ATOM 2180 CZ ARG A 138 10.232 18.221 55.245 1.00 0.00 C ATOM 2181 NH1 ARG A 138 9.783 17.241 55.990 1.00 0.00 N ATOM 2182 NH2 ARG A 138 9.424 19.180 54.887 1.00 0.00 N ATOM 0 H ARG A 138 14.894 20.777 57.435 1.00 0.00 H new ATOM 0 HA ARG A 138 13.884 18.348 58.914 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.730 19.599 56.906 1.00 0.00 H new ATOM 0 HB3 ARG A 138 14.054 18.995 55.928 1.00 0.00 H new ATOM 0 HG2 ARG A 138 13.407 16.659 57.108 1.00 0.00 H new ATOM 0 HG3 ARG A 138 11.854 17.447 57.311 1.00 0.00 H new ATOM 0 HD2 ARG A 138 13.330 17.185 54.628 1.00 0.00 H new ATOM 0 HD3 ARG A 138 11.981 16.182 55.126 1.00 0.00 H new ATOM 0 HE ARG A 138 11.813 19.021 54.274 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.409 16.487 56.273 1.00 0.00 H new ATOM 0 HH12 ARG A 138 8.807 17.232 56.287 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.767 19.946 54.307 1.00 0.00 H new ATOM 0 HH22 ARG A 138 8.449 19.164 55.187 1.00 0.00 H new ATOM 2196 N ARG A 139 16.780 18.676 57.705 1.00 0.00 N ATOM 2197 CA ARG A 139 18.060 17.954 57.447 1.00 0.00 C ATOM 2198 C ARG A 139 19.228 18.698 58.101 1.00 0.00 C ATOM 2199 O ARG A 139 19.476 18.457 59.270 1.00 0.00 O ATOM 2200 CB ARG A 139 18.209 17.939 55.924 1.00 0.00 C ATOM 2201 CG ARG A 139 18.977 16.683 55.504 1.00 0.00 C ATOM 2202 CD ARG A 139 18.741 16.406 54.016 1.00 0.00 C ATOM 2203 NE ARG A 139 18.042 15.086 53.979 1.00 0.00 N ATOM 2204 CZ ARG A 139 16.731 15.015 53.942 1.00 0.00 C ATOM 2205 NH1 ARG A 139 15.994 16.096 53.938 1.00 0.00 N ATOM 2206 NH2 ARG A 139 16.151 13.845 53.911 1.00 0.00 N ATOM 2207 OXT ARG A 139 19.851 19.499 57.423 1.00 0.00 O ATOM 0 H ARG A 139 16.866 19.687 57.809 1.00 0.00 H new ATOM 0 HA ARG A 139 18.058 16.946 57.862 1.00 0.00 H new ATOM 0 HB2 ARG A 139 17.227 17.954 55.451 1.00 0.00 H new ATOM 0 HB3 ARG A 139 18.738 18.832 55.590 1.00 0.00 H new ATOM 0 HG2 ARG A 139 20.042 16.816 55.694 1.00 0.00 H new ATOM 0 HG3 ARG A 139 18.651 15.830 56.099 1.00 0.00 H new ATOM 0 HD2 ARG A 139 18.134 17.188 53.560 1.00 0.00 H new ATOM 0 HD3 ARG A 139 19.682 16.371 53.466 1.00 0.00 H new ATOM 0 HE ARG A 139 18.591 14.227 53.983 1.00 0.00 H new ATOM 0 HH11 ARG A 139 16.436 17.015 53.964 1.00 0.00 H new ATOM 0 HH12 ARG A 139 14.977 16.020 53.909 1.00 0.00 H new ATOM 0 HH21 ARG A 139 16.716 12.996 53.916 1.00 0.00 H new ATOM 0 HH22 ARG A 139 15.133 13.781 53.882 1.00 0.00 H new