USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=22 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 HD1:sc= -9.03! C(o=-9.6!,f=-14!) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -145:sc= -0.586 (180deg=-2.69!) USER MOD Set 2.1: A 42 CYS SG : rot 180:sc= 0.712 USER MOD Set 2.2: A 69 CYS SG : rot 180:sc= 0.252 USER MOD Set 2.3: A 72 CYS SG : rot 120:sc= -0.192 USER MOD Set 3.1: A 53 SER OG : rot 161:sc= -3.8! USER MOD Set 3.2: A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 40:sc= 0.143 USER MOD Single : A 11 GLN : amide:sc= -0.0206 K(o=-0.021,f=-0.58) USER MOD Single : A 14 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.021) USER MOD Single : A 15 SER OG : rot 170:sc= 0 USER MOD Single : A 22 ASN : amide:sc= -2.29! K(o=-2.3!,f=-0.75) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -26:sc= 0.287 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HE2:sc= -6.87! C(o=-6.9!,f=-4.3!) USER MOD Single : A 51 ASN : amide:sc= -2.67 X(o=-2.7,f=-2.5) USER MOD Single : A 57 ASN : amide:sc= -3.8! C(o=-3.8!,f=-18!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -3.56 K(o=-3.6,f=-4.4!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -11.4! C(o=-11!,f=-9.1!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.497 X(o=-0.5,f=-0.046) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0259 USER MOD Single : A 89 HIS : no HD1:sc= -0.213 X(o=-0.21,f=-0.072) USER MOD Single : A 91 CYS SG : rot 130:sc= -4.57! USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot -130:sc= -2.97! USER MOD Single : A 108 GLN : amide:sc= -0.18 K(o=-0.18,f=-0.82) USER MOD Single : A 111 MET CE :methyl -165:sc= -2.21 (180deg=-2.86!) USER MOD Single : A 112 SER OG : rot 180:sc= -0.29 USER MOD Single : A 115 HIS : no HD1:sc= -0.0121 X(o=-0.012,f=-0.23) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.0561 USER MOD Single : A 124 THR OG1 : rot 130:sc= 0.0163 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot -27:sc= -0.814! USER MOD Single : A 132 GLN : amide:sc= -1.16 K(o=-1.2,f=-3.6!) USER MOD Single : A 133 GLN : amide:sc= -0.0947 K(o=-0.095,f=-0.76) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 8.461 16.013 18.982 1.00 0.00 N ATOM 119 CA THR A 8 7.237 16.683 18.534 1.00 0.00 C ATOM 120 C THR A 8 7.548 18.164 18.366 1.00 0.00 C ATOM 121 O THR A 8 7.011 19.011 19.073 1.00 0.00 O ATOM 122 CB THR A 8 6.222 16.454 19.653 1.00 0.00 C ATOM 123 OG1 THR A 8 5.966 15.061 19.776 1.00 0.00 O ATOM 124 CG2 THR A 8 4.920 17.194 19.337 1.00 0.00 C ATOM 0 HA THR A 8 6.853 16.309 17.585 1.00 0.00 H new ATOM 0 HB THR A 8 6.625 16.835 20.591 1.00 0.00 H new ATOM 0 HG1 THR A 8 6.804 14.564 19.668 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.202 17.026 20.139 1.00 0.00 H new ATOM 0 HG22 THR A 8 5.121 18.262 19.248 1.00 0.00 H new ATOM 0 HG23 THR A 8 4.509 16.822 18.398 1.00 0.00 H new ATOM 132 N ASP A 9 8.419 18.482 17.441 1.00 0.00 N ATOM 133 CA ASP A 9 8.798 19.911 17.203 1.00 0.00 C ATOM 134 C ASP A 9 7.565 20.809 17.303 1.00 0.00 C ATOM 135 O ASP A 9 7.646 21.962 17.722 1.00 0.00 O ATOM 136 CB ASP A 9 9.376 19.943 15.784 1.00 0.00 C ATOM 137 CG ASP A 9 8.307 19.524 14.770 1.00 0.00 C ATOM 138 OD1 ASP A 9 7.524 18.645 15.088 1.00 0.00 O ATOM 139 OD2 ASP A 9 8.289 20.092 13.690 1.00 0.00 O ATOM 0 H ASP A 9 8.888 17.808 16.835 1.00 0.00 H new ATOM 0 HA ASP A 9 9.515 20.274 17.940 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.735 20.946 15.552 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.234 19.274 15.717 1.00 0.00 H new ATOM 144 N ASP A 10 6.419 20.293 16.948 1.00 0.00 N ATOM 145 CA ASP A 10 5.187 21.079 17.040 1.00 0.00 C ATOM 146 C ASP A 10 4.971 21.532 18.480 1.00 0.00 C ATOM 147 O ASP A 10 4.811 22.726 18.759 1.00 0.00 O ATOM 148 CB ASP A 10 4.108 20.097 16.603 1.00 0.00 C ATOM 149 CG ASP A 10 4.079 20.010 15.077 1.00 0.00 C ATOM 150 OD1 ASP A 10 4.111 21.052 14.442 1.00 0.00 O ATOM 151 OD2 ASP A 10 4.024 18.903 14.567 1.00 0.00 O ATOM 0 H ASP A 10 6.298 19.344 16.594 1.00 0.00 H new ATOM 0 HA ASP A 10 5.196 21.984 16.432 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.304 19.113 17.029 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.136 20.419 16.977 1.00 0.00 H new ATOM 156 N GLN A 11 4.994 20.626 19.422 1.00 0.00 N ATOM 157 CA GLN A 11 4.808 21.091 20.813 1.00 0.00 C ATOM 158 C GLN A 11 6.133 21.536 21.388 1.00 0.00 C ATOM 159 O GLN A 11 6.172 22.437 22.216 1.00 0.00 O ATOM 160 CB GLN A 11 4.232 19.962 21.635 1.00 0.00 C ATOM 161 CG GLN A 11 3.904 20.554 23.003 1.00 0.00 C ATOM 162 CD GLN A 11 2.388 20.580 23.208 1.00 0.00 C ATOM 163 OE1 GLN A 11 1.705 21.474 22.713 1.00 0.00 O ATOM 164 NE2 GLN A 11 1.821 19.642 23.915 1.00 0.00 N ATOM 0 H GLN A 11 5.128 19.623 19.291 1.00 0.00 H new ATOM 0 HA GLN A 11 4.122 21.938 20.831 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.338 19.554 21.163 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.946 19.144 21.726 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.376 19.963 23.788 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.308 21.564 23.078 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.388 18.900 24.326 1.00 0.00 H new ATOM 0 HE22 GLN A 11 0.811 19.650 24.057 1.00 0.00 H new ATOM 173 N ARG A 12 7.231 20.974 20.949 1.00 0.00 N ATOM 174 CA ARG A 12 8.523 21.460 21.464 1.00 0.00 C ATOM 175 C ARG A 12 8.504 22.953 21.246 1.00 0.00 C ATOM 176 O ARG A 12 8.852 23.743 22.119 1.00 0.00 O ATOM 177 CB ARG A 12 9.582 20.806 20.590 1.00 0.00 C ATOM 178 CG ARG A 12 9.678 19.300 20.882 1.00 0.00 C ATOM 179 CD ARG A 12 9.350 19.011 22.354 1.00 0.00 C ATOM 180 NE ARG A 12 9.772 17.598 22.581 1.00 0.00 N ATOM 181 CZ ARG A 12 9.525 17.008 23.724 1.00 0.00 C ATOM 182 NH1 ARG A 12 8.905 17.645 24.686 1.00 0.00 N ATOM 183 NH2 ARG A 12 9.899 15.771 23.908 1.00 0.00 N ATOM 0 H ARG A 12 7.279 20.215 20.269 1.00 0.00 H new ATOM 0 HA ARG A 12 8.713 21.235 22.513 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.340 20.962 19.539 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.548 21.278 20.768 1.00 0.00 H new ATOM 0 HG2 ARG A 12 8.989 18.755 20.237 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.682 18.943 20.651 1.00 0.00 H new ATOM 0 HD2 ARG A 12 9.883 19.692 23.017 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.286 19.141 22.553 1.00 0.00 H new ATOM 0 HE ARG A 12 10.256 17.088 21.842 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.609 18.611 24.550 1.00 0.00 H new ATOM 0 HH12 ARG A 12 8.718 17.175 25.572 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.381 15.268 23.163 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.709 15.307 24.796 1.00 0.00 H new ATOM 197 N TRP A 13 8.025 23.348 20.093 1.00 0.00 N ATOM 198 CA TRP A 13 7.906 24.785 19.814 1.00 0.00 C ATOM 199 C TRP A 13 6.912 25.378 20.792 1.00 0.00 C ATOM 200 O TRP A 13 7.130 26.454 21.343 1.00 0.00 O ATOM 201 CB TRP A 13 7.349 24.912 18.401 1.00 0.00 C ATOM 202 CG TRP A 13 7.359 26.362 18.044 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.315 27.057 17.537 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.444 27.313 18.202 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.698 28.376 17.371 1.00 0.00 N ATOM 206 CE2 TRP A 13 8.002 28.583 17.771 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.759 27.194 18.674 1.00 0.00 C ATOM 208 CZ2 TRP A 13 8.838 29.699 17.812 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.603 28.308 18.716 1.00 0.00 C ATOM 210 CH2 TRP A 13 10.147 29.561 18.292 1.00 0.00 C ATOM 0 H TRP A 13 7.716 22.729 19.344 1.00 0.00 H new ATOM 0 HA TRP A 13 8.863 25.298 19.907 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.954 24.340 17.698 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.336 24.512 18.350 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.343 26.650 17.301 1.00 0.00 H new ATOM 0 HE1 TRP A 13 6.091 29.106 16.999 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.123 26.234 19.008 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 8.479 30.661 17.477 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.615 28.200 19.079 1.00 0.00 H new ATOM 0 HH2 TRP A 13 10.802 30.419 18.335 1.00 0.00 H new ATOM 221 N GLN A 14 5.833 24.681 21.061 1.00 0.00 N ATOM 222 CA GLN A 14 4.870 25.229 22.048 1.00 0.00 C ATOM 223 C GLN A 14 5.612 25.371 23.379 1.00 0.00 C ATOM 224 O GLN A 14 5.338 26.263 24.172 1.00 0.00 O ATOM 225 CB GLN A 14 3.729 24.203 22.121 1.00 0.00 C ATOM 226 CG GLN A 14 2.749 24.590 23.233 1.00 0.00 C ATOM 227 CD GLN A 14 1.599 25.404 22.637 1.00 0.00 C ATOM 228 OE1 GLN A 14 1.343 26.528 23.060 1.00 0.00 O ATOM 229 NE2 GLN A 14 0.887 24.892 21.670 1.00 0.00 N ATOM 0 H GLN A 14 5.588 23.781 20.649 1.00 0.00 H new ATOM 0 HA GLN A 14 4.465 26.207 21.787 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.208 24.157 21.165 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.134 23.209 22.311 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.362 23.695 23.719 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.262 25.172 23.999 1.00 0.00 H new ATOM 0 HE21 GLN A 14 1.100 23.958 21.319 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.118 25.426 21.265 1.00 0.00 H new ATOM 238 N SER A 15 6.585 24.522 23.603 1.00 0.00 N ATOM 239 CA SER A 15 7.401 24.601 24.839 1.00 0.00 C ATOM 240 C SER A 15 8.381 25.759 24.706 1.00 0.00 C ATOM 241 O SER A 15 8.740 26.430 25.677 1.00 0.00 O ATOM 242 CB SER A 15 8.152 23.269 24.909 1.00 0.00 C ATOM 243 OG SER A 15 7.594 22.472 25.945 1.00 0.00 O ATOM 0 H SER A 15 6.847 23.768 22.967 1.00 0.00 H new ATOM 0 HA SER A 15 6.803 24.768 25.735 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.081 22.747 23.954 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.211 23.444 25.099 1.00 0.00 H new ATOM 0 HG SER A 15 7.958 21.564 25.891 1.00 0.00 H new ATOM 249 N VAL A 16 8.819 25.999 23.504 1.00 0.00 N ATOM 250 CA VAL A 16 9.787 27.095 23.264 1.00 0.00 C ATOM 251 C VAL A 16 9.131 28.439 23.396 1.00 0.00 C ATOM 252 O VAL A 16 9.733 29.431 23.805 1.00 0.00 O ATOM 253 CB VAL A 16 10.282 26.894 21.837 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.338 27.931 21.530 1.00 0.00 C ATOM 255 CG2 VAL A 16 10.896 25.511 21.677 1.00 0.00 C ATOM 0 H VAL A 16 8.544 25.477 22.672 1.00 0.00 H new ATOM 0 HA VAL A 16 10.598 27.070 23.992 1.00 0.00 H new ATOM 0 HB VAL A 16 9.438 26.993 21.155 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.697 27.794 20.510 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.910 28.928 21.633 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.170 27.820 22.226 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.244 25.384 20.652 1.00 0.00 H new ATOM 0 HG22 VAL A 16 11.737 25.405 22.362 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.147 24.752 21.902 1.00 0.00 H new ATOM 265 N LEU A 17 7.920 28.481 23.044 1.00 0.00 N ATOM 266 CA LEU A 17 7.164 29.728 23.115 1.00 0.00 C ATOM 267 C LEU A 17 6.524 29.832 24.484 1.00 0.00 C ATOM 268 O LEU A 17 6.366 30.909 25.054 1.00 0.00 O ATOM 269 CB LEU A 17 6.136 29.540 22.024 1.00 0.00 C ATOM 270 CG LEU A 17 6.815 29.269 20.666 1.00 0.00 C ATOM 271 CD1 LEU A 17 6.020 29.959 19.577 1.00 0.00 C ATOM 272 CD2 LEU A 17 8.261 29.794 20.627 1.00 0.00 C ATOM 0 H LEU A 17 7.393 27.680 22.696 1.00 0.00 H new ATOM 0 HA LEU A 17 7.749 30.638 22.982 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.478 28.709 22.278 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.511 30.430 21.951 1.00 0.00 H new ATOM 0 HG LEU A 17 6.843 28.190 20.515 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.490 29.775 18.611 1.00 0.00 H new ATOM 0 HD12 LEU A 17 5.003 29.568 19.566 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.994 31.032 19.769 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.699 29.581 19.652 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.262 30.871 20.798 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.847 29.303 21.403 1.00 0.00 H new ATOM 284 N ALA A 18 6.182 28.708 25.022 1.00 0.00 N ATOM 285 CA ALA A 18 5.573 28.680 26.376 1.00 0.00 C ATOM 286 C ALA A 18 6.666 28.830 27.437 1.00 0.00 C ATOM 287 O ALA A 18 6.382 29.039 28.614 1.00 0.00 O ATOM 288 CB ALA A 18 4.899 27.314 26.499 1.00 0.00 C ATOM 0 H ALA A 18 6.297 27.795 24.581 1.00 0.00 H new ATOM 0 HA ALA A 18 4.860 29.491 26.520 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.428 27.227 27.478 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.142 27.211 25.722 1.00 0.00 H new ATOM 0 HB3 ALA A 18 5.646 26.528 26.384 1.00 0.00 H new ATOM 294 N ARG A 19 7.917 28.720 27.045 1.00 0.00 N ATOM 295 CA ARG A 19 9.028 28.850 28.022 1.00 0.00 C ATOM 296 C ARG A 19 8.942 27.722 29.033 1.00 0.00 C ATOM 297 O ARG A 19 9.174 27.903 30.224 1.00 0.00 O ATOM 298 CB ARG A 19 8.856 30.217 28.684 1.00 0.00 C ATOM 299 CG ARG A 19 8.529 31.281 27.626 1.00 0.00 C ATOM 300 CD ARG A 19 8.532 32.666 28.276 1.00 0.00 C ATOM 301 NE ARG A 19 7.262 32.727 29.055 1.00 0.00 N ATOM 302 CZ ARG A 19 6.108 32.872 28.446 1.00 0.00 C ATOM 303 NH1 ARG A 19 6.045 32.966 27.142 1.00 0.00 N ATOM 304 NH2 ARG A 19 5.010 32.921 29.149 1.00 0.00 N ATOM 0 H ARG A 19 8.208 28.545 26.083 1.00 0.00 H new ATOM 0 HA ARG A 19 10.008 28.782 27.550 1.00 0.00 H new ATOM 0 HB2 ARG A 19 8.058 30.173 29.425 1.00 0.00 H new ATOM 0 HB3 ARG A 19 9.768 30.490 29.215 1.00 0.00 H new ATOM 0 HG2 ARG A 19 9.262 31.245 26.820 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.555 31.079 27.181 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.399 32.797 28.923 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.573 33.455 27.525 1.00 0.00 H new ATOM 0 HE ARG A 19 7.290 32.655 30.072 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.899 32.927 26.586 1.00 0.00 H new ATOM 0 HH12 ARG A 19 5.142 33.078 26.682 1.00 0.00 H new ATOM 0 HH21 ARG A 19 5.051 32.847 30.165 1.00 0.00 H new ATOM 0 HH22 ARG A 19 4.110 33.034 28.682 1.00 0.00 H new ATOM 318 N ASP A 20 8.624 26.553 28.558 1.00 0.00 N ATOM 319 CA ASP A 20 8.526 25.376 29.451 1.00 0.00 C ATOM 320 C ASP A 20 9.923 24.970 29.939 1.00 0.00 C ATOM 321 O ASP A 20 10.729 24.458 29.165 1.00 0.00 O ATOM 322 CB ASP A 20 7.918 24.276 28.577 1.00 0.00 C ATOM 323 CG ASP A 20 7.517 23.084 29.447 1.00 0.00 C ATOM 324 OD1 ASP A 20 7.220 23.297 30.612 1.00 0.00 O ATOM 325 OD2 ASP A 20 7.510 21.977 28.933 1.00 0.00 O ATOM 0 H ASP A 20 8.426 26.364 27.575 1.00 0.00 H new ATOM 0 HA ASP A 20 7.925 25.571 30.339 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.047 24.660 28.047 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.637 23.960 27.821 1.00 0.00 H new ATOM 330 N PRO A 21 10.168 25.186 31.205 1.00 0.00 N ATOM 331 CA PRO A 21 11.474 24.818 31.811 1.00 0.00 C ATOM 332 C PRO A 21 11.598 23.292 31.898 1.00 0.00 C ATOM 333 O PRO A 21 12.533 22.759 32.491 1.00 0.00 O ATOM 334 CB PRO A 21 11.423 25.444 33.202 1.00 0.00 C ATOM 335 CG PRO A 21 9.968 25.573 33.512 1.00 0.00 C ATOM 336 CD PRO A 21 9.261 25.783 32.199 1.00 0.00 C ATOM 0 HA PRO A 21 12.331 25.166 31.234 1.00 0.00 H new ATOM 0 HB2 PRO A 21 11.929 24.817 33.936 1.00 0.00 H new ATOM 0 HB3 PRO A 21 11.918 26.415 33.217 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.598 24.678 34.011 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.789 26.411 34.186 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.285 25.299 32.190 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.093 26.842 32.001 1.00 0.00 H new ATOM 344 N ASN A 22 10.654 22.583 31.336 1.00 0.00 N ATOM 345 CA ASN A 22 10.669 21.114 31.389 1.00 0.00 C ATOM 346 C ASN A 22 11.186 20.573 30.075 1.00 0.00 C ATOM 347 O ASN A 22 11.535 19.401 29.945 1.00 0.00 O ATOM 348 CB ASN A 22 9.198 20.808 31.539 1.00 0.00 C ATOM 349 CG ASN A 22 8.971 19.317 31.407 1.00 0.00 C ATOM 350 OD1 ASN A 22 8.768 18.611 32.394 1.00 0.00 O ATOM 351 ND2 ASN A 22 9.000 18.801 30.217 1.00 0.00 N ATOM 0 H ASN A 22 9.861 22.982 30.834 1.00 0.00 H new ATOM 0 HA ASN A 22 11.294 20.687 32.173 1.00 0.00 H new ATOM 0 HB2 ASN A 22 8.841 21.155 32.509 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.626 21.341 30.779 1.00 0.00 H new ATOM 0 HD21 ASN A 22 8.854 17.799 30.092 1.00 0.00 H new ATOM 0 HD22 ASN A 22 9.169 19.397 29.407 1.00 0.00 H new ATOM 358 N ALA A 23 11.287 21.430 29.118 1.00 0.00 N ATOM 359 CA ALA A 23 11.836 21.013 27.812 1.00 0.00 C ATOM 360 C ALA A 23 13.212 21.637 27.656 1.00 0.00 C ATOM 361 O ALA A 23 13.950 21.373 26.704 1.00 0.00 O ATOM 362 CB ALA A 23 10.893 21.572 26.761 1.00 0.00 C ATOM 0 H ALA A 23 11.012 22.410 29.181 1.00 0.00 H new ATOM 0 HA ALA A 23 11.925 19.930 27.721 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.249 21.295 25.769 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.894 21.165 26.915 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.859 22.658 26.844 1.00 0.00 H new ATOM 368 N ASP A 24 13.559 22.465 28.597 1.00 0.00 N ATOM 369 CA ASP A 24 14.861 23.139 28.573 1.00 0.00 C ATOM 370 C ASP A 24 15.897 22.100 28.974 1.00 0.00 C ATOM 371 O ASP A 24 15.750 21.457 29.990 1.00 0.00 O ATOM 372 CB ASP A 24 14.687 24.230 29.644 1.00 0.00 C ATOM 373 CG ASP A 24 15.692 25.349 29.445 1.00 0.00 C ATOM 374 OD1 ASP A 24 16.210 25.443 28.358 1.00 0.00 O ATOM 375 OD2 ASP A 24 15.906 26.106 30.377 1.00 0.00 O ATOM 0 H ASP A 24 12.972 22.702 29.397 1.00 0.00 H new ATOM 0 HA ASP A 24 15.174 23.563 27.619 1.00 0.00 H new ATOM 0 HB2 ASP A 24 13.675 24.632 29.598 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.812 23.795 30.636 1.00 0.00 H new ATOM 380 N GLY A 25 16.903 21.875 28.183 1.00 0.00 N ATOM 381 CA GLY A 25 17.900 20.801 28.536 1.00 0.00 C ATOM 382 C GLY A 25 17.555 19.571 27.692 1.00 0.00 C ATOM 383 O GLY A 25 18.420 18.781 27.318 1.00 0.00 O ATOM 0 H GLY A 25 17.088 22.376 27.314 1.00 0.00 H new ATOM 0 HA2 GLY A 25 18.916 21.136 28.330 1.00 0.00 H new ATOM 0 HA3 GLY A 25 17.851 20.565 29.599 1.00 0.00 H new ATOM 387 N GLU A 26 16.290 19.411 27.374 1.00 0.00 N ATOM 388 CA GLU A 26 15.849 18.266 26.545 1.00 0.00 C ATOM 389 C GLU A 26 16.056 18.588 25.063 1.00 0.00 C ATOM 390 O GLU A 26 16.555 17.765 24.301 1.00 0.00 O ATOM 391 CB GLU A 26 14.362 18.093 26.858 1.00 0.00 C ATOM 392 CG GLU A 26 13.912 16.687 26.453 1.00 0.00 C ATOM 393 CD GLU A 26 12.387 16.593 26.540 1.00 0.00 C ATOM 394 OE1 GLU A 26 11.884 16.446 27.642 1.00 0.00 O ATOM 395 OE2 GLU A 26 11.749 16.669 25.503 1.00 0.00 O ATOM 0 H GLU A 26 15.541 20.041 27.663 1.00 0.00 H new ATOM 0 HA GLU A 26 16.412 17.357 26.758 1.00 0.00 H new ATOM 0 HB2 GLU A 26 14.183 18.251 27.922 1.00 0.00 H new ATOM 0 HB3 GLU A 26 13.778 18.841 26.322 1.00 0.00 H new ATOM 0 HG2 GLU A 26 14.243 16.466 25.438 1.00 0.00 H new ATOM 0 HG3 GLU A 26 14.370 15.945 27.107 1.00 0.00 H new ATOM 402 N PHE A 27 15.690 19.775 24.641 1.00 0.00 N ATOM 403 CA PHE A 27 15.886 20.150 23.205 1.00 0.00 C ATOM 404 C PHE A 27 16.200 21.627 23.064 1.00 0.00 C ATOM 405 O PHE A 27 16.078 22.418 23.997 1.00 0.00 O ATOM 406 CB PHE A 27 14.586 19.829 22.462 1.00 0.00 C ATOM 407 CG PHE A 27 13.509 20.875 22.715 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.584 22.147 22.116 1.00 0.00 C ATOM 409 CD2 PHE A 27 12.415 20.554 23.517 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.558 23.080 22.327 1.00 0.00 C ATOM 411 CE2 PHE A 27 11.393 21.491 23.732 1.00 0.00 C ATOM 412 CZ PHE A 27 11.464 22.748 23.136 1.00 0.00 C ATOM 0 H PHE A 27 15.267 20.496 25.225 1.00 0.00 H new ATOM 0 HA PHE A 27 16.726 19.592 22.791 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.786 19.767 21.392 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.222 18.851 22.776 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.430 22.404 21.495 1.00 0.00 H new ATOM 0 HD2 PHE A 27 12.354 19.578 23.976 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.612 24.055 21.865 1.00 0.00 H new ATOM 0 HE2 PHE A 27 10.551 21.238 24.360 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.675 23.467 23.298 1.00 0.00 H new ATOM 422 N VAL A 28 16.572 21.997 21.887 1.00 0.00 N ATOM 423 CA VAL A 28 16.880 23.413 21.585 1.00 0.00 C ATOM 424 C VAL A 28 16.072 23.809 20.379 1.00 0.00 C ATOM 425 O VAL A 28 15.434 22.975 19.743 1.00 0.00 O ATOM 426 CB VAL A 28 18.369 23.487 21.239 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.059 22.207 21.657 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.563 23.635 19.740 1.00 0.00 C ATOM 0 H VAL A 28 16.680 21.362 21.096 1.00 0.00 H new ATOM 0 HA VAL A 28 16.648 24.070 22.423 1.00 0.00 H new ATOM 0 HB VAL A 28 18.789 24.346 21.762 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.118 22.267 21.408 1.00 0.00 H new ATOM 0 HG12 VAL A 28 18.946 22.067 22.732 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.610 21.364 21.133 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.628 23.686 19.514 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.125 22.777 19.230 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.076 24.548 19.398 1.00 0.00 H new ATOM 438 N PHE A 29 16.141 25.034 20.007 1.00 0.00 N ATOM 439 CA PHE A 29 15.425 25.432 18.787 1.00 0.00 C ATOM 440 C PHE A 29 16.277 26.406 18.007 1.00 0.00 C ATOM 441 O PHE A 29 16.703 27.444 18.501 1.00 0.00 O ATOM 442 CB PHE A 29 14.062 25.962 19.218 1.00 0.00 C ATOM 443 CG PHE A 29 13.994 27.482 19.311 1.00 0.00 C ATOM 444 CD1 PHE A 29 13.731 28.251 18.168 1.00 0.00 C ATOM 445 CD2 PHE A 29 14.107 28.114 20.560 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.595 29.647 18.274 1.00 0.00 C ATOM 447 CE2 PHE A 29 13.960 29.506 20.660 1.00 0.00 C ATOM 448 CZ PHE A 29 13.704 30.270 19.520 1.00 0.00 C ATOM 0 H PHE A 29 16.655 25.773 20.486 1.00 0.00 H new ATOM 0 HA PHE A 29 15.245 24.604 18.102 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.308 25.617 18.511 1.00 0.00 H new ATOM 0 HB3 PHE A 29 13.807 25.536 20.189 1.00 0.00 H new ATOM 0 HD1 PHE A 29 13.633 27.771 17.206 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.307 27.528 21.445 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.406 30.239 17.390 1.00 0.00 H new ATOM 0 HE2 PHE A 29 14.045 29.988 21.623 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.590 31.341 19.601 1.00 0.00 H new ATOM 458 N ALA A 30 16.586 26.018 16.812 1.00 0.00 N ATOM 459 CA ALA A 30 17.502 26.828 15.960 1.00 0.00 C ATOM 460 C ALA A 30 16.780 27.721 14.962 1.00 0.00 C ATOM 461 O ALA A 30 16.157 27.259 14.008 1.00 0.00 O ATOM 462 CB ALA A 30 18.344 25.798 15.216 1.00 0.00 C ATOM 0 H ALA A 30 16.241 25.162 16.377 1.00 0.00 H new ATOM 0 HA ALA A 30 18.083 27.512 16.579 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.050 26.309 14.562 1.00 0.00 H new ATOM 0 HB2 ALA A 30 18.891 25.188 15.935 1.00 0.00 H new ATOM 0 HB3 ALA A 30 17.693 25.159 14.619 1.00 0.00 H new ATOM 468 N VAL A 31 16.906 28.999 15.149 1.00 0.00 N ATOM 469 CA VAL A 31 16.294 29.970 14.212 1.00 0.00 C ATOM 470 C VAL A 31 17.326 30.265 13.108 1.00 0.00 C ATOM 471 O VAL A 31 18.287 31.014 13.313 1.00 0.00 O ATOM 472 CB VAL A 31 16.034 31.221 15.050 1.00 0.00 C ATOM 473 CG1 VAL A 31 14.976 32.077 14.372 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.539 30.831 16.436 1.00 0.00 C ATOM 0 H VAL A 31 17.417 29.419 15.926 1.00 0.00 H new ATOM 0 HA VAL A 31 15.376 29.613 13.746 1.00 0.00 H new ATOM 0 HB VAL A 31 16.965 31.781 15.142 1.00 0.00 H new ATOM 0 HG11 VAL A 31 14.791 32.969 14.971 1.00 0.00 H new ATOM 0 HG12 VAL A 31 15.325 32.370 13.382 1.00 0.00 H new ATOM 0 HG13 VAL A 31 14.052 31.506 14.277 1.00 0.00 H new ATOM 0 HG21 VAL A 31 15.357 31.731 17.024 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.613 30.264 16.345 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.292 30.219 16.933 1.00 0.00 H new ATOM 484 N ARG A 32 17.155 29.672 11.958 1.00 0.00 N ATOM 485 CA ARG A 32 18.107 29.876 10.825 1.00 0.00 C ATOM 486 C ARG A 32 18.117 31.328 10.370 1.00 0.00 C ATOM 487 O ARG A 32 19.051 31.801 9.724 1.00 0.00 O ATOM 488 CB ARG A 32 17.503 29.049 9.712 1.00 0.00 C ATOM 489 CG ARG A 32 17.874 27.575 9.885 1.00 0.00 C ATOM 490 CD ARG A 32 16.893 26.706 9.095 1.00 0.00 C ATOM 491 NE ARG A 32 17.717 25.581 8.560 1.00 0.00 N ATOM 492 CZ ARG A 32 17.180 24.674 7.781 1.00 0.00 C ATOM 493 NH1 ARG A 32 15.913 24.735 7.457 1.00 0.00 N ATOM 494 NH2 ARG A 32 17.916 23.697 7.325 1.00 0.00 N ATOM 0 H ARG A 32 16.380 29.042 11.751 1.00 0.00 H new ATOM 0 HA ARG A 32 19.127 29.608 11.099 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.419 29.161 9.714 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.859 29.410 8.747 1.00 0.00 H new ATOM 0 HG2 ARG A 32 18.892 27.402 9.536 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.848 27.304 10.940 1.00 0.00 H new ATOM 0 HD2 ARG A 32 16.090 26.338 9.733 1.00 0.00 H new ATOM 0 HD3 ARG A 32 16.426 27.271 8.289 1.00 0.00 H new ATOM 0 HE ARG A 32 18.706 25.518 8.803 1.00 0.00 H new ATOM 0 HH11 ARG A 32 15.332 25.495 7.812 1.00 0.00 H new ATOM 0 HH12 ARG A 32 15.507 24.023 6.850 1.00 0.00 H new ATOM 0 HH21 ARG A 32 18.903 23.642 7.575 1.00 0.00 H new ATOM 0 HH22 ARG A 32 17.504 22.988 6.718 1.00 0.00 H new ATOM 508 N THR A 33 17.089 32.031 10.701 1.00 0.00 N ATOM 509 CA THR A 33 16.990 33.466 10.310 1.00 0.00 C ATOM 510 C THR A 33 18.090 34.245 11.019 1.00 0.00 C ATOM 511 O THR A 33 18.619 35.230 10.508 1.00 0.00 O ATOM 512 CB THR A 33 15.603 33.913 10.785 1.00 0.00 C ATOM 513 OG1 THR A 33 15.216 35.080 10.075 1.00 0.00 O ATOM 514 CG2 THR A 33 15.624 34.222 12.286 1.00 0.00 C ATOM 0 H THR A 33 16.295 31.676 11.234 1.00 0.00 H new ATOM 0 HA THR A 33 17.110 33.631 9.239 1.00 0.00 H new ATOM 0 HB THR A 33 14.892 33.108 10.599 1.00 0.00 H new ATOM 0 HG1 THR A 33 14.328 35.367 10.376 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.631 34.538 12.606 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.916 33.328 12.837 1.00 0.00 H new ATOM 0 HG23 THR A 33 16.340 35.020 12.483 1.00 0.00 H new ATOM 522 N THR A 34 18.447 33.800 12.189 1.00 0.00 N ATOM 523 CA THR A 34 19.529 34.490 12.953 1.00 0.00 C ATOM 524 C THR A 34 20.694 33.527 13.201 1.00 0.00 C ATOM 525 O THR A 34 21.692 33.880 13.827 1.00 0.00 O ATOM 526 CB THR A 34 18.886 34.924 14.274 1.00 0.00 C ATOM 527 OG1 THR A 34 19.831 35.657 15.039 1.00 0.00 O ATOM 528 CG2 THR A 34 18.431 33.699 15.065 1.00 0.00 C ATOM 0 H THR A 34 18.038 32.988 12.652 1.00 0.00 H new ATOM 0 HA THR A 34 19.935 35.344 12.411 1.00 0.00 H new ATOM 0 HB THR A 34 18.020 35.550 14.060 1.00 0.00 H new ATOM 0 HG1 THR A 34 20.738 35.387 14.784 1.00 0.00 H new ATOM 0 HG21 THR A 34 17.976 34.019 16.002 1.00 0.00 H new ATOM 0 HG22 THR A 34 17.702 33.138 14.480 1.00 0.00 H new ATOM 0 HG23 THR A 34 19.291 33.064 15.278 1.00 0.00 H new ATOM 536 N GLY A 35 20.586 32.318 12.716 1.00 0.00 N ATOM 537 CA GLY A 35 21.679 31.332 12.912 1.00 0.00 C ATOM 538 C GLY A 35 21.874 31.061 14.404 1.00 0.00 C ATOM 539 O GLY A 35 22.992 30.848 14.862 1.00 0.00 O ATOM 0 H GLY A 35 19.782 31.973 12.191 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.440 30.404 12.393 1.00 0.00 H new ATOM 0 HA3 GLY A 35 22.604 31.711 12.478 1.00 0.00 H new ATOM 543 N ILE A 36 20.815 31.052 15.172 1.00 0.00 N ATOM 544 CA ILE A 36 20.974 30.776 16.636 1.00 0.00 C ATOM 545 C ILE A 36 20.073 29.616 17.016 1.00 0.00 C ATOM 546 O ILE A 36 19.146 29.270 16.294 1.00 0.00 O ATOM 547 CB ILE A 36 20.451 32.019 17.372 1.00 0.00 C ATOM 548 CG1 ILE A 36 21.367 33.207 17.154 1.00 0.00 C ATOM 549 CG2 ILE A 36 20.395 31.750 18.896 1.00 0.00 C ATOM 550 CD1 ILE A 36 20.726 34.405 17.846 1.00 0.00 C ATOM 0 H ILE A 36 19.860 31.221 14.857 1.00 0.00 H new ATOM 0 HA ILE A 36 22.011 30.548 16.883 1.00 0.00 H new ATOM 0 HB ILE A 36 19.459 32.236 16.977 1.00 0.00 H new ATOM 0 HG12 ILE A 36 22.357 33.010 17.565 1.00 0.00 H new ATOM 0 HG13 ILE A 36 21.497 33.402 16.090 1.00 0.00 H new ATOM 0 HG21 ILE A 36 20.023 32.637 19.409 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.728 30.911 19.093 1.00 0.00 H new ATOM 0 HG23 ILE A 36 21.394 31.513 19.261 1.00 0.00 H new ATOM 0 HD11 ILE A 36 21.357 35.283 17.712 1.00 0.00 H new ATOM 0 HD12 ILE A 36 19.744 34.594 17.412 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.618 34.195 18.910 1.00 0.00 H new ATOM 562 N PHE A 37 20.275 29.073 18.171 1.00 0.00 N ATOM 563 CA PHE A 37 19.372 28.006 18.651 1.00 0.00 C ATOM 564 C PHE A 37 19.275 28.129 20.160 1.00 0.00 C ATOM 565 O PHE A 37 20.267 28.038 20.882 1.00 0.00 O ATOM 566 CB PHE A 37 19.935 26.657 18.190 1.00 0.00 C ATOM 567 CG PHE A 37 21.032 26.170 19.092 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.703 25.595 20.321 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.363 26.248 18.686 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.703 25.101 21.149 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.366 25.744 19.511 1.00 0.00 C ATOM 572 CZ PHE A 37 23.035 25.170 20.746 1.00 0.00 C ATOM 0 H PHE A 37 21.031 29.323 18.809 1.00 0.00 H new ATOM 0 HA PHE A 37 18.364 28.091 18.244 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.133 25.919 18.163 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.316 26.751 17.173 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.669 25.534 20.628 1.00 0.00 H new ATOM 0 HD2 PHE A 37 22.615 26.697 17.737 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.448 24.664 22.103 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.399 25.796 19.199 1.00 0.00 H new ATOM 0 HZ PHE A 37 23.813 24.781 21.386 1.00 0.00 H new ATOM 596 N ARG A 39 16.909 27.646 23.984 1.00 0.00 N ATOM 597 CA ARG A 39 16.143 26.665 24.732 1.00 0.00 C ATOM 598 C ARG A 39 14.670 26.997 24.536 1.00 0.00 C ATOM 599 O ARG A 39 14.346 27.982 23.874 1.00 0.00 O ATOM 600 CB ARG A 39 16.595 26.928 26.154 1.00 0.00 C ATOM 601 CG ARG A 39 17.808 26.058 26.470 1.00 0.00 C ATOM 602 CD ARG A 39 18.436 26.537 27.775 1.00 0.00 C ATOM 603 NE ARG A 39 19.894 26.316 27.613 1.00 0.00 N ATOM 604 CZ ARG A 39 20.662 26.249 28.664 1.00 0.00 C ATOM 605 NH1 ARG A 39 20.156 26.375 29.861 1.00 0.00 N ATOM 606 NH2 ARG A 39 21.944 26.060 28.521 1.00 0.00 N ATOM 0 HA ARG A 39 16.281 25.623 24.444 1.00 0.00 H new ATOM 0 HB2 ARG A 39 16.847 27.981 26.278 1.00 0.00 H new ATOM 0 HB3 ARG A 39 15.786 26.710 26.851 1.00 0.00 H new ATOM 0 HG2 ARG A 39 17.510 25.013 26.557 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.534 26.116 25.659 1.00 0.00 H new ATOM 0 HD2 ARG A 39 18.215 27.589 27.955 1.00 0.00 H new ATOM 0 HD3 ARG A 39 18.046 25.980 28.627 1.00 0.00 H new ATOM 0 HE ARG A 39 20.295 26.217 26.680 1.00 0.00 H new ATOM 0 HH11 ARG A 39 19.154 26.527 29.978 1.00 0.00 H new ATOM 0 HH12 ARG A 39 20.763 26.322 30.679 1.00 0.00 H new ATOM 0 HH21 ARG A 39 22.345 25.965 27.588 1.00 0.00 H new ATOM 0 HH22 ARG A 39 22.546 26.007 29.342 1.00 0.00 H new ATOM 620 N PRO A 40 13.813 26.204 25.094 1.00 0.00 N ATOM 621 CA PRO A 40 12.375 26.472 24.941 1.00 0.00 C ATOM 622 C PRO A 40 11.975 27.721 25.731 1.00 0.00 C ATOM 623 O PRO A 40 10.925 28.312 25.499 1.00 0.00 O ATOM 624 CB PRO A 40 11.711 25.227 25.521 1.00 0.00 C ATOM 625 CG PRO A 40 12.721 24.665 26.464 1.00 0.00 C ATOM 626 CD PRO A 40 14.075 25.010 25.903 1.00 0.00 C ATOM 0 HA PRO A 40 12.084 26.661 23.908 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.783 25.476 26.036 1.00 0.00 H new ATOM 0 HB3 PRO A 40 11.458 24.512 24.738 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.596 25.087 27.461 1.00 0.00 H new ATOM 0 HG3 PRO A 40 12.604 23.585 26.558 1.00 0.00 H new ATOM 0 HD2 PRO A 40 14.798 25.211 26.693 1.00 0.00 H new ATOM 0 HD3 PRO A 40 14.479 24.197 25.300 1.00 0.00 H new ATOM 634 N SER A 41 12.761 28.105 26.693 1.00 0.00 N ATOM 635 CA SER A 41 12.397 29.266 27.518 1.00 0.00 C ATOM 636 C SER A 41 13.375 30.459 27.371 1.00 0.00 C ATOM 637 O SER A 41 13.552 31.228 28.314 1.00 0.00 O ATOM 638 CB SER A 41 12.378 28.682 28.928 1.00 0.00 C ATOM 639 OG SER A 41 13.695 28.682 29.462 1.00 0.00 O ATOM 0 H SER A 41 13.644 27.657 26.939 1.00 0.00 H new ATOM 0 HA SER A 41 11.445 29.708 27.224 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.716 29.268 29.566 1.00 0.00 H new ATOM 0 HB3 SER A 41 11.984 27.666 28.906 1.00 0.00 H new ATOM 0 HG SER A 41 13.681 28.308 30.368 1.00 0.00 H new ATOM 645 N CYS A 42 13.998 30.654 26.216 1.00 0.00 N ATOM 646 CA CYS A 42 14.926 31.824 26.050 1.00 0.00 C ATOM 647 C CYS A 42 14.274 33.084 26.609 1.00 0.00 C ATOM 648 O CYS A 42 13.072 33.304 26.477 1.00 0.00 O ATOM 649 CB CYS A 42 15.179 31.997 24.551 1.00 0.00 C ATOM 650 SG CYS A 42 16.393 33.335 24.303 1.00 0.00 S ATOM 0 H CYS A 42 13.901 30.057 25.395 1.00 0.00 H new ATOM 0 HA CYS A 42 15.861 31.653 26.584 1.00 0.00 H new ATOM 0 HB2 CYS A 42 15.552 31.067 24.122 1.00 0.00 H new ATOM 0 HB3 CYS A 42 14.247 32.234 24.037 1.00 0.00 H new ATOM 0 HG CYS A 42 16.616 33.488 23.032 1.00 0.00 H new ATOM 655 N ARG A 43 15.046 33.888 27.253 1.00 0.00 N ATOM 656 CA ARG A 43 14.501 35.133 27.871 1.00 0.00 C ATOM 657 C ARG A 43 14.778 36.375 27.018 1.00 0.00 C ATOM 658 O ARG A 43 14.528 37.498 27.455 1.00 0.00 O ATOM 659 CB ARG A 43 15.226 35.248 29.215 1.00 0.00 C ATOM 660 CG ARG A 43 16.739 35.341 28.987 1.00 0.00 C ATOM 661 CD ARG A 43 17.324 36.433 29.889 1.00 0.00 C ATOM 662 NE ARG A 43 17.989 37.386 28.955 1.00 0.00 N ATOM 663 CZ ARG A 43 18.173 38.642 29.290 1.00 0.00 C ATOM 664 NH1 ARG A 43 17.777 39.094 30.454 1.00 0.00 N ATOM 665 NH2 ARG A 43 18.760 39.448 28.450 1.00 0.00 N ATOM 0 H ARG A 43 16.047 33.745 27.386 1.00 0.00 H new ATOM 0 HA ARG A 43 13.417 35.078 27.970 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.876 36.129 29.752 1.00 0.00 H new ATOM 0 HB3 ARG A 43 14.996 34.383 29.837 1.00 0.00 H new ATOM 0 HG2 ARG A 43 17.210 34.383 29.205 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.947 35.568 27.941 1.00 0.00 H new ATOM 0 HD2 ARG A 43 16.544 36.927 30.468 1.00 0.00 H new ATOM 0 HD3 ARG A 43 18.036 36.017 30.602 1.00 0.00 H new ATOM 0 HE ARG A 43 18.306 37.057 28.043 1.00 0.00 H new ATOM 0 HH11 ARG A 43 17.318 38.467 31.115 1.00 0.00 H new ATOM 0 HH12 ARG A 43 17.927 40.073 30.699 1.00 0.00 H new ATOM 0 HH21 ARG A 43 19.071 39.101 27.543 1.00 0.00 H new ATOM 0 HH22 ARG A 43 18.908 40.426 28.700 1.00 0.00 H new ATOM 679 N ALA A 44 15.310 36.226 25.833 1.00 0.00 N ATOM 680 CA ALA A 44 15.607 37.449 25.024 1.00 0.00 C ATOM 681 C ALA A 44 14.433 37.856 24.134 1.00 0.00 C ATOM 682 O ALA A 44 14.000 39.006 24.142 1.00 0.00 O ATOM 683 CB ALA A 44 16.801 37.049 24.169 1.00 0.00 C ATOM 0 H ALA A 44 15.547 35.335 25.397 1.00 0.00 H new ATOM 0 HA ALA A 44 15.800 38.311 25.663 1.00 0.00 H new ATOM 0 HB1 ALA A 44 17.093 37.888 23.537 1.00 0.00 H new ATOM 0 HB2 ALA A 44 17.635 36.773 24.815 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.531 36.199 23.542 1.00 0.00 H new ATOM 689 N ARG A 45 13.918 36.930 23.380 1.00 0.00 N ATOM 690 CA ARG A 45 12.765 37.203 22.455 1.00 0.00 C ATOM 691 C ARG A 45 12.620 35.964 21.533 1.00 0.00 C ATOM 692 O ARG A 45 13.284 34.953 21.754 1.00 0.00 O ATOM 693 CB ARG A 45 13.138 38.495 21.680 1.00 0.00 C ATOM 694 CG ARG A 45 11.894 39.167 21.091 1.00 0.00 C ATOM 695 CD ARG A 45 11.890 40.669 21.446 1.00 0.00 C ATOM 696 NE ARG A 45 13.180 41.231 20.912 1.00 0.00 N ATOM 697 CZ ARG A 45 13.258 42.476 20.503 1.00 0.00 C ATOM 698 NH1 ARG A 45 12.216 43.269 20.550 1.00 0.00 N ATOM 699 NH2 ARG A 45 14.391 42.931 20.045 1.00 0.00 N ATOM 0 H ARG A 45 14.251 35.966 23.360 1.00 0.00 H new ATOM 0 HA ARG A 45 11.809 37.358 22.955 1.00 0.00 H new ATOM 0 HB2 ARG A 45 13.647 39.189 22.349 1.00 0.00 H new ATOM 0 HB3 ARG A 45 13.837 38.253 20.880 1.00 0.00 H new ATOM 0 HG2 ARG A 45 11.880 39.040 20.008 1.00 0.00 H new ATOM 0 HG3 ARG A 45 10.994 38.690 21.480 1.00 0.00 H new ATOM 0 HD2 ARG A 45 11.032 41.172 21.000 1.00 0.00 H new ATOM 0 HD3 ARG A 45 11.819 40.814 22.524 1.00 0.00 H new ATOM 0 HE ARG A 45 14.007 40.635 20.867 1.00 0.00 H new ATOM 0 HH11 ARG A 45 11.327 42.922 20.909 1.00 0.00 H new ATOM 0 HH12 ARG A 45 12.294 44.234 20.228 1.00 0.00 H new ATOM 0 HH21 ARG A 45 15.207 42.321 20.007 1.00 0.00 H new ATOM 0 HH22 ARG A 45 14.461 43.897 19.725 1.00 0.00 H new ATOM 713 N HIS A 46 11.768 35.988 20.537 1.00 0.00 N ATOM 714 CA HIS A 46 11.601 34.778 19.664 1.00 0.00 C ATOM 715 C HIS A 46 11.414 35.082 18.188 1.00 0.00 C ATOM 716 O HIS A 46 10.970 36.155 17.799 1.00 0.00 O ATOM 717 CB HIS A 46 10.340 34.102 20.151 1.00 0.00 C ATOM 718 CG HIS A 46 10.684 33.107 21.196 1.00 0.00 C ATOM 719 ND1 HIS A 46 10.759 31.767 20.900 1.00 0.00 N ATOM 720 CD2 HIS A 46 10.928 33.218 22.535 1.00 0.00 C ATOM 721 CE1 HIS A 46 11.016 31.125 22.032 1.00 0.00 C ATOM 722 NE2 HIS A 46 11.136 31.956 23.071 1.00 0.00 N ATOM 0 H HIS A 46 11.183 36.786 20.290 1.00 0.00 H new ATOM 0 HA HIS A 46 12.509 34.179 19.737 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.649 34.843 20.553 1.00 0.00 H new ATOM 0 HB3 HIS A 46 9.833 33.612 19.320 1.00 0.00 H new ATOM 0 HD1 HIS A 46 10.639 31.344 19.980 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.955 34.144 23.090 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.117 30.052 22.105 1.00 0.00 H new ATOM 730 N ALA A 47 11.669 34.083 17.382 1.00 0.00 N ATOM 731 CA ALA A 47 11.457 34.179 15.914 1.00 0.00 C ATOM 732 C ALA A 47 10.428 33.122 15.491 1.00 0.00 C ATOM 733 O ALA A 47 10.182 32.156 16.211 1.00 0.00 O ATOM 734 CB ALA A 47 12.816 33.893 15.277 1.00 0.00 C ATOM 0 H ALA A 47 12.026 33.180 17.695 1.00 0.00 H new ATOM 0 HA ALA A 47 11.082 35.155 15.608 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.728 33.948 14.192 1.00 0.00 H new ATOM 0 HB2 ALA A 47 13.541 34.631 15.620 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.149 32.896 15.564 1.00 0.00 H new ATOM 740 N LEU A 48 9.802 33.297 14.360 1.00 0.00 N ATOM 741 CA LEU A 48 8.772 32.328 13.913 1.00 0.00 C ATOM 742 C LEU A 48 9.298 30.887 13.908 1.00 0.00 C ATOM 743 O LEU A 48 10.500 30.637 13.850 1.00 0.00 O ATOM 744 CB LEU A 48 8.397 32.760 12.493 1.00 0.00 C ATOM 745 CG LEU A 48 7.415 33.933 12.550 1.00 0.00 C ATOM 746 CD1 LEU A 48 7.259 34.533 11.151 1.00 0.00 C ATOM 747 CD2 LEU A 48 6.053 33.436 13.042 1.00 0.00 C ATOM 0 H LEU A 48 9.964 34.078 13.724 1.00 0.00 H new ATOM 0 HA LEU A 48 7.918 32.332 14.591 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.292 33.050 11.943 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.949 31.924 11.955 1.00 0.00 H new ATOM 0 HG LEU A 48 7.795 34.692 13.234 1.00 0.00 H new ATOM 0 HD11 LEU A 48 6.560 35.369 11.189 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.227 34.886 10.796 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.878 33.772 10.469 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.354 34.271 13.083 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.673 32.678 12.357 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.161 33.005 14.037 1.00 0.00 H new ATOM 759 N ARG A 49 8.399 29.937 13.943 1.00 0.00 N ATOM 760 CA ARG A 49 8.796 28.494 13.917 1.00 0.00 C ATOM 761 C ARG A 49 9.439 28.188 12.573 1.00 0.00 C ATOM 762 O ARG A 49 10.306 27.328 12.428 1.00 0.00 O ATOM 763 CB ARG A 49 7.467 27.772 13.990 1.00 0.00 C ATOM 764 CG ARG A 49 7.671 26.338 14.484 1.00 0.00 C ATOM 765 CD ARG A 49 6.475 25.481 14.063 1.00 0.00 C ATOM 766 NE ARG A 49 7.067 24.193 13.595 1.00 0.00 N ATOM 767 CZ ARG A 49 7.727 24.132 12.463 1.00 0.00 C ATOM 768 NH1 ARG A 49 7.880 25.198 11.720 1.00 0.00 N ATOM 769 NH2 ARG A 49 8.237 22.996 12.074 1.00 0.00 N ATOM 0 H ARG A 49 7.393 30.101 13.989 1.00 0.00 H new ATOM 0 HA ARG A 49 9.493 28.217 14.708 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.793 28.303 14.662 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.996 27.762 13.007 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.591 25.926 14.070 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.777 26.327 15.569 1.00 0.00 H new ATOM 0 HD2 ARG A 49 5.791 25.321 14.897 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.903 25.964 13.270 1.00 0.00 H new ATOM 0 HE ARG A 49 6.957 23.352 14.161 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.484 26.089 12.019 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.395 25.138 10.842 1.00 0.00 H new ATOM 0 HH21 ARG A 49 8.121 22.162 12.649 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.751 22.942 11.195 1.00 0.00 H new ATOM 783 N GLU A 50 8.989 28.905 11.599 1.00 0.00 N ATOM 784 CA GLU A 50 9.464 28.778 10.206 1.00 0.00 C ATOM 785 C GLU A 50 10.970 28.566 10.130 1.00 0.00 C ATOM 786 O GLU A 50 11.461 27.545 9.652 1.00 0.00 O ATOM 787 CB GLU A 50 9.109 30.140 9.646 1.00 0.00 C ATOM 788 CG GLU A 50 9.165 30.097 8.148 1.00 0.00 C ATOM 789 CD GLU A 50 10.617 30.136 7.666 1.00 0.00 C ATOM 790 OE1 GLU A 50 11.143 31.227 7.519 1.00 0.00 O ATOM 791 OE2 GLU A 50 11.177 29.074 7.451 1.00 0.00 O ATOM 0 H GLU A 50 8.268 29.616 11.720 1.00 0.00 H new ATOM 0 HA GLU A 50 9.029 27.928 9.680 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.111 30.431 9.975 1.00 0.00 H new ATOM 0 HB3 GLU A 50 9.801 30.892 10.025 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.679 29.191 7.786 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.615 30.941 7.733 1.00 0.00 H new ATOM 798 N ASN A 51 11.697 29.524 10.600 1.00 0.00 N ATOM 799 CA ASN A 51 13.179 29.429 10.581 1.00 0.00 C ATOM 800 C ASN A 51 13.643 28.782 11.870 1.00 0.00 C ATOM 801 O ASN A 51 14.794 28.878 12.253 1.00 0.00 O ATOM 802 CB ASN A 51 13.655 30.879 10.550 1.00 0.00 C ATOM 803 CG ASN A 51 13.285 31.524 9.215 1.00 0.00 C ATOM 804 OD1 ASN A 51 13.677 31.042 8.155 1.00 0.00 O ATOM 805 ND2 ASN A 51 12.543 32.598 9.213 1.00 0.00 N ATOM 0 H ASN A 51 11.327 30.384 11.004 1.00 0.00 H new ATOM 0 HA ASN A 51 13.557 28.845 9.742 1.00 0.00 H new ATOM 0 HB2 ASN A 51 13.202 31.436 11.370 1.00 0.00 H new ATOM 0 HB3 ASN A 51 14.735 30.919 10.695 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.287 33.039 8.330 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.219 32.996 10.095 1.00 0.00 H new ATOM 812 N VAL A 52 12.754 28.139 12.552 1.00 0.00 N ATOM 813 CA VAL A 52 13.121 27.507 13.841 1.00 0.00 C ATOM 814 C VAL A 52 13.077 25.976 13.750 1.00 0.00 C ATOM 815 O VAL A 52 12.117 25.388 13.256 1.00 0.00 O ATOM 816 CB VAL A 52 12.057 28.041 14.802 1.00 0.00 C ATOM 817 CG1 VAL A 52 11.774 27.024 15.899 1.00 0.00 C ATOM 818 CG2 VAL A 52 12.550 29.339 15.443 1.00 0.00 C ATOM 0 H VAL A 52 11.780 28.021 12.273 1.00 0.00 H new ATOM 0 HA VAL A 52 14.138 27.740 14.156 1.00 0.00 H new ATOM 0 HB VAL A 52 11.142 28.226 14.239 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.015 27.419 16.574 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.415 26.097 15.452 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.689 26.827 16.457 1.00 0.00 H new ATOM 0 HG21 VAL A 52 11.791 29.718 16.127 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.471 29.146 15.993 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.740 30.079 14.666 1.00 0.00 H new ATOM 828 N SER A 53 14.095 25.328 14.247 1.00 0.00 N ATOM 829 CA SER A 53 14.134 23.842 14.239 1.00 0.00 C ATOM 830 C SER A 53 14.392 23.360 15.661 1.00 0.00 C ATOM 831 O SER A 53 14.579 24.166 16.563 1.00 0.00 O ATOM 832 CB SER A 53 15.292 23.467 13.323 1.00 0.00 C ATOM 833 OG SER A 53 16.391 24.332 13.578 1.00 0.00 O ATOM 0 H SER A 53 14.912 25.774 14.664 1.00 0.00 H new ATOM 0 HA SER A 53 13.204 23.392 13.892 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.583 22.430 13.492 1.00 0.00 H new ATOM 0 HB3 SER A 53 14.986 23.546 12.280 1.00 0.00 H new ATOM 0 HG SER A 53 17.214 23.925 13.235 1.00 0.00 H new ATOM 839 N PHE A 54 14.372 22.081 15.896 1.00 0.00 N ATOM 840 CA PHE A 54 14.581 21.579 17.256 1.00 0.00 C ATOM 841 C PHE A 54 15.703 20.557 17.286 1.00 0.00 C ATOM 842 O PHE A 54 15.968 19.854 16.313 1.00 0.00 O ATOM 843 CB PHE A 54 13.247 20.958 17.596 1.00 0.00 C ATOM 844 CG PHE A 54 12.214 22.049 17.517 1.00 0.00 C ATOM 845 CD1 PHE A 54 11.598 22.334 16.295 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.918 22.811 18.650 1.00 0.00 C ATOM 847 CE1 PHE A 54 10.684 23.384 16.204 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.994 23.855 18.562 1.00 0.00 C ATOM 849 CZ PHE A 54 10.382 24.143 17.337 1.00 0.00 C ATOM 0 H PHE A 54 14.217 21.363 15.188 1.00 0.00 H new ATOM 0 HA PHE A 54 14.879 22.350 17.967 1.00 0.00 H new ATOM 0 HB2 PHE A 54 13.010 20.153 16.901 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.269 20.521 18.594 1.00 0.00 H new ATOM 0 HD1 PHE A 54 11.829 21.742 15.422 1.00 0.00 H new ATOM 0 HD2 PHE A 54 12.402 22.594 19.591 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.211 23.609 15.260 1.00 0.00 H new ATOM 0 HE2 PHE A 54 10.752 24.439 19.438 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.674 24.955 17.267 1.00 0.00 H new ATOM 859 N TYR A 55 16.374 20.485 18.387 1.00 0.00 N ATOM 860 CA TYR A 55 17.508 19.534 18.520 1.00 0.00 C ATOM 861 C TYR A 55 17.447 18.820 19.856 1.00 0.00 C ATOM 862 O TYR A 55 16.914 19.345 20.827 1.00 0.00 O ATOM 863 CB TYR A 55 18.753 20.417 18.472 1.00 0.00 C ATOM 864 CG TYR A 55 18.953 20.918 17.067 1.00 0.00 C ATOM 865 CD1 TYR A 55 18.933 20.012 16.009 1.00 0.00 C ATOM 866 CD2 TYR A 55 19.153 22.280 16.822 1.00 0.00 C ATOM 867 CE1 TYR A 55 19.112 20.459 14.699 1.00 0.00 C ATOM 868 CE2 TYR A 55 19.334 22.730 15.511 1.00 0.00 C ATOM 869 CZ TYR A 55 19.314 21.820 14.447 1.00 0.00 C ATOM 870 OH TYR A 55 19.490 22.265 13.151 1.00 0.00 O ATOM 0 H TYR A 55 16.187 21.050 19.216 1.00 0.00 H new ATOM 0 HA TYR A 55 17.496 18.770 17.743 1.00 0.00 H new ATOM 0 HB2 TYR A 55 18.644 21.257 19.158 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.627 19.852 18.797 1.00 0.00 H new ATOM 0 HD1 TYR A 55 18.779 18.961 16.203 1.00 0.00 H new ATOM 0 HD2 TYR A 55 19.168 22.982 17.643 1.00 0.00 H new ATOM 0 HE1 TYR A 55 19.095 19.755 13.881 1.00 0.00 H new ATOM 0 HE2 TYR A 55 19.490 23.781 15.318 1.00 0.00 H new ATOM 0 HH TYR A 55 19.617 23.237 13.153 1.00 0.00 H new ATOM 880 N ALA A 56 18.017 17.654 19.940 1.00 0.00 N ATOM 881 CA ALA A 56 18.023 16.942 21.241 1.00 0.00 C ATOM 882 C ALA A 56 18.953 17.697 22.179 1.00 0.00 C ATOM 883 O ALA A 56 18.672 17.868 23.361 1.00 0.00 O ATOM 884 CB ALA A 56 18.561 15.548 20.949 1.00 0.00 C ATOM 0 H ALA A 56 18.475 17.167 19.170 1.00 0.00 H new ATOM 0 HA ALA A 56 17.039 16.880 21.705 1.00 0.00 H new ATOM 0 HB1 ALA A 56 18.591 14.969 21.872 1.00 0.00 H new ATOM 0 HB2 ALA A 56 17.911 15.050 20.229 1.00 0.00 H new ATOM 0 HB3 ALA A 56 19.567 15.625 20.536 1.00 0.00 H new ATOM 890 N ASN A 57 20.059 18.168 21.668 1.00 0.00 N ATOM 891 CA ASN A 57 20.993 18.922 22.517 1.00 0.00 C ATOM 892 C ASN A 57 21.553 20.118 21.770 1.00 0.00 C ATOM 893 O ASN A 57 21.496 20.220 20.537 1.00 0.00 O ATOM 894 CB ASN A 57 22.128 17.973 22.832 1.00 0.00 C ATOM 895 CG ASN A 57 22.716 17.445 21.534 1.00 0.00 C ATOM 896 OD1 ASN A 57 23.631 18.048 20.982 1.00 0.00 O ATOM 897 ND2 ASN A 57 22.229 16.359 21.007 1.00 0.00 N ATOM 0 H ASN A 57 20.346 18.057 20.696 1.00 0.00 H new ATOM 0 HA ASN A 57 20.490 19.288 23.412 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.896 18.486 23.411 1.00 0.00 H new ATOM 0 HB3 ASN A 57 21.767 17.146 23.444 1.00 0.00 H new ATOM 0 HD21 ASN A 57 22.608 16.004 20.129 1.00 0.00 H new ATOM 0 HD22 ASN A 57 21.468 15.863 21.472 1.00 0.00 H new ATOM 904 N ALA A 58 22.122 21.007 22.505 1.00 0.00 N ATOM 905 CA ALA A 58 22.730 22.197 21.890 1.00 0.00 C ATOM 906 C ALA A 58 23.886 21.786 20.983 1.00 0.00 C ATOM 907 O ALA A 58 24.237 22.512 20.071 1.00 0.00 O ATOM 908 CB ALA A 58 23.244 23.021 23.065 1.00 0.00 C ATOM 0 H ALA A 58 22.194 20.961 23.521 1.00 0.00 H new ATOM 0 HA ALA A 58 22.024 22.754 21.274 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.715 23.931 22.693 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.411 23.284 23.717 1.00 0.00 H new ATOM 0 HB3 ALA A 58 23.974 22.438 23.626 1.00 0.00 H new ATOM 914 N SER A 59 24.488 20.637 21.194 1.00 0.00 N ATOM 915 CA SER A 59 25.618 20.248 20.302 1.00 0.00 C ATOM 916 C SER A 59 25.071 19.908 18.923 1.00 0.00 C ATOM 917 O SER A 59 25.674 20.230 17.902 1.00 0.00 O ATOM 918 CB SER A 59 26.284 19.039 20.963 1.00 0.00 C ATOM 919 OG SER A 59 27.043 18.331 19.992 1.00 0.00 O ATOM 0 H SER A 59 24.250 19.969 21.928 1.00 0.00 H new ATOM 0 HA SER A 59 26.345 21.050 20.170 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.930 19.366 21.778 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.528 18.385 21.398 1.00 0.00 H new ATOM 0 HG SER A 59 27.472 17.557 20.413 1.00 0.00 H new ATOM 925 N GLU A 60 23.916 19.306 18.868 1.00 0.00 N ATOM 926 CA GLU A 60 23.310 19.002 17.551 1.00 0.00 C ATOM 927 C GLU A 60 23.060 20.336 16.859 1.00 0.00 C ATOM 928 O GLU A 60 23.475 20.574 15.717 1.00 0.00 O ATOM 929 CB GLU A 60 22.001 18.280 17.868 1.00 0.00 C ATOM 930 CG GLU A 60 21.342 17.825 16.568 1.00 0.00 C ATOM 931 CD GLU A 60 22.301 16.925 15.783 1.00 0.00 C ATOM 932 OE1 GLU A 60 22.337 15.739 16.069 1.00 0.00 O ATOM 933 OE2 GLU A 60 22.981 17.437 14.909 1.00 0.00 O ATOM 0 H GLU A 60 23.370 19.014 19.678 1.00 0.00 H new ATOM 0 HA GLU A 60 23.930 18.385 16.900 1.00 0.00 H new ATOM 0 HB2 GLU A 60 22.194 17.421 18.510 1.00 0.00 H new ATOM 0 HB3 GLU A 60 21.331 18.943 18.415 1.00 0.00 H new ATOM 0 HG2 GLU A 60 20.421 17.285 16.787 1.00 0.00 H new ATOM 0 HG3 GLU A 60 21.069 18.692 15.966 1.00 0.00 H new ATOM 940 N ALA A 61 22.442 21.240 17.566 1.00 0.00 N ATOM 941 CA ALA A 61 22.213 22.595 16.995 1.00 0.00 C ATOM 942 C ALA A 61 23.559 23.205 16.659 1.00 0.00 C ATOM 943 O ALA A 61 23.761 23.800 15.601 1.00 0.00 O ATOM 944 CB ALA A 61 21.573 23.386 18.117 1.00 0.00 C ATOM 0 H ALA A 61 22.087 21.099 18.512 1.00 0.00 H new ATOM 0 HA ALA A 61 21.596 22.581 16.096 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.371 24.402 17.777 1.00 0.00 H new ATOM 0 HB2 ALA A 61 20.638 22.909 18.411 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.249 23.417 18.972 1.00 0.00 H new ATOM 950 N LEU A 62 24.490 23.041 17.551 1.00 0.00 N ATOM 951 CA LEU A 62 25.849 23.569 17.326 1.00 0.00 C ATOM 952 C LEU A 62 26.433 22.879 16.092 1.00 0.00 C ATOM 953 O LEU A 62 27.265 23.434 15.378 1.00 0.00 O ATOM 954 CB LEU A 62 26.602 23.183 18.602 1.00 0.00 C ATOM 955 CG LEU A 62 26.168 24.071 19.780 1.00 0.00 C ATOM 956 CD1 LEU A 62 26.693 23.472 21.089 1.00 0.00 C ATOM 957 CD2 LEU A 62 26.715 25.491 19.624 1.00 0.00 C ATOM 0 H LEU A 62 24.360 22.555 18.438 1.00 0.00 H new ATOM 0 HA LEU A 62 25.897 24.643 17.145 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.412 22.136 18.840 1.00 0.00 H new ATOM 0 HB3 LEU A 62 27.675 23.283 18.441 1.00 0.00 H new ATOM 0 HG LEU A 62 25.079 24.115 19.795 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.386 24.100 21.925 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.285 22.470 21.220 1.00 0.00 H new ATOM 0 HD13 LEU A 62 27.781 23.420 21.054 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.394 26.099 20.470 1.00 0.00 H new ATOM 0 HD22 LEU A 62 27.804 25.460 19.592 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.337 25.927 18.699 1.00 0.00 H new ATOM 969 N ALA A 63 25.990 21.674 15.824 1.00 0.00 N ATOM 970 CA ALA A 63 26.481 20.938 14.641 1.00 0.00 C ATOM 971 C ALA A 63 25.792 21.456 13.376 1.00 0.00 C ATOM 972 O ALA A 63 26.277 21.260 12.263 1.00 0.00 O ATOM 973 CB ALA A 63 26.109 19.474 14.894 1.00 0.00 C ATOM 0 H ALA A 63 25.302 21.173 16.387 1.00 0.00 H new ATOM 0 HA ALA A 63 27.554 21.063 14.495 1.00 0.00 H new ATOM 0 HB1 ALA A 63 26.443 18.864 14.055 1.00 0.00 H new ATOM 0 HB2 ALA A 63 26.592 19.129 15.808 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.028 19.386 14.999 1.00 0.00 H new ATOM 979 N ALA A 64 24.674 22.124 13.524 1.00 0.00 N ATOM 980 CA ALA A 64 23.965 22.660 12.316 1.00 0.00 C ATOM 981 C ALA A 64 24.647 23.926 11.814 1.00 0.00 C ATOM 982 O ALA A 64 24.240 24.538 10.829 1.00 0.00 O ATOM 983 CB ALA A 64 22.526 22.959 12.750 1.00 0.00 C ATOM 0 H ALA A 64 24.224 22.321 14.418 1.00 0.00 H new ATOM 0 HA ALA A 64 23.985 21.939 11.498 1.00 0.00 H new ATOM 0 HB1 ALA A 64 21.965 23.353 11.903 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.054 22.042 13.102 1.00 0.00 H new ATOM 0 HB3 ALA A 64 22.534 23.695 13.554 1.00 0.00 H new ATOM 989 N GLY A 65 25.678 24.310 12.479 1.00 0.00 N ATOM 990 CA GLY A 65 26.435 25.532 12.079 1.00 0.00 C ATOM 991 C GLY A 65 25.764 26.782 12.656 1.00 0.00 C ATOM 992 O GLY A 65 25.694 27.822 12.004 1.00 0.00 O ATOM 0 H GLY A 65 26.045 23.829 13.300 1.00 0.00 H new ATOM 0 HA2 GLY A 65 27.463 25.465 12.435 1.00 0.00 H new ATOM 0 HA3 GLY A 65 26.478 25.602 10.992 1.00 0.00 H new ATOM 996 N PHE A 66 25.277 26.709 13.866 1.00 0.00 N ATOM 997 CA PHE A 66 24.622 27.902 14.482 1.00 0.00 C ATOM 998 C PHE A 66 25.427 28.453 15.651 1.00 0.00 C ATOM 999 O PHE A 66 26.274 27.778 16.232 1.00 0.00 O ATOM 1000 CB PHE A 66 23.262 27.425 14.995 1.00 0.00 C ATOM 1001 CG PHE A 66 22.341 27.149 13.840 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.613 26.115 12.945 1.00 0.00 C ATOM 1003 CD2 PHE A 66 21.207 27.949 13.666 1.00 0.00 C ATOM 1004 CE1 PHE A 66 21.747 25.879 11.871 1.00 0.00 C ATOM 1005 CE2 PHE A 66 20.342 27.714 12.598 1.00 0.00 C ATOM 1006 CZ PHE A 66 20.612 26.680 11.700 1.00 0.00 C ATOM 0 H PHE A 66 25.304 25.876 14.455 1.00 0.00 H new ATOM 0 HA PHE A 66 24.539 28.701 13.745 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.387 26.523 15.594 1.00 0.00 H new ATOM 0 HB3 PHE A 66 22.825 28.182 15.646 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.489 25.498 13.080 1.00 0.00 H new ATOM 0 HD2 PHE A 66 21.001 28.750 14.360 1.00 0.00 H new ATOM 0 HE1 PHE A 66 21.954 25.080 11.175 1.00 0.00 H new ATOM 0 HE2 PHE A 66 19.465 28.331 12.466 1.00 0.00 H new ATOM 0 HZ PHE A 66 19.944 26.498 10.871 1.00 0.00 H new ATOM 1016 N ARG A 67 25.130 29.663 16.026 1.00 0.00 N ATOM 1017 CA ARG A 67 25.810 30.284 17.183 1.00 0.00 C ATOM 1018 C ARG A 67 24.871 30.159 18.382 1.00 0.00 C ATOM 1019 O ARG A 67 23.783 30.732 18.381 1.00 0.00 O ATOM 1020 CB ARG A 67 26.010 31.752 16.799 1.00 0.00 C ATOM 1021 CG ARG A 67 27.075 31.861 15.704 1.00 0.00 C ATOM 1022 CD ARG A 67 28.026 33.018 16.029 1.00 0.00 C ATOM 1023 NE ARG A 67 29.320 32.650 15.380 1.00 0.00 N ATOM 1024 CZ ARG A 67 30.056 31.677 15.859 1.00 0.00 C ATOM 1025 NH1 ARG A 67 29.673 31.006 16.916 1.00 0.00 N ATOM 1026 NH2 ARG A 67 31.184 31.373 15.276 1.00 0.00 N ATOM 0 H ARG A 67 24.434 30.253 15.570 1.00 0.00 H new ATOM 0 HA ARG A 67 26.764 29.821 17.434 1.00 0.00 H new ATOM 0 HB2 ARG A 67 25.070 32.177 16.448 1.00 0.00 H new ATOM 0 HB3 ARG A 67 26.314 32.328 17.673 1.00 0.00 H new ATOM 0 HG2 ARG A 67 27.633 30.927 15.630 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.601 32.026 14.736 1.00 0.00 H new ATOM 0 HD2 ARG A 67 27.645 33.963 15.641 1.00 0.00 H new ATOM 0 HD3 ARG A 67 28.145 33.140 17.106 1.00 0.00 H new ATOM 0 HE ARG A 67 29.634 33.161 14.555 1.00 0.00 H new ATOM 0 HH11 ARG A 67 28.793 31.238 17.376 1.00 0.00 H new ATOM 0 HH12 ARG A 67 30.255 30.251 17.279 1.00 0.00 H new ATOM 0 HH21 ARG A 67 31.488 31.892 14.452 1.00 0.00 H new ATOM 0 HH22 ARG A 67 31.761 30.617 15.644 1.00 0.00 H new ATOM 1040 N PRO A 68 25.282 29.395 19.355 1.00 0.00 N ATOM 1041 CA PRO A 68 24.429 29.177 20.543 1.00 0.00 C ATOM 1042 C PRO A 68 24.189 30.486 21.297 1.00 0.00 C ATOM 1043 O PRO A 68 25.108 31.257 21.564 1.00 0.00 O ATOM 1044 CB PRO A 68 25.211 28.152 21.365 1.00 0.00 C ATOM 1045 CG PRO A 68 26.626 28.287 20.906 1.00 0.00 C ATOM 1046 CD PRO A 68 26.563 28.683 19.456 1.00 0.00 C ATOM 0 HA PRO A 68 23.429 28.819 20.299 1.00 0.00 H new ATOM 0 HB2 PRO A 68 25.122 28.351 22.433 1.00 0.00 H new ATOM 0 HB3 PRO A 68 24.836 27.142 21.197 1.00 0.00 H new ATOM 0 HG2 PRO A 68 27.155 29.039 21.492 1.00 0.00 H new ATOM 0 HG3 PRO A 68 27.166 27.348 21.030 1.00 0.00 H new ATOM 0 HD2 PRO A 68 27.401 29.321 19.177 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.592 27.813 18.800 1.00 0.00 H new ATOM 1054 N CYS A 69 22.952 30.742 21.637 1.00 0.00 N ATOM 1055 CA CYS A 69 22.602 31.989 22.370 1.00 0.00 C ATOM 1056 C CYS A 69 23.371 31.997 23.702 1.00 0.00 C ATOM 1057 O CYS A 69 23.135 31.169 24.578 1.00 0.00 O ATOM 1058 CB CYS A 69 21.081 31.886 22.549 1.00 0.00 C ATOM 1059 SG CYS A 69 20.446 33.078 23.768 1.00 0.00 S ATOM 0 H CYS A 69 22.162 30.130 21.434 1.00 0.00 H new ATOM 0 HA CYS A 69 22.866 32.918 21.864 1.00 0.00 H new ATOM 0 HB2 CYS A 69 20.592 32.056 21.590 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.822 30.875 22.864 1.00 0.00 H new ATOM 0 HG CYS A 69 19.157 32.945 23.875 1.00 0.00 H new ATOM 1064 N LYS A 70 24.313 32.894 23.855 1.00 0.00 N ATOM 1065 CA LYS A 70 25.139 32.937 25.108 1.00 0.00 C ATOM 1066 C LYS A 70 24.271 32.989 26.369 1.00 0.00 C ATOM 1067 O LYS A 70 24.777 32.908 27.486 1.00 0.00 O ATOM 1068 CB LYS A 70 25.993 34.199 24.986 1.00 0.00 C ATOM 1069 CG LYS A 70 27.312 33.997 25.737 1.00 0.00 C ATOM 1070 CD LYS A 70 27.677 35.279 26.485 1.00 0.00 C ATOM 1071 CE LYS A 70 28.499 36.188 25.568 1.00 0.00 C ATOM 1072 NZ LYS A 70 28.983 37.286 26.450 1.00 0.00 N ATOM 0 H LYS A 70 24.549 33.605 23.162 1.00 0.00 H new ATOM 0 HA LYS A 70 25.744 32.036 25.207 1.00 0.00 H new ATOM 0 HB2 LYS A 70 26.190 34.418 23.936 1.00 0.00 H new ATOM 0 HB3 LYS A 70 25.457 35.055 25.395 1.00 0.00 H new ATOM 0 HG2 LYS A 70 27.219 33.168 26.439 1.00 0.00 H new ATOM 0 HG3 LYS A 70 28.105 33.734 25.036 1.00 0.00 H new ATOM 0 HD2 LYS A 70 26.773 35.794 26.809 1.00 0.00 H new ATOM 0 HD3 LYS A 70 28.247 35.039 27.383 1.00 0.00 H new ATOM 0 HE2 LYS A 70 29.331 35.647 25.118 1.00 0.00 H new ATOM 0 HE3 LYS A 70 27.892 36.577 24.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 29.556 37.952 25.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.169 37.788 26.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 29.563 36.886 27.215 1.00 0.00 H new ATOM 1086 N ARG A 71 22.985 33.104 26.223 1.00 0.00 N ATOM 1087 CA ARG A 71 22.101 33.136 27.417 1.00 0.00 C ATOM 1088 C ARG A 71 21.528 31.737 27.603 1.00 0.00 C ATOM 1089 O ARG A 71 21.373 31.234 28.711 1.00 0.00 O ATOM 1090 CB ARG A 71 20.993 34.112 27.046 1.00 0.00 C ATOM 1091 CG ARG A 71 20.473 34.837 28.302 1.00 0.00 C ATOM 1092 CD ARG A 71 21.644 35.509 29.037 1.00 0.00 C ATOM 1093 NE ARG A 71 21.169 36.882 29.415 1.00 0.00 N ATOM 1094 CZ ARG A 71 20.782 37.147 30.642 1.00 0.00 C ATOM 1095 NH1 ARG A 71 20.796 36.222 31.570 1.00 0.00 N ATOM 1096 NH2 ARG A 71 20.377 38.350 30.944 1.00 0.00 N ATOM 0 H ARG A 71 22.505 33.178 25.326 1.00 0.00 H new ATOM 0 HA ARG A 71 22.607 33.433 28.336 1.00 0.00 H new ATOM 0 HB2 ARG A 71 21.367 34.840 26.327 1.00 0.00 H new ATOM 0 HB3 ARG A 71 20.176 33.577 26.562 1.00 0.00 H new ATOM 0 HG2 ARG A 71 19.731 35.584 28.021 1.00 0.00 H new ATOM 0 HG3 ARG A 71 19.976 34.127 28.963 1.00 0.00 H new ATOM 0 HD2 ARG A 71 21.928 34.938 29.921 1.00 0.00 H new ATOM 0 HD3 ARG A 71 22.525 35.564 28.397 1.00 0.00 H new ATOM 0 HE ARG A 71 21.146 37.619 28.710 1.00 0.00 H new ATOM 0 HH11 ARG A 71 21.111 35.278 31.345 1.00 0.00 H new ATOM 0 HH12 ARG A 71 20.492 36.446 32.518 1.00 0.00 H new ATOM 0 HH21 ARG A 71 20.362 39.078 30.229 1.00 0.00 H new ATOM 0 HH22 ARG A 71 20.075 38.563 31.895 1.00 0.00 H new ATOM 1110 N CYS A 72 21.224 31.112 26.502 1.00 0.00 N ATOM 1111 CA CYS A 72 20.662 29.726 26.524 1.00 0.00 C ATOM 1112 C CYS A 72 21.774 28.693 26.343 1.00 0.00 C ATOM 1113 O CYS A 72 21.521 27.493 26.294 1.00 0.00 O ATOM 1114 CB CYS A 72 19.725 29.652 25.319 1.00 0.00 C ATOM 1115 SG CYS A 72 18.201 30.546 25.662 1.00 0.00 S ATOM 0 H CYS A 72 21.342 31.507 25.569 1.00 0.00 H new ATOM 0 HA CYS A 72 20.160 29.519 27.469 1.00 0.00 H new ATOM 0 HB2 CYS A 72 20.214 30.076 24.442 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.500 28.611 25.087 1.00 0.00 H new ATOM 0 HG CYS A 72 18.059 31.508 24.800 1.00 0.00 H new ATOM 1120 N GLN A 73 22.994 29.123 26.205 1.00 0.00 N ATOM 1121 CA GLN A 73 24.092 28.139 25.991 1.00 0.00 C ATOM 1122 C GLN A 73 24.846 27.820 27.305 1.00 0.00 C ATOM 1123 O GLN A 73 24.965 26.653 27.669 1.00 0.00 O ATOM 1124 CB GLN A 73 24.990 28.794 24.933 1.00 0.00 C ATOM 1125 CG GLN A 73 26.325 28.050 24.838 1.00 0.00 C ATOM 1126 CD GLN A 73 27.334 28.683 25.798 1.00 0.00 C ATOM 1127 OE1 GLN A 73 27.589 29.883 25.736 1.00 0.00 O ATOM 1128 NE2 GLN A 73 27.926 27.934 26.686 1.00 0.00 N ATOM 0 H GLN A 73 23.279 30.102 26.230 1.00 0.00 H new ATOM 0 HA GLN A 73 23.723 27.169 25.658 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.490 28.784 23.964 1.00 0.00 H new ATOM 0 HB3 GLN A 73 25.165 29.839 25.190 1.00 0.00 H new ATOM 0 HG2 GLN A 73 26.185 26.997 25.084 1.00 0.00 H new ATOM 0 HG3 GLN A 73 26.704 28.091 23.817 1.00 0.00 H new ATOM 0 HE21 GLN A 73 27.713 26.938 26.736 1.00 0.00 H new ATOM 0 HE22 GLN A 73 28.602 28.344 27.330 1.00 0.00 H new ATOM 1137 N PRO A 74 25.344 28.833 27.979 1.00 0.00 N ATOM 1138 CA PRO A 74 26.092 28.599 29.244 1.00 0.00 C ATOM 1139 C PRO A 74 25.147 28.435 30.451 1.00 0.00 C ATOM 1140 O PRO A 74 25.559 27.994 31.521 1.00 0.00 O ATOM 1141 CB PRO A 74 26.921 29.867 29.399 1.00 0.00 C ATOM 1142 CG PRO A 74 26.174 30.931 28.653 1.00 0.00 C ATOM 1143 CD PRO A 74 25.277 30.257 27.641 1.00 0.00 C ATOM 0 HA PRO A 74 26.684 27.684 29.208 1.00 0.00 H new ATOM 0 HB2 PRO A 74 27.037 30.133 30.450 1.00 0.00 H new ATOM 0 HB3 PRO A 74 27.923 29.732 28.991 1.00 0.00 H new ATOM 0 HG2 PRO A 74 25.583 31.535 29.342 1.00 0.00 H new ATOM 0 HG3 PRO A 74 26.870 31.606 28.154 1.00 0.00 H new ATOM 0 HD2 PRO A 74 24.256 30.632 27.705 1.00 0.00 H new ATOM 0 HD3 PRO A 74 25.621 30.439 26.623 1.00 0.00 H new ATOM 1151 N ASP A 75 23.900 28.797 30.305 1.00 0.00 N ATOM 1152 CA ASP A 75 22.932 28.684 31.445 1.00 0.00 C ATOM 1153 C ASP A 75 22.520 27.223 31.683 1.00 0.00 C ATOM 1154 O ASP A 75 22.944 26.315 30.972 1.00 0.00 O ATOM 1155 CB ASP A 75 21.720 29.500 31.003 1.00 0.00 C ATOM 1156 CG ASP A 75 21.104 28.828 29.778 1.00 0.00 C ATOM 1157 OD1 ASP A 75 21.862 28.419 28.912 1.00 0.00 O ATOM 1158 OD2 ASP A 75 19.892 28.699 29.738 1.00 0.00 O ATOM 0 H ASP A 75 23.504 29.169 29.441 1.00 0.00 H new ATOM 0 HA ASP A 75 23.367 29.040 32.379 1.00 0.00 H new ATOM 0 HB2 ASP A 75 20.989 29.560 31.810 1.00 0.00 H new ATOM 0 HB3 ASP A 75 22.017 30.521 30.765 1.00 0.00 H new ATOM 1163 N LYS A 76 21.696 26.986 32.677 1.00 0.00 N ATOM 1164 CA LYS A 76 21.246 25.594 32.977 1.00 0.00 C ATOM 1165 C LYS A 76 19.773 25.379 32.573 1.00 0.00 C ATOM 1166 O LYS A 76 18.861 25.971 33.144 1.00 0.00 O ATOM 1167 CB LYS A 76 21.397 25.468 34.491 1.00 0.00 C ATOM 1168 CG LYS A 76 22.878 25.343 34.854 1.00 0.00 C ATOM 1169 CD LYS A 76 23.386 23.953 34.459 1.00 0.00 C ATOM 1170 CE LYS A 76 24.791 24.072 33.865 1.00 0.00 C ATOM 1171 NZ LYS A 76 25.706 23.608 34.944 1.00 0.00 N ATOM 0 H LYS A 76 21.316 27.703 33.295 1.00 0.00 H new ATOM 0 HA LYS A 76 21.825 24.853 32.425 1.00 0.00 H new ATOM 0 HB2 LYS A 76 20.965 26.339 34.983 1.00 0.00 H new ATOM 0 HB3 LYS A 76 20.850 24.596 34.849 1.00 0.00 H new ATOM 0 HG2 LYS A 76 23.455 26.112 34.341 1.00 0.00 H new ATOM 0 HG3 LYS A 76 23.016 25.502 35.924 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.403 23.299 35.331 1.00 0.00 H new ATOM 0 HD3 LYS A 76 22.710 23.500 33.734 1.00 0.00 H new ATOM 0 HE2 LYS A 76 24.894 23.459 32.969 1.00 0.00 H new ATOM 0 HE3 LYS A 76 25.011 25.099 33.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 26.690 23.661 34.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 25.591 24.214 35.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 25.477 22.625 35.194 1.00 0.00 H new ATOM 1185 N ALA A 77 19.530 24.526 31.608 1.00 0.00 N ATOM 1186 CA ALA A 77 18.126 24.234 31.162 1.00 0.00 C ATOM 1187 C ALA A 77 17.532 23.152 32.087 1.00 0.00 C ATOM 1188 O ALA A 77 17.418 23.368 33.285 1.00 0.00 O ATOM 1189 CB ALA A 77 18.308 23.741 29.726 1.00 0.00 C ATOM 0 H ALA A 77 20.252 24.012 31.103 1.00 0.00 H new ATOM 0 HA ALA A 77 17.442 25.082 31.205 1.00 0.00 H new ATOM 0 HB1 ALA A 77 17.335 23.497 29.299 1.00 0.00 H new ATOM 0 HB2 ALA A 77 18.780 24.522 29.130 1.00 0.00 H new ATOM 0 HB3 ALA A 77 18.939 22.852 29.724 1.00 0.00 H new ATOM 1195 N ASN A 78 17.208 21.968 31.600 1.00 0.00 N ATOM 1196 CA ASN A 78 16.715 20.918 32.543 1.00 0.00 C ATOM 1197 C ASN A 78 17.795 20.656 33.587 1.00 0.00 C ATOM 1198 O ASN A 78 17.481 20.364 34.738 1.00 0.00 O ATOM 1199 CB ASN A 78 16.406 19.640 31.748 1.00 0.00 C ATOM 1200 CG ASN A 78 15.028 19.744 31.075 1.00 0.00 C ATOM 1201 OD1 ASN A 78 14.814 19.173 30.007 1.00 0.00 O ATOM 1202 ND2 ASN A 78 14.073 20.442 31.640 1.00 0.00 N ATOM 0 H ASN A 78 17.263 21.695 30.619 1.00 0.00 H new ATOM 0 HA ASN A 78 15.805 21.245 33.047 1.00 0.00 H new ATOM 0 HB2 ASN A 78 17.175 19.480 30.992 1.00 0.00 H new ATOM 0 HB3 ASN A 78 16.428 18.777 32.413 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.158 20.509 31.194 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.245 20.918 32.526 1.00 0.00 H new ATOM 1209 N PRO A 79 19.043 20.834 33.198 1.00 0.00 N ATOM 1210 CA PRO A 79 20.152 20.679 34.186 1.00 0.00 C ATOM 1211 C PRO A 79 19.914 21.691 35.319 1.00 0.00 C ATOM 1212 O PRO A 79 20.468 21.572 36.410 1.00 0.00 O ATOM 1213 CB PRO A 79 21.381 20.995 33.315 1.00 0.00 C ATOM 1214 CG PRO A 79 20.840 21.849 32.236 1.00 0.00 C ATOM 1215 CD PRO A 79 19.561 21.184 31.873 1.00 0.00 C ATOM 0 HA PRO A 79 20.251 19.711 34.677 1.00 0.00 H new ATOM 0 HB2 PRO A 79 22.153 21.512 33.885 1.00 0.00 H new ATOM 0 HB3 PRO A 79 21.833 20.087 32.917 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.678 22.871 32.577 1.00 0.00 H new ATOM 0 HG3 PRO A 79 21.521 21.901 31.386 1.00 0.00 H new ATOM 0 HD2 PRO A 79 18.890 21.849 31.330 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.716 20.306 31.246 1.00 0.00 H new ATOM 1223 N ARG A 80 19.051 22.669 35.082 1.00 0.00 N ATOM 1224 CA ARG A 80 18.719 23.661 36.131 1.00 0.00 C ATOM 1225 C ARG A 80 18.322 22.908 37.404 1.00 0.00 C ATOM 1226 O ARG A 80 18.984 22.987 38.440 1.00 0.00 O ATOM 1227 CB ARG A 80 17.517 24.448 35.617 1.00 0.00 C ATOM 1228 CG ARG A 80 17.186 25.580 36.593 1.00 0.00 C ATOM 1229 CD ARG A 80 18.306 26.626 36.576 1.00 0.00 C ATOM 1230 NE ARG A 80 18.206 27.276 35.238 1.00 0.00 N ATOM 1231 CZ ARG A 80 17.224 28.099 34.964 1.00 0.00 C ATOM 1232 NH1 ARG A 80 16.307 28.368 35.859 1.00 0.00 N ATOM 1233 NH2 ARG A 80 17.159 28.656 33.786 1.00 0.00 N ATOM 0 H ARG A 80 18.568 22.808 34.194 1.00 0.00 H new ATOM 0 HA ARG A 80 19.559 24.320 36.349 1.00 0.00 H new ATOM 0 HB2 ARG A 80 17.733 24.857 34.630 1.00 0.00 H new ATOM 0 HB3 ARG A 80 16.657 23.787 35.507 1.00 0.00 H new ATOM 0 HG2 ARG A 80 16.239 26.044 36.318 1.00 0.00 H new ATOM 0 HG3 ARG A 80 17.065 25.180 37.600 1.00 0.00 H new ATOM 0 HD2 ARG A 80 18.180 27.353 37.378 1.00 0.00 H new ATOM 0 HD3 ARG A 80 19.282 26.162 36.717 1.00 0.00 H new ATOM 0 HE ARG A 80 18.910 27.078 34.527 1.00 0.00 H new ATOM 0 HH11 ARG A 80 16.352 27.935 36.782 1.00 0.00 H new ATOM 0 HH12 ARG A 80 15.547 29.010 35.634 1.00 0.00 H new ATOM 0 HH21 ARG A 80 17.870 28.450 33.084 1.00 0.00 H new ATOM 0 HH22 ARG A 80 16.397 29.298 33.567 1.00 0.00 H new ATOM 1247 N GLN A 81 17.249 22.164 37.332 1.00 0.00 N ATOM 1248 CA GLN A 81 16.767 21.369 38.510 1.00 0.00 C ATOM 1249 C GLN A 81 17.907 20.534 39.144 1.00 0.00 C ATOM 1250 O GLN A 81 17.953 20.337 40.359 1.00 0.00 O ATOM 1251 CB GLN A 81 15.688 20.446 37.942 1.00 0.00 C ATOM 1252 CG GLN A 81 14.351 21.190 37.895 1.00 0.00 C ATOM 1253 CD GLN A 81 13.556 20.731 36.671 1.00 0.00 C ATOM 1254 OE1 GLN A 81 12.670 19.885 36.781 1.00 0.00 O ATOM 1255 NE2 GLN A 81 13.824 21.246 35.503 1.00 0.00 N ATOM 0 H GLN A 81 16.674 22.070 36.494 1.00 0.00 H new ATOM 0 HA GLN A 81 16.394 22.019 39.302 1.00 0.00 H new ATOM 0 HB2 GLN A 81 15.967 20.115 36.942 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.597 19.552 38.559 1.00 0.00 H new ATOM 0 HG2 GLN A 81 13.783 20.997 38.805 1.00 0.00 H new ATOM 0 HG3 GLN A 81 14.522 22.265 37.849 1.00 0.00 H new ATOM 0 HE21 GLN A 81 14.559 21.948 35.411 1.00 0.00 H new ATOM 0 HE22 GLN A 81 13.299 20.947 34.681 1.00 0.00 H new ATOM 1264 N HIS A 82 18.824 20.037 38.338 1.00 0.00 N ATOM 1265 CA HIS A 82 19.951 19.213 38.886 1.00 0.00 C ATOM 1266 C HIS A 82 20.882 20.126 39.711 1.00 0.00 C ATOM 1267 O HIS A 82 21.328 19.775 40.810 1.00 0.00 O ATOM 1268 CB HIS A 82 20.670 18.652 37.649 1.00 0.00 C ATOM 1269 CG HIS A 82 22.102 18.322 37.981 1.00 0.00 C ATOM 1270 ND1 HIS A 82 22.497 17.057 38.384 1.00 0.00 N ATOM 1271 CD2 HIS A 82 23.244 19.087 37.976 1.00 0.00 C ATOM 1272 CE1 HIS A 82 23.824 17.096 38.603 1.00 0.00 C ATOM 1273 NE2 HIS A 82 24.330 18.310 38.369 1.00 0.00 N ATOM 0 H HIS A 82 18.838 20.168 37.327 1.00 0.00 H new ATOM 0 HA HIS A 82 19.620 18.410 39.544 1.00 0.00 H new ATOM 0 HB2 HIS A 82 20.156 17.758 37.296 1.00 0.00 H new ATOM 0 HB3 HIS A 82 20.636 19.380 36.839 1.00 0.00 H new ATOM 0 HD2 HIS A 82 23.291 20.132 37.708 1.00 0.00 H new ATOM 0 HE1 HIS A 82 24.409 16.249 38.928 1.00 0.00 H new ATOM 0 HE2 HIS A 82 25.303 18.604 38.459 1.00 0.00 H new ATOM 1281 N ARG A 83 21.144 21.306 39.225 1.00 0.00 N ATOM 1282 CA ARG A 83 21.997 22.259 39.988 1.00 0.00 C ATOM 1283 C ARG A 83 21.241 22.694 41.246 1.00 0.00 C ATOM 1284 O ARG A 83 21.837 23.069 42.267 1.00 0.00 O ATOM 1285 CB ARG A 83 22.217 23.446 39.045 1.00 0.00 C ATOM 1286 CG ARG A 83 23.034 24.527 39.761 1.00 0.00 C ATOM 1287 CD ARG A 83 23.764 25.391 38.726 1.00 0.00 C ATOM 1288 NE ARG A 83 23.168 26.754 38.861 1.00 0.00 N ATOM 1289 CZ ARG A 83 23.656 27.767 38.185 1.00 0.00 C ATOM 1290 NH1 ARG A 83 24.675 27.606 37.378 1.00 0.00 N ATOM 1291 NH2 ARG A 83 23.119 28.950 38.318 1.00 0.00 N ATOM 0 H ARG A 83 20.803 21.653 38.329 1.00 0.00 H new ATOM 0 HA ARG A 83 22.947 21.828 40.303 1.00 0.00 H new ATOM 0 HB2 ARG A 83 22.739 23.117 38.146 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.257 23.853 38.726 1.00 0.00 H new ATOM 0 HG2 ARG A 83 22.378 25.149 40.371 1.00 0.00 H new ATOM 0 HG3 ARG A 83 23.754 24.065 40.437 1.00 0.00 H new ATOM 0 HD2 ARG A 83 24.837 25.410 38.916 1.00 0.00 H new ATOM 0 HD3 ARG A 83 23.626 24.999 37.718 1.00 0.00 H new ATOM 0 HE ARG A 83 22.374 26.899 39.485 1.00 0.00 H new ATOM 0 HH11 ARG A 83 25.099 26.685 37.269 1.00 0.00 H new ATOM 0 HH12 ARG A 83 25.045 28.402 36.858 1.00 0.00 H new ATOM 0 HH21 ARG A 83 22.325 29.082 38.945 1.00 0.00 H new ATOM 0 HH22 ARG A 83 23.494 29.742 37.795 1.00 0.00 H new ATOM 1305 N LEU A 84 19.932 22.618 41.218 1.00 0.00 N ATOM 1306 CA LEU A 84 19.179 23.002 42.418 1.00 0.00 C ATOM 1307 C LEU A 84 19.281 21.846 43.413 1.00 0.00 C ATOM 1308 O LEU A 84 19.337 22.053 44.628 1.00 0.00 O ATOM 1309 CB LEU A 84 17.733 23.243 42.006 1.00 0.00 C ATOM 1310 CG LEU A 84 17.273 24.685 42.349 1.00 0.00 C ATOM 1311 CD1 LEU A 84 18.218 25.418 43.350 1.00 0.00 C ATOM 1312 CD2 LEU A 84 17.193 25.485 41.051 1.00 0.00 C ATOM 0 H LEU A 84 19.373 22.310 40.422 1.00 0.00 H new ATOM 0 HA LEU A 84 19.569 23.909 42.879 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.626 23.072 40.935 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.086 22.525 42.510 1.00 0.00 H new ATOM 0 HG LEU A 84 16.302 24.611 42.839 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.835 26.420 43.544 1.00 0.00 H new ATOM 0 HD12 LEU A 84 18.262 24.859 44.285 1.00 0.00 H new ATOM 0 HD13 LEU A 84 19.218 25.488 42.922 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.871 26.503 41.270 1.00 0.00 H new ATOM 0 HD22 LEU A 84 18.174 25.509 40.577 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.476 25.015 40.377 1.00 0.00 H new ATOM 1324 N ASP A 85 19.390 20.633 42.925 1.00 0.00 N ATOM 1325 CA ASP A 85 19.580 19.484 43.857 1.00 0.00 C ATOM 1326 C ASP A 85 20.892 19.723 44.612 1.00 0.00 C ATOM 1327 O ASP A 85 21.014 19.475 45.821 1.00 0.00 O ATOM 1328 CB ASP A 85 19.696 18.253 42.964 1.00 0.00 C ATOM 1329 CG ASP A 85 18.312 17.646 42.737 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.893 16.848 43.561 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.693 17.986 41.742 1.00 0.00 O ATOM 0 H ASP A 85 19.356 20.394 41.934 1.00 0.00 H new ATOM 0 HA ASP A 85 18.771 19.364 44.578 1.00 0.00 H new ATOM 0 HB2 ASP A 85 20.144 18.526 42.009 1.00 0.00 H new ATOM 0 HB3 ASP A 85 20.354 17.518 43.426 1.00 0.00 H new ATOM 1336 N LYS A 86 21.864 20.254 43.921 1.00 0.00 N ATOM 1337 CA LYS A 86 23.175 20.574 44.571 1.00 0.00 C ATOM 1338 C LYS A 86 22.961 21.542 45.758 1.00 0.00 C ATOM 1339 O LYS A 86 23.451 21.318 46.872 1.00 0.00 O ATOM 1340 CB LYS A 86 24.005 21.247 43.477 1.00 0.00 C ATOM 1341 CG LYS A 86 25.445 21.434 43.963 1.00 0.00 C ATOM 1342 CD LYS A 86 26.374 20.495 43.190 1.00 0.00 C ATOM 1343 CE LYS A 86 26.364 19.113 43.845 1.00 0.00 C ATOM 1344 NZ LYS A 86 27.786 18.670 43.825 1.00 0.00 N ATOM 0 H LYS A 86 21.809 20.482 42.928 1.00 0.00 H new ATOM 0 HA LYS A 86 23.666 19.686 44.969 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.992 20.640 42.572 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.570 22.212 43.219 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.756 22.469 43.820 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.509 21.227 45.031 1.00 0.00 H new ATOM 0 HD2 LYS A 86 26.050 20.419 42.152 1.00 0.00 H new ATOM 0 HD3 LYS A 86 27.387 20.897 43.179 1.00 0.00 H new ATOM 0 HE2 LYS A 86 25.979 19.161 44.864 1.00 0.00 H new ATOM 0 HE3 LYS A 86 25.726 18.420 43.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 27.862 17.728 44.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 28.123 18.627 42.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 28.368 19.345 44.361 1.00 0.00 H new ATOM 1358 N ILE A 87 22.234 22.613 45.548 1.00 0.00 N ATOM 1359 CA ILE A 87 21.998 23.584 46.677 1.00 0.00 C ATOM 1360 C ILE A 87 21.285 22.872 47.859 1.00 0.00 C ATOM 1361 O ILE A 87 21.623 23.080 49.023 1.00 0.00 O ATOM 1362 CB ILE A 87 21.156 24.756 46.136 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.436 25.031 44.641 1.00 0.00 C ATOM 1364 CG2 ILE A 87 21.535 26.005 46.935 1.00 0.00 C ATOM 1365 CD1 ILE A 87 22.547 26.076 44.495 1.00 0.00 C ATOM 0 H ILE A 87 21.797 22.860 44.660 1.00 0.00 H new ATOM 0 HA ILE A 87 22.946 23.966 47.055 1.00 0.00 H new ATOM 0 HB ILE A 87 20.101 24.503 46.238 1.00 0.00 H new ATOM 0 HG12 ILE A 87 21.728 24.107 44.142 1.00 0.00 H new ATOM 0 HG13 ILE A 87 20.528 25.384 44.152 1.00 0.00 H new ATOM 0 HG21 ILE A 87 20.956 26.856 46.577 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.322 25.840 47.991 1.00 0.00 H new ATOM 0 HG23 ILE A 87 22.598 26.210 46.807 1.00 0.00 H new ATOM 0 HD11 ILE A 87 22.735 26.261 43.438 1.00 0.00 H new ATOM 0 HD12 ILE A 87 22.239 27.004 44.977 1.00 0.00 H new ATOM 0 HD13 ILE A 87 23.458 25.707 44.967 1.00 0.00 H new ATOM 1377 N THR A 88 20.343 21.997 47.592 1.00 0.00 N ATOM 1378 CA THR A 88 19.679 21.238 48.704 1.00 0.00 C ATOM 1379 C THR A 88 20.790 20.600 49.552 1.00 0.00 C ATOM 1380 O THR A 88 20.780 20.644 50.782 1.00 0.00 O ATOM 1381 CB THR A 88 18.830 20.165 48.018 1.00 0.00 C ATOM 1382 OG1 THR A 88 18.008 20.774 47.031 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.951 19.465 49.055 1.00 0.00 C ATOM 0 H THR A 88 20.005 21.775 46.655 1.00 0.00 H new ATOM 0 HA THR A 88 19.059 21.858 49.351 1.00 0.00 H new ATOM 0 HB THR A 88 19.484 19.431 47.546 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.465 20.088 46.589 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.347 18.701 48.564 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.582 18.998 49.811 1.00 0.00 H new ATOM 0 HG23 THR A 88 17.296 20.196 49.530 1.00 0.00 H new ATOM 1391 N HIS A 89 21.798 20.065 48.906 1.00 0.00 N ATOM 1392 CA HIS A 89 22.947 19.508 49.676 1.00 0.00 C ATOM 1393 C HIS A 89 23.475 20.635 50.573 1.00 0.00 C ATOM 1394 O HIS A 89 23.766 20.439 51.751 1.00 0.00 O ATOM 1395 CB HIS A 89 23.987 19.106 48.627 1.00 0.00 C ATOM 1396 CG HIS A 89 24.900 18.057 49.201 1.00 0.00 C ATOM 1397 ND1 HIS A 89 26.263 18.042 48.946 1.00 0.00 N ATOM 1398 CD2 HIS A 89 24.661 16.977 50.016 1.00 0.00 C ATOM 1399 CE1 HIS A 89 26.786 16.987 49.597 1.00 0.00 C ATOM 1400 NE2 HIS A 89 25.853 16.304 50.264 1.00 0.00 N ATOM 0 H HIS A 89 21.872 19.992 47.891 1.00 0.00 H new ATOM 0 HA HIS A 89 22.691 18.652 50.300 1.00 0.00 H new ATOM 0 HB2 HIS A 89 23.490 18.723 47.736 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.565 19.978 48.320 1.00 0.00 H new ATOM 0 HD2 HIS A 89 23.694 16.694 50.405 1.00 0.00 H new ATOM 0 HE1 HIS A 89 27.834 16.725 49.582 1.00 0.00 H new ATOM 0 HE2 HIS A 89 25.986 15.468 50.833 1.00 0.00 H new ATOM 1408 N ALA A 90 23.545 21.839 50.033 1.00 0.00 N ATOM 1409 CA ALA A 90 23.987 23.014 50.855 1.00 0.00 C ATOM 1410 C ALA A 90 23.092 23.098 52.093 1.00 0.00 C ATOM 1411 O ALA A 90 23.529 23.484 53.172 1.00 0.00 O ATOM 1412 CB ALA A 90 23.799 24.269 49.975 1.00 0.00 C ATOM 0 H ALA A 90 23.315 22.053 49.063 1.00 0.00 H new ATOM 0 HA ALA A 90 25.025 22.926 51.175 1.00 0.00 H new ATOM 0 HB1 ALA A 90 24.108 25.153 50.532 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.406 24.176 49.075 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.749 24.364 49.697 1.00 0.00 H new ATOM 1418 N CYS A 91 21.849 22.695 51.967 1.00 0.00 N ATOM 1419 CA CYS A 91 20.933 22.709 53.151 1.00 0.00 C ATOM 1420 C CYS A 91 21.504 21.765 54.206 1.00 0.00 C ATOM 1421 O CYS A 91 21.716 22.137 55.364 1.00 0.00 O ATOM 1422 CB CYS A 91 19.580 22.165 52.635 1.00 0.00 C ATOM 1423 SG CYS A 91 18.677 21.275 53.953 1.00 0.00 S ATOM 0 H CYS A 91 21.432 22.359 51.099 1.00 0.00 H new ATOM 0 HA CYS A 91 20.820 23.700 53.590 1.00 0.00 H new ATOM 0 HB2 CYS A 91 18.970 22.990 52.267 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.752 21.495 51.793 1.00 0.00 H new ATOM 0 HG CYS A 91 17.454 21.711 54.012 1.00 0.00 H new ATOM 1429 N ARG A 92 21.767 20.551 53.815 1.00 0.00 N ATOM 1430 CA ARG A 92 22.337 19.565 54.778 1.00 0.00 C ATOM 1431 C ARG A 92 23.565 20.161 55.478 1.00 0.00 C ATOM 1432 O ARG A 92 23.648 20.197 56.700 1.00 0.00 O ATOM 1433 CB ARG A 92 22.739 18.365 53.915 1.00 0.00 C ATOM 1434 CG ARG A 92 23.365 17.277 54.793 1.00 0.00 C ATOM 1435 CD ARG A 92 22.269 16.567 55.589 1.00 0.00 C ATOM 1436 NE ARG A 92 21.546 15.725 54.591 1.00 0.00 N ATOM 1437 CZ ARG A 92 20.580 14.923 54.970 1.00 0.00 C ATOM 1438 NH1 ARG A 92 20.229 14.844 56.229 1.00 0.00 N ATOM 1439 NH2 ARG A 92 19.960 14.194 54.082 1.00 0.00 N ATOM 0 H ARG A 92 21.613 20.197 52.871 1.00 0.00 H new ATOM 0 HA ARG A 92 21.630 19.288 55.560 1.00 0.00 H new ATOM 0 HB2 ARG A 92 21.865 17.969 53.398 1.00 0.00 H new ATOM 0 HB3 ARG A 92 23.448 18.678 53.149 1.00 0.00 H new ATOM 0 HG2 ARG A 92 23.901 16.559 54.173 1.00 0.00 H new ATOM 0 HG3 ARG A 92 24.094 17.718 55.472 1.00 0.00 H new ATOM 0 HD2 ARG A 92 22.693 15.956 56.386 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.597 17.284 56.060 1.00 0.00 H new ATOM 0 HE ARG A 92 21.805 15.774 53.606 1.00 0.00 H new ATOM 0 HH11 ARG A 92 20.709 15.410 56.929 1.00 0.00 H new ATOM 0 HH12 ARG A 92 19.476 14.216 56.510 1.00 0.00 H new ATOM 0 HH21 ARG A 92 20.228 14.250 53.099 1.00 0.00 H new ATOM 0 HH22 ARG A 92 19.208 13.568 54.371 1.00 0.00 H new ATOM 1453 N LEU A 93 24.520 20.618 54.716 1.00 0.00 N ATOM 1454 CA LEU A 93 25.762 21.201 55.314 1.00 0.00 C ATOM 1455 C LEU A 93 25.466 22.361 56.285 1.00 0.00 C ATOM 1456 O LEU A 93 26.108 22.475 57.336 1.00 0.00 O ATOM 1457 CB LEU A 93 26.562 21.712 54.116 1.00 0.00 C ATOM 1458 CG LEU A 93 28.058 21.592 54.408 1.00 0.00 C ATOM 1459 CD1 LEU A 93 28.473 20.121 54.361 1.00 0.00 C ATOM 1460 CD2 LEU A 93 28.845 22.375 53.354 1.00 0.00 C ATOM 0 H LEU A 93 24.496 20.614 53.696 1.00 0.00 H new ATOM 0 HA LEU A 93 26.295 20.456 55.905 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.308 21.138 53.225 1.00 0.00 H new ATOM 0 HB3 LEU A 93 26.304 22.751 53.910 1.00 0.00 H new ATOM 0 HG LEU A 93 28.268 21.997 55.398 1.00 0.00 H new ATOM 0 HD11 LEU A 93 29.540 20.037 54.569 1.00 0.00 H new ATOM 0 HD12 LEU A 93 27.912 19.561 55.109 1.00 0.00 H new ATOM 0 HD13 LEU A 93 28.264 19.715 53.371 1.00 0.00 H new ATOM 0 HD21 LEU A 93 29.912 22.291 53.560 1.00 0.00 H new ATOM 0 HD22 LEU A 93 28.633 21.968 52.365 1.00 0.00 H new ATOM 0 HD23 LEU A 93 28.551 23.424 53.385 1.00 0.00 H new ATOM 1472 N LEU A 94 24.533 23.228 55.951 1.00 0.00 N ATOM 1473 CA LEU A 94 24.229 24.412 56.829 1.00 0.00 C ATOM 1474 C LEU A 94 23.557 23.977 58.138 1.00 0.00 C ATOM 1475 O LEU A 94 23.431 24.759 59.079 1.00 0.00 O ATOM 1476 CB LEU A 94 23.242 25.258 55.989 1.00 0.00 C ATOM 1477 CG LEU A 94 23.982 26.366 55.221 1.00 0.00 C ATOM 1478 CD1 LEU A 94 24.494 25.819 53.886 1.00 0.00 C ATOM 1479 CD2 LEU A 94 23.012 27.517 54.931 1.00 0.00 C ATOM 0 H LEU A 94 23.967 23.167 55.105 1.00 0.00 H new ATOM 0 HA LEU A 94 25.132 24.953 57.111 1.00 0.00 H new ATOM 0 HB2 LEU A 94 22.713 24.615 55.286 1.00 0.00 H new ATOM 0 HB3 LEU A 94 22.491 25.702 56.642 1.00 0.00 H new ATOM 0 HG LEU A 94 24.819 26.717 55.824 1.00 0.00 H new ATOM 0 HD11 LEU A 94 25.017 26.608 53.346 1.00 0.00 H new ATOM 0 HD12 LEU A 94 25.178 24.990 54.071 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.652 25.468 53.289 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.534 28.304 54.387 1.00 0.00 H new ATOM 0 HD22 LEU A 94 22.181 27.149 54.329 1.00 0.00 H new ATOM 0 HD23 LEU A 94 22.631 27.917 55.871 1.00 0.00 H new ATOM 1491 N GLU A 95 23.152 22.743 58.226 1.00 0.00 N ATOM 1492 CA GLU A 95 22.524 22.262 59.487 1.00 0.00 C ATOM 1493 C GLU A 95 23.191 20.958 59.929 1.00 0.00 C ATOM 1494 O GLU A 95 22.891 20.417 60.992 1.00 0.00 O ATOM 1495 CB GLU A 95 21.047 22.038 59.153 1.00 0.00 C ATOM 1496 CG GLU A 95 20.271 21.731 60.439 1.00 0.00 C ATOM 1497 CD GLU A 95 20.468 22.861 61.455 1.00 0.00 C ATOM 1498 OE1 GLU A 95 20.644 23.990 61.029 1.00 0.00 O ATOM 1499 OE2 GLU A 95 20.443 22.575 62.641 1.00 0.00 O ATOM 0 H GLU A 95 23.228 22.048 57.483 1.00 0.00 H new ATOM 0 HA GLU A 95 22.637 22.974 60.305 1.00 0.00 H new ATOM 0 HB2 GLU A 95 20.634 22.924 58.670 1.00 0.00 H new ATOM 0 HB3 GLU A 95 20.944 21.213 58.448 1.00 0.00 H new ATOM 0 HG2 GLU A 95 19.211 21.614 60.214 1.00 0.00 H new ATOM 0 HG3 GLU A 95 20.613 20.787 60.863 1.00 0.00 H new ATOM 1506 N GLN A 96 24.101 20.449 59.138 1.00 0.00 N ATOM 1507 CA GLN A 96 24.800 19.194 59.511 1.00 0.00 C ATOM 1508 C GLN A 96 26.057 19.521 60.311 1.00 0.00 C ATOM 1509 O GLN A 96 26.231 19.047 61.433 1.00 0.00 O ATOM 1510 CB GLN A 96 25.163 18.521 58.186 1.00 0.00 C ATOM 1511 CG GLN A 96 25.887 17.200 58.460 1.00 0.00 C ATOM 1512 CD GLN A 96 26.876 16.915 57.328 1.00 0.00 C ATOM 1513 OE1 GLN A 96 28.048 17.280 57.414 1.00 0.00 O ATOM 1514 NE2 GLN A 96 26.466 16.281 56.265 1.00 0.00 N ATOM 0 H GLN A 96 24.387 20.855 58.247 1.00 0.00 H new ATOM 0 HA GLN A 96 24.182 18.545 60.132 1.00 0.00 H new ATOM 0 HB2 GLN A 96 24.262 18.338 57.601 1.00 0.00 H new ATOM 0 HB3 GLN A 96 25.799 19.180 57.595 1.00 0.00 H new ATOM 0 HG2 GLN A 96 26.414 17.253 59.413 1.00 0.00 H new ATOM 0 HG3 GLN A 96 25.165 16.387 58.540 1.00 0.00 H new ATOM 0 HE21 GLN A 96 25.494 15.979 56.194 1.00 0.00 H new ATOM 0 HE22 GLN A 96 27.117 16.087 55.504 1.00 0.00 H new ATOM 1523 N GLU A 97 26.938 20.325 59.771 1.00 0.00 N ATOM 1524 CA GLU A 97 28.173 20.660 60.546 1.00 0.00 C ATOM 1525 C GLU A 97 27.917 21.877 61.451 1.00 0.00 C ATOM 1526 O GLU A 97 26.780 22.148 61.832 1.00 0.00 O ATOM 1527 CB GLU A 97 29.288 20.914 59.510 1.00 0.00 C ATOM 1528 CG GLU A 97 28.817 21.859 58.403 1.00 0.00 C ATOM 1529 CD GLU A 97 28.636 23.255 58.981 1.00 0.00 C ATOM 1530 OE1 GLU A 97 29.521 23.687 59.697 1.00 0.00 O ATOM 1531 OE2 GLU A 97 27.620 23.869 58.700 1.00 0.00 O ATOM 0 H GLU A 97 26.861 20.755 58.849 1.00 0.00 H new ATOM 0 HA GLU A 97 28.471 19.850 61.211 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.159 21.340 60.008 1.00 0.00 H new ATOM 0 HB3 GLU A 97 29.603 19.967 59.072 1.00 0.00 H new ATOM 0 HG2 GLU A 97 29.545 21.880 57.592 1.00 0.00 H new ATOM 0 HG3 GLU A 97 27.878 21.503 57.980 1.00 0.00 H new ATOM 1538 N THR A 98 28.942 22.606 61.817 1.00 0.00 N ATOM 1539 CA THR A 98 28.731 23.789 62.709 1.00 0.00 C ATOM 1540 C THR A 98 28.844 25.121 61.924 1.00 0.00 C ATOM 1541 O THR A 98 27.844 25.818 61.760 1.00 0.00 O ATOM 1542 CB THR A 98 29.806 23.655 63.799 1.00 0.00 C ATOM 1543 OG1 THR A 98 29.378 22.699 64.759 1.00 0.00 O ATOM 1544 CG2 THR A 98 30.031 25.001 64.494 1.00 0.00 C ATOM 0 H THR A 98 29.909 22.436 61.540 1.00 0.00 H new ATOM 0 HA THR A 98 27.730 23.809 63.140 1.00 0.00 H new ATOM 0 HB THR A 98 30.741 23.334 63.339 1.00 0.00 H new ATOM 0 HG1 THR A 98 30.060 22.608 65.456 1.00 0.00 H new ATOM 0 HG21 THR A 98 30.795 24.890 65.263 1.00 0.00 H new ATOM 0 HG22 THR A 98 30.358 25.739 63.761 1.00 0.00 H new ATOM 0 HG23 THR A 98 29.100 25.334 64.953 1.00 0.00 H new ATOM 1552 N PRO A 99 30.022 25.441 61.432 1.00 0.00 N ATOM 1553 CA PRO A 99 30.199 26.696 60.642 1.00 0.00 C ATOM 1554 C PRO A 99 29.396 26.614 59.335 1.00 0.00 C ATOM 1555 O PRO A 99 29.335 25.575 58.700 1.00 0.00 O ATOM 1556 CB PRO A 99 31.703 26.749 60.380 1.00 0.00 C ATOM 1557 CG PRO A 99 32.154 25.331 60.488 1.00 0.00 C ATOM 1558 CD PRO A 99 31.282 24.692 61.536 1.00 0.00 C ATOM 0 HA PRO A 99 29.842 27.589 61.155 1.00 0.00 H new ATOM 0 HB2 PRO A 99 31.919 27.160 59.394 1.00 0.00 H new ATOM 0 HB3 PRO A 99 32.210 27.383 61.108 1.00 0.00 H new ATOM 0 HG2 PRO A 99 32.054 24.817 59.532 1.00 0.00 H new ATOM 0 HG3 PRO A 99 33.205 25.277 60.771 1.00 0.00 H new ATOM 0 HD2 PRO A 99 31.135 23.629 61.343 1.00 0.00 H new ATOM 0 HD3 PRO A 99 31.720 24.778 62.530 1.00 0.00 H new ATOM 1566 N VAL A 100 28.773 27.678 58.912 1.00 0.00 N ATOM 1567 CA VAL A 100 27.966 27.598 57.650 1.00 0.00 C ATOM 1568 C VAL A 100 28.904 27.638 56.443 1.00 0.00 C ATOM 1569 O VAL A 100 29.946 28.287 56.475 1.00 0.00 O ATOM 1570 CB VAL A 100 27.059 28.832 57.663 1.00 0.00 C ATOM 1571 CG1 VAL A 100 25.897 28.619 56.699 1.00 0.00 C ATOM 1572 CG2 VAL A 100 26.499 29.066 59.072 1.00 0.00 C ATOM 0 H VAL A 100 28.783 28.588 59.372 1.00 0.00 H new ATOM 0 HA VAL A 100 27.385 26.678 57.587 1.00 0.00 H new ATOM 0 HB VAL A 100 27.644 29.700 57.359 1.00 0.00 H new ATOM 0 HG11 VAL A 100 25.251 29.497 56.708 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.284 28.463 55.692 1.00 0.00 H new ATOM 0 HG13 VAL A 100 25.324 27.744 57.007 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.856 29.946 59.066 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.920 28.196 59.383 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.322 29.222 59.769 1.00 0.00 H new ATOM 1582 N THR A 101 28.583 26.915 55.392 1.00 0.00 N ATOM 1583 CA THR A 101 29.509 26.891 54.222 1.00 0.00 C ATOM 1584 C THR A 101 28.889 27.463 52.941 1.00 0.00 C ATOM 1585 O THR A 101 28.188 26.793 52.186 1.00 0.00 O ATOM 1586 CB THR A 101 29.839 25.418 54.001 1.00 0.00 C ATOM 1587 OG1 THR A 101 29.073 24.610 54.884 1.00 0.00 O ATOM 1588 CG2 THR A 101 31.326 25.182 54.259 1.00 0.00 C ATOM 0 H THR A 101 27.737 26.353 55.298 1.00 0.00 H new ATOM 0 HA THR A 101 30.380 27.512 54.433 1.00 0.00 H new ATOM 0 HB THR A 101 29.599 25.151 52.972 1.00 0.00 H new ATOM 0 HG1 THR A 101 29.664 23.978 55.345 1.00 0.00 H new ATOM 0 HG21 THR A 101 31.560 24.129 54.101 1.00 0.00 H new ATOM 0 HG22 THR A 101 31.915 25.792 53.574 1.00 0.00 H new ATOM 0 HG23 THR A 101 31.565 25.456 55.286 1.00 0.00 H new ATOM 1596 N LEU A 102 29.215 28.682 52.685 1.00 0.00 N ATOM 1597 CA LEU A 102 28.789 29.389 51.485 1.00 0.00 C ATOM 1598 C LEU A 102 30.055 30.016 50.926 1.00 0.00 C ATOM 1599 O LEU A 102 30.051 30.630 49.866 1.00 0.00 O ATOM 1600 CB LEU A 102 27.808 30.465 51.957 1.00 0.00 C ATOM 1601 CG LEU A 102 26.484 29.818 52.373 1.00 0.00 C ATOM 1602 CD1 LEU A 102 26.630 29.193 53.762 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.387 30.885 52.411 1.00 0.00 C ATOM 0 H LEU A 102 29.797 29.244 53.305 1.00 0.00 H new ATOM 0 HA LEU A 102 28.310 28.766 50.730 1.00 0.00 H new ATOM 0 HB2 LEU A 102 28.234 31.014 52.797 1.00 0.00 H new ATOM 0 HB3 LEU A 102 27.635 31.187 51.159 1.00 0.00 H new ATOM 0 HG LEU A 102 26.219 29.044 51.653 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.686 28.733 54.055 1.00 0.00 H new ATOM 0 HD12 LEU A 102 27.412 28.434 53.739 1.00 0.00 H new ATOM 0 HD13 LEU A 102 26.896 29.966 54.483 1.00 0.00 H new ATOM 0 HD21 LEU A 102 24.443 30.426 52.707 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.656 31.658 53.131 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.279 31.331 51.422 1.00 0.00 H new ATOM 1615 N GLU A 103 31.163 29.875 51.647 1.00 0.00 N ATOM 1616 CA GLU A 103 32.465 30.459 51.218 1.00 0.00 C ATOM 1617 C GLU A 103 32.697 30.313 49.722 1.00 0.00 C ATOM 1618 O GLU A 103 33.130 31.258 49.064 1.00 0.00 O ATOM 1619 CB GLU A 103 33.524 29.676 51.995 1.00 0.00 C ATOM 1620 CG GLU A 103 34.855 30.428 51.940 1.00 0.00 C ATOM 1621 CD GLU A 103 34.729 31.747 52.706 1.00 0.00 C ATOM 1622 OE1 GLU A 103 34.628 31.694 53.920 1.00 0.00 O ATOM 1623 OE2 GLU A 103 34.735 32.784 52.066 1.00 0.00 O ATOM 0 H GLU A 103 31.203 29.366 52.530 1.00 0.00 H new ATOM 0 HA GLU A 103 32.496 31.530 51.419 1.00 0.00 H new ATOM 0 HB2 GLU A 103 33.209 29.547 53.031 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.639 28.679 51.570 1.00 0.00 H new ATOM 0 HG2 GLU A 103 35.648 29.818 52.373 1.00 0.00 H new ATOM 0 HG3 GLU A 103 35.133 30.622 50.904 1.00 0.00 H new ATOM 1630 N ALA A 104 32.448 29.163 49.158 1.00 0.00 N ATOM 1631 CA ALA A 104 32.705 29.026 47.694 1.00 0.00 C ATOM 1632 C ALA A 104 31.649 29.828 46.934 1.00 0.00 C ATOM 1633 O ALA A 104 31.933 30.475 45.925 1.00 0.00 O ATOM 1634 CB ALA A 104 32.568 27.531 47.398 1.00 0.00 C ATOM 0 H ALA A 104 32.088 28.333 49.630 1.00 0.00 H new ATOM 0 HA ALA A 104 33.685 29.397 47.395 1.00 0.00 H new ATOM 0 HB1 ALA A 104 32.744 27.352 46.337 1.00 0.00 H new ATOM 0 HB2 ALA A 104 33.299 26.975 47.986 1.00 0.00 H new ATOM 0 HB3 ALA A 104 31.563 27.199 47.660 1.00 0.00 H new ATOM 1640 N LEU A 105 30.435 29.806 47.413 1.00 0.00 N ATOM 1641 CA LEU A 105 29.349 30.570 46.740 1.00 0.00 C ATOM 1642 C LEU A 105 29.585 32.078 46.901 1.00 0.00 C ATOM 1643 O LEU A 105 29.641 32.816 45.919 1.00 0.00 O ATOM 1644 CB LEU A 105 28.061 30.133 47.434 1.00 0.00 C ATOM 1645 CG LEU A 105 27.661 28.742 46.927 1.00 0.00 C ATOM 1646 CD1 LEU A 105 26.973 27.962 48.051 1.00 0.00 C ATOM 1647 CD2 LEU A 105 26.703 28.880 45.735 1.00 0.00 C ATOM 0 H LEU A 105 30.149 29.289 48.245 1.00 0.00 H new ATOM 0 HA LEU A 105 29.307 30.376 45.668 1.00 0.00 H new ATOM 0 HB2 LEU A 105 28.205 30.112 48.514 1.00 0.00 H new ATOM 0 HB3 LEU A 105 27.264 30.849 47.233 1.00 0.00 H new ATOM 0 HG LEU A 105 28.555 28.205 46.610 1.00 0.00 H new ATOM 0 HD11 LEU A 105 26.690 26.974 47.688 1.00 0.00 H new ATOM 0 HD12 LEU A 105 27.658 27.857 48.893 1.00 0.00 H new ATOM 0 HD13 LEU A 105 26.081 28.499 48.374 1.00 0.00 H new ATOM 0 HD21 LEU A 105 26.421 27.889 45.378 1.00 0.00 H new ATOM 0 HD22 LEU A 105 25.810 29.421 46.047 1.00 0.00 H new ATOM 0 HD23 LEU A 105 27.197 29.428 44.933 1.00 0.00 H new ATOM 1659 N ALA A 106 29.737 32.551 48.112 1.00 0.00 N ATOM 1660 CA ALA A 106 29.985 34.011 48.322 1.00 0.00 C ATOM 1661 C ALA A 106 31.208 34.447 47.510 1.00 0.00 C ATOM 1662 O ALA A 106 31.224 35.536 46.919 1.00 0.00 O ATOM 1663 CB ALA A 106 30.247 34.167 49.822 1.00 0.00 C ATOM 0 H ALA A 106 29.700 31.991 48.964 1.00 0.00 H new ATOM 0 HA ALA A 106 29.145 34.627 47.999 1.00 0.00 H new ATOM 0 HB1 ALA A 106 30.438 35.216 50.051 1.00 0.00 H new ATOM 0 HB2 ALA A 106 29.376 33.826 50.381 1.00 0.00 H new ATOM 0 HB3 ALA A 106 31.115 33.571 50.104 1.00 0.00 H new ATOM 1669 N ASP A 107 32.223 33.608 47.454 1.00 0.00 N ATOM 1670 CA ASP A 107 33.436 33.939 46.668 1.00 0.00 C ATOM 1671 C ASP A 107 33.056 34.112 45.195 1.00 0.00 C ATOM 1672 O ASP A 107 33.513 35.030 44.517 1.00 0.00 O ATOM 1673 CB ASP A 107 34.341 32.729 46.865 1.00 0.00 C ATOM 1674 CG ASP A 107 35.235 32.947 48.089 1.00 0.00 C ATOM 1675 OD1 ASP A 107 34.714 33.361 49.111 1.00 0.00 O ATOM 1676 OD2 ASP A 107 36.424 32.694 47.981 1.00 0.00 O ATOM 0 H ASP A 107 32.252 32.705 47.927 1.00 0.00 H new ATOM 0 HA ASP A 107 33.920 34.865 46.978 1.00 0.00 H new ATOM 0 HB2 ASP A 107 33.739 31.830 46.998 1.00 0.00 H new ATOM 0 HB3 ASP A 107 34.955 32.573 45.978 1.00 0.00 H new ATOM 1681 N GLN A 108 32.210 33.249 44.695 1.00 0.00 N ATOM 1682 CA GLN A 108 31.772 33.359 43.275 1.00 0.00 C ATOM 1683 C GLN A 108 30.982 34.657 43.071 1.00 0.00 C ATOM 1684 O GLN A 108 31.328 35.490 42.237 1.00 0.00 O ATOM 1685 CB GLN A 108 30.876 32.141 43.042 1.00 0.00 C ATOM 1686 CG GLN A 108 30.411 32.110 41.583 1.00 0.00 C ATOM 1687 CD GLN A 108 30.682 30.726 40.989 1.00 0.00 C ATOM 1688 OE1 GLN A 108 31.715 30.119 41.264 1.00 0.00 O ATOM 1689 NE2 GLN A 108 29.805 30.189 40.186 1.00 0.00 N ATOM 0 H GLN A 108 31.803 32.470 45.213 1.00 0.00 H new ATOM 0 HA GLN A 108 32.612 33.383 42.580 1.00 0.00 H new ATOM 0 HB2 GLN A 108 31.420 31.227 43.279 1.00 0.00 H new ATOM 0 HB3 GLN A 108 30.014 32.180 43.707 1.00 0.00 H new ATOM 0 HG2 GLN A 108 29.347 32.340 41.524 1.00 0.00 H new ATOM 0 HG3 GLN A 108 30.935 32.873 41.007 1.00 0.00 H new ATOM 0 HE21 GLN A 108 28.948 30.692 39.957 1.00 0.00 H new ATOM 0 HE22 GLN A 108 29.977 29.266 39.787 1.00 0.00 H new ATOM 1698 N VAL A 109 29.930 34.846 43.827 1.00 0.00 N ATOM 1699 CA VAL A 109 29.120 36.096 43.686 1.00 0.00 C ATOM 1700 C VAL A 109 29.967 37.314 44.074 1.00 0.00 C ATOM 1701 O VAL A 109 29.659 38.445 43.705 1.00 0.00 O ATOM 1702 CB VAL A 109 27.948 35.927 44.657 1.00 0.00 C ATOM 1703 CG1 VAL A 109 27.030 37.147 44.564 1.00 0.00 C ATOM 1704 CG2 VAL A 109 27.157 34.669 44.292 1.00 0.00 C ATOM 0 H VAL A 109 29.597 34.191 44.534 1.00 0.00 H new ATOM 0 HA VAL A 109 28.778 36.254 42.663 1.00 0.00 H new ATOM 0 HB VAL A 109 28.331 35.834 45.673 1.00 0.00 H new ATOM 0 HG11 VAL A 109 26.195 37.028 45.255 1.00 0.00 H new ATOM 0 HG12 VAL A 109 27.591 38.045 44.824 1.00 0.00 H new ATOM 0 HG13 VAL A 109 26.649 37.239 43.547 1.00 0.00 H new ATOM 0 HG21 VAL A 109 26.323 34.550 44.984 1.00 0.00 H new ATOM 0 HG22 VAL A 109 26.775 34.762 43.275 1.00 0.00 H new ATOM 0 HG23 VAL A 109 27.809 33.798 44.356 1.00 0.00 H new ATOM 1714 N ALA A 110 31.030 37.093 44.816 1.00 0.00 N ATOM 1715 CA ALA A 110 31.935 38.209 45.250 1.00 0.00 C ATOM 1716 C ALA A 110 31.346 38.963 46.447 1.00 0.00 C ATOM 1717 O ALA A 110 31.810 40.047 46.797 1.00 0.00 O ATOM 1718 CB ALA A 110 32.087 39.143 44.042 1.00 0.00 C ATOM 0 H ALA A 110 31.313 36.170 45.144 1.00 0.00 H new ATOM 0 HA ALA A 110 32.901 37.820 45.571 1.00 0.00 H new ATOM 0 HB1 ALA A 110 32.739 39.976 44.306 1.00 0.00 H new ATOM 0 HB2 ALA A 110 32.522 38.592 43.208 1.00 0.00 H new ATOM 0 HB3 ALA A 110 31.108 39.526 43.753 1.00 0.00 H new ATOM 1724 N MET A 111 30.352 38.408 47.102 1.00 0.00 N ATOM 1725 CA MET A 111 29.792 39.125 48.285 1.00 0.00 C ATOM 1726 C MET A 111 29.416 38.173 49.444 1.00 0.00 C ATOM 1727 O MET A 111 29.869 37.033 49.519 1.00 0.00 O ATOM 1728 CB MET A 111 28.625 39.976 47.758 1.00 0.00 C ATOM 1729 CG MET A 111 27.288 39.237 47.791 1.00 0.00 C ATOM 1730 SD MET A 111 25.985 40.468 48.051 1.00 0.00 S ATOM 1731 CE MET A 111 26.080 40.520 49.857 1.00 0.00 C ATOM 0 H MET A 111 29.916 37.514 46.875 1.00 0.00 H new ATOM 0 HA MET A 111 30.539 39.772 48.745 1.00 0.00 H new ATOM 0 HB2 MET A 111 28.547 40.885 48.354 1.00 0.00 H new ATOM 0 HB3 MET A 111 28.839 40.283 46.734 1.00 0.00 H new ATOM 0 HG2 MET A 111 27.125 38.699 46.857 1.00 0.00 H new ATOM 0 HG3 MET A 111 27.280 38.497 48.591 1.00 0.00 H new ATOM 0 HE1 MET A 111 25.192 41.012 50.254 1.00 0.00 H new ATOM 0 HE2 MET A 111 26.137 39.504 50.248 1.00 0.00 H new ATOM 0 HE3 MET A 111 26.968 41.075 50.159 1.00 0.00 H new ATOM 1741 N SER A 112 28.643 38.674 50.374 1.00 0.00 N ATOM 1742 CA SER A 112 28.247 37.897 51.605 1.00 0.00 C ATOM 1743 C SER A 112 27.287 36.701 51.360 1.00 0.00 C ATOM 1744 O SER A 112 26.734 36.524 50.278 1.00 0.00 O ATOM 1745 CB SER A 112 27.569 38.950 52.496 1.00 0.00 C ATOM 1746 OG SER A 112 26.316 38.459 52.959 1.00 0.00 O ATOM 0 H SER A 112 28.255 39.617 50.336 1.00 0.00 H new ATOM 0 HA SER A 112 29.127 37.422 52.040 1.00 0.00 H new ATOM 0 HB2 SER A 112 28.211 39.190 53.344 1.00 0.00 H new ATOM 0 HB3 SER A 112 27.423 39.873 51.936 1.00 0.00 H new ATOM 0 HG SER A 112 25.890 39.134 53.527 1.00 0.00 H new ATOM 1752 N PRO A 113 27.130 35.936 52.433 1.00 0.00 N ATOM 1753 CA PRO A 113 26.252 34.734 52.499 1.00 0.00 C ATOM 1754 C PRO A 113 24.804 35.109 52.237 1.00 0.00 C ATOM 1755 O PRO A 113 24.017 34.282 51.776 1.00 0.00 O ATOM 1756 CB PRO A 113 26.451 34.193 53.915 1.00 0.00 C ATOM 1757 CG PRO A 113 26.920 35.369 54.691 1.00 0.00 C ATOM 1758 CD PRO A 113 27.782 36.150 53.742 1.00 0.00 C ATOM 0 HA PRO A 113 26.501 33.989 51.744 1.00 0.00 H new ATOM 0 HB2 PRO A 113 25.523 33.791 54.322 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.183 33.386 53.934 1.00 0.00 H new ATOM 0 HG2 PRO A 113 26.080 35.968 55.044 1.00 0.00 H new ATOM 0 HG3 PRO A 113 27.484 35.060 55.571 1.00 0.00 H new ATOM 0 HD2 PRO A 113 27.815 37.207 54.006 1.00 0.00 H new ATOM 0 HD3 PRO A 113 28.810 35.789 53.743 1.00 0.00 H new ATOM 1766 N PHE A 114 24.410 36.325 52.518 1.00 0.00 N ATOM 1767 CA PHE A 114 22.992 36.670 52.266 1.00 0.00 C ATOM 1768 C PHE A 114 22.740 36.659 50.769 1.00 0.00 C ATOM 1769 O PHE A 114 21.682 36.208 50.332 1.00 0.00 O ATOM 1770 CB PHE A 114 22.762 38.081 52.810 1.00 0.00 C ATOM 1771 CG PHE A 114 22.784 38.110 54.322 1.00 0.00 C ATOM 1772 CD1 PHE A 114 23.057 36.954 55.066 1.00 0.00 C ATOM 1773 CD2 PHE A 114 22.524 39.315 54.978 1.00 0.00 C ATOM 1774 CE1 PHE A 114 23.076 37.014 56.465 1.00 0.00 C ATOM 1775 CE2 PHE A 114 22.540 39.375 56.373 1.00 0.00 C ATOM 1776 CZ PHE A 114 22.819 38.225 57.117 1.00 0.00 C ATOM 0 H PHE A 114 24.994 37.069 52.900 1.00 0.00 H new ATOM 0 HA PHE A 114 22.322 35.957 52.747 1.00 0.00 H new ATOM 0 HB2 PHE A 114 23.530 38.750 52.422 1.00 0.00 H new ATOM 0 HB3 PHE A 114 21.803 38.456 52.453 1.00 0.00 H new ATOM 0 HD1 PHE A 114 23.252 36.019 54.562 1.00 0.00 H new ATOM 0 HD2 PHE A 114 22.310 40.204 54.404 1.00 0.00 H new ATOM 0 HE1 PHE A 114 23.289 36.125 57.041 1.00 0.00 H new ATOM 0 HE2 PHE A 114 22.337 40.309 56.876 1.00 0.00 H new ATOM 0 HZ PHE A 114 22.836 38.271 58.196 1.00 0.00 H new ATOM 1786 N HIS A 115 23.662 37.097 49.945 1.00 0.00 N ATOM 1787 CA HIS A 115 23.344 37.010 48.506 1.00 0.00 C ATOM 1788 C HIS A 115 23.365 35.538 48.052 1.00 0.00 C ATOM 1789 O HIS A 115 22.581 35.139 47.192 1.00 0.00 O ATOM 1790 CB HIS A 115 24.278 37.869 47.693 1.00 0.00 C ATOM 1791 CG HIS A 115 23.445 38.300 46.519 1.00 0.00 C ATOM 1792 ND1 HIS A 115 22.544 39.348 46.636 1.00 0.00 N ATOM 1793 CD2 HIS A 115 23.207 37.738 45.288 1.00 0.00 C ATOM 1794 CE1 HIS A 115 21.799 39.372 45.520 1.00 0.00 C ATOM 1795 NE2 HIS A 115 22.158 38.415 44.662 1.00 0.00 N ATOM 0 H HIS A 115 24.570 37.489 50.196 1.00 0.00 H new ATOM 0 HA HIS A 115 22.339 37.397 48.339 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.634 38.725 48.266 1.00 0.00 H new ATOM 0 HB3 HIS A 115 25.158 37.311 47.374 1.00 0.00 H new ATOM 0 HD2 HIS A 115 23.748 36.902 44.869 1.00 0.00 H new ATOM 0 HE1 HIS A 115 21.004 40.081 45.338 1.00 0.00 H new ATOM 0 HE2 HIS A 115 21.753 38.220 43.746 1.00 0.00 H new ATOM 1803 N LEU A 116 24.190 34.705 48.645 1.00 0.00 N ATOM 1804 CA LEU A 116 24.178 33.254 48.273 1.00 0.00 C ATOM 1805 C LEU A 116 22.755 32.743 48.494 1.00 0.00 C ATOM 1806 O LEU A 116 22.166 32.083 47.641 1.00 0.00 O ATOM 1807 CB LEU A 116 25.158 32.565 49.233 1.00 0.00 C ATOM 1808 CG LEU A 116 25.058 31.032 49.099 1.00 0.00 C ATOM 1809 CD1 LEU A 116 23.873 30.510 49.919 1.00 0.00 C ATOM 1810 CD2 LEU A 116 24.859 30.640 47.632 1.00 0.00 C ATOM 0 H LEU A 116 24.865 34.965 49.364 1.00 0.00 H new ATOM 0 HA LEU A 116 24.467 33.066 47.239 1.00 0.00 H new ATOM 0 HB2 LEU A 116 26.176 32.889 49.017 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.940 32.861 50.259 1.00 0.00 H new ATOM 0 HG LEU A 116 25.984 30.593 49.470 1.00 0.00 H new ATOM 0 HD11 LEU A 116 23.810 29.426 49.818 1.00 0.00 H new ATOM 0 HD12 LEU A 116 24.014 30.769 50.968 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.951 30.962 49.554 1.00 0.00 H new ATOM 0 HD21 LEU A 116 24.790 29.555 47.551 1.00 0.00 H new ATOM 0 HD22 LEU A 116 23.941 31.091 47.256 1.00 0.00 H new ATOM 0 HD23 LEU A 116 25.705 30.994 47.043 1.00 0.00 H new ATOM 1822 N HIS A 117 22.174 33.092 49.614 1.00 0.00 N ATOM 1823 CA HIS A 117 20.765 32.689 49.890 1.00 0.00 C ATOM 1824 C HIS A 117 19.884 33.232 48.754 1.00 0.00 C ATOM 1825 O HIS A 117 19.094 32.508 48.150 1.00 0.00 O ATOM 1826 CB HIS A 117 20.417 33.356 51.223 1.00 0.00 C ATOM 1827 CG HIS A 117 21.398 32.926 52.283 1.00 0.00 C ATOM 1828 ND1 HIS A 117 21.756 33.752 53.335 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.107 31.764 52.462 1.00 0.00 C ATOM 1830 CE1 HIS A 117 22.643 33.083 54.094 1.00 0.00 C ATOM 1831 NE2 HIS A 117 22.893 31.865 53.606 1.00 0.00 N ATOM 0 H HIS A 117 22.618 33.641 50.350 1.00 0.00 H new ATOM 0 HA HIS A 117 20.618 31.610 49.944 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.438 34.440 51.114 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.404 33.086 51.521 1.00 0.00 H new ATOM 0 HD2 HIS A 117 22.062 30.902 51.813 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.097 33.482 54.989 1.00 0.00 H new ATOM 0 HE2 HIS A 117 23.524 31.161 53.989 1.00 0.00 H new ATOM 1839 N ARG A 118 20.064 34.492 48.418 1.00 0.00 N ATOM 1840 CA ARG A 118 19.301 35.121 47.285 1.00 0.00 C ATOM 1841 C ARG A 118 19.495 34.295 45.994 1.00 0.00 C ATOM 1842 O ARG A 118 18.558 34.107 45.220 1.00 0.00 O ATOM 1843 CB ARG A 118 19.911 36.516 47.125 1.00 0.00 C ATOM 1844 CG ARG A 118 18.820 37.525 46.739 1.00 0.00 C ATOM 1845 CD ARG A 118 17.726 37.586 47.820 1.00 0.00 C ATOM 1846 NE ARG A 118 18.423 37.364 49.122 1.00 0.00 N ATOM 1847 CZ ARG A 118 19.167 38.302 49.656 1.00 0.00 C ATOM 1848 NH1 ARG A 118 19.318 39.458 49.063 1.00 0.00 N ATOM 1849 NH2 ARG A 118 19.764 38.081 50.795 1.00 0.00 N ATOM 0 H ARG A 118 20.716 35.120 48.888 1.00 0.00 H new ATOM 0 HA ARG A 118 18.229 35.164 47.479 1.00 0.00 H new ATOM 0 HB2 ARG A 118 20.388 36.822 48.056 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.687 36.497 46.360 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.262 38.512 46.606 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.378 37.242 45.783 1.00 0.00 H new ATOM 0 HD2 ARG A 118 17.219 38.551 47.808 1.00 0.00 H new ATOM 0 HD3 ARG A 118 16.966 36.824 47.649 1.00 0.00 H new ATOM 0 HE ARG A 118 18.319 36.470 49.602 1.00 0.00 H new ATOM 0 HH11 ARG A 118 18.854 39.639 48.173 1.00 0.00 H new ATOM 0 HH12 ARG A 118 19.900 40.178 49.491 1.00 0.00 H new ATOM 0 HH21 ARG A 118 19.650 37.183 51.264 1.00 0.00 H new ATOM 0 HH22 ARG A 118 20.344 38.807 51.216 1.00 0.00 H new ATOM 1863 N LEU A 119 20.679 33.759 45.767 1.00 0.00 N ATOM 1864 CA LEU A 119 20.919 32.900 44.548 1.00 0.00 C ATOM 1865 C LEU A 119 20.131 31.575 44.697 1.00 0.00 C ATOM 1866 O LEU A 119 19.411 31.156 43.793 1.00 0.00 O ATOM 1867 CB LEU A 119 22.434 32.646 44.539 1.00 0.00 C ATOM 1868 CG LEU A 119 22.847 31.829 43.302 1.00 0.00 C ATOM 1869 CD1 LEU A 119 22.511 30.352 43.520 1.00 0.00 C ATOM 1870 CD2 LEU A 119 22.115 32.343 42.057 1.00 0.00 C ATOM 0 H LEU A 119 21.491 33.879 46.373 1.00 0.00 H new ATOM 0 HA LEU A 119 20.590 33.368 43.620 1.00 0.00 H new ATOM 0 HB2 LEU A 119 22.966 33.597 44.546 1.00 0.00 H new ATOM 0 HB3 LEU A 119 22.723 32.113 45.445 1.00 0.00 H new ATOM 0 HG LEU A 119 23.921 31.939 43.153 1.00 0.00 H new ATOM 0 HD11 LEU A 119 22.805 29.778 42.641 1.00 0.00 H new ATOM 0 HD12 LEU A 119 23.049 29.981 44.392 1.00 0.00 H new ATOM 0 HD13 LEU A 119 21.439 30.243 43.682 1.00 0.00 H new ATOM 0 HD21 LEU A 119 22.417 31.756 41.189 1.00 0.00 H new ATOM 0 HD22 LEU A 119 21.039 32.249 42.203 1.00 0.00 H new ATOM 0 HD23 LEU A 119 22.368 33.390 41.892 1.00 0.00 H new ATOM 1882 N PHE A 120 20.229 30.937 45.851 1.00 0.00 N ATOM 1883 CA PHE A 120 19.462 29.660 46.125 1.00 0.00 C ATOM 1884 C PHE A 120 17.972 29.890 45.749 1.00 0.00 C ATOM 1885 O PHE A 120 17.330 29.026 45.165 1.00 0.00 O ATOM 1886 CB PHE A 120 19.666 29.450 47.659 1.00 0.00 C ATOM 1887 CG PHE A 120 19.560 27.981 48.103 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.823 27.065 47.344 1.00 0.00 C ATOM 1889 CD2 PHE A 120 20.162 27.545 49.320 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.684 25.740 47.770 1.00 0.00 C ATOM 1891 CE2 PHE A 120 20.006 26.219 49.746 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.267 25.318 48.970 1.00 0.00 C ATOM 0 H PHE A 120 20.815 31.250 46.625 1.00 0.00 H new ATOM 0 HA PHE A 120 19.789 28.789 45.557 1.00 0.00 H new ATOM 0 HB2 PHE A 120 20.645 29.836 47.942 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.924 30.038 48.199 1.00 0.00 H new ATOM 0 HD1 PHE A 120 18.358 27.383 46.423 1.00 0.00 H new ATOM 0 HD2 PHE A 120 20.739 28.238 49.914 1.00 0.00 H new ATOM 0 HE1 PHE A 120 18.124 25.039 47.169 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.455 25.892 50.672 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.147 24.296 49.298 1.00 0.00 H new ATOM 1902 N LYS A 121 17.432 31.062 46.033 1.00 0.00 N ATOM 1903 CA LYS A 121 16.005 31.379 45.652 1.00 0.00 C ATOM 1904 C LYS A 121 15.912 31.652 44.145 1.00 0.00 C ATOM 1905 O LYS A 121 14.965 31.247 43.478 1.00 0.00 O ATOM 1906 CB LYS A 121 15.671 32.664 46.400 1.00 0.00 C ATOM 1907 CG LYS A 121 14.302 33.197 45.948 1.00 0.00 C ATOM 1908 CD LYS A 121 14.319 34.727 45.962 1.00 0.00 C ATOM 1909 CE LYS A 121 13.171 35.257 45.099 1.00 0.00 C ATOM 1910 NZ LYS A 121 13.819 35.730 43.843 1.00 0.00 N ATOM 0 H LYS A 121 17.921 31.817 46.515 1.00 0.00 H new ATOM 0 HA LYS A 121 15.331 30.557 45.894 1.00 0.00 H new ATOM 0 HB2 LYS A 121 15.661 32.477 47.474 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.441 33.413 46.214 1.00 0.00 H new ATOM 0 HG2 LYS A 121 14.072 32.835 44.946 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.519 32.826 46.609 1.00 0.00 H new ATOM 0 HD2 LYS A 121 14.219 35.093 46.984 1.00 0.00 H new ATOM 0 HD3 LYS A 121 15.273 35.094 45.583 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.438 34.477 44.895 1.00 0.00 H new ATOM 0 HE3 LYS A 121 12.642 36.068 45.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 13.095 36.108 43.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 14.507 36.477 44.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 14.308 34.935 43.384 1.00 0.00 H new ATOM 1924 N ALA A 122 16.887 32.337 43.601 1.00 0.00 N ATOM 1925 CA ALA A 122 16.873 32.638 42.140 1.00 0.00 C ATOM 1926 C ALA A 122 16.826 31.326 41.363 1.00 0.00 C ATOM 1927 O ALA A 122 15.947 31.104 40.533 1.00 0.00 O ATOM 1928 CB ALA A 122 18.182 33.381 41.865 1.00 0.00 C ATOM 0 H ALA A 122 17.693 32.701 44.109 1.00 0.00 H new ATOM 0 HA ALA A 122 16.011 33.234 41.840 1.00 0.00 H new ATOM 0 HB1 ALA A 122 18.241 33.635 40.807 1.00 0.00 H new ATOM 0 HB2 ALA A 122 18.214 34.294 42.460 1.00 0.00 H new ATOM 0 HB3 ALA A 122 19.025 32.744 42.133 1.00 0.00 H new ATOM 1934 N THR A 123 17.764 30.455 41.617 1.00 0.00 N ATOM 1935 CA THR A 123 17.778 29.150 40.883 1.00 0.00 C ATOM 1936 C THR A 123 16.583 28.266 41.333 1.00 0.00 C ATOM 1937 O THR A 123 15.709 27.944 40.531 1.00 0.00 O ATOM 1938 CB THR A 123 19.114 28.499 41.264 1.00 0.00 C ATOM 1939 OG1 THR A 123 20.105 29.508 41.416 1.00 0.00 O ATOM 1940 CG2 THR A 123 19.547 27.538 40.156 1.00 0.00 C ATOM 0 H THR A 123 18.516 30.585 42.294 1.00 0.00 H new ATOM 0 HA THR A 123 17.682 29.278 39.805 1.00 0.00 H new ATOM 0 HB THR A 123 18.996 27.953 42.200 1.00 0.00 H new ATOM 0 HG1 THR A 123 20.959 29.094 41.661 1.00 0.00 H new ATOM 0 HG21 THR A 123 20.496 27.075 40.426 1.00 0.00 H new ATOM 0 HG22 THR A 123 18.789 26.765 40.029 1.00 0.00 H new ATOM 0 HG23 THR A 123 19.664 28.088 39.222 1.00 0.00 H new ATOM 1948 N THR A 124 16.497 27.912 42.602 1.00 0.00 N ATOM 1949 CA THR A 124 15.325 27.097 43.107 1.00 0.00 C ATOM 1950 C THR A 124 14.026 27.790 42.679 1.00 0.00 C ATOM 1951 O THR A 124 13.018 27.151 42.384 1.00 0.00 O ATOM 1952 CB THR A 124 15.471 27.047 44.639 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.886 25.846 45.123 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.773 28.243 45.293 1.00 0.00 C ATOM 0 H THR A 124 17.188 28.151 43.313 1.00 0.00 H new ATOM 0 HA THR A 124 15.302 26.085 42.703 1.00 0.00 H new ATOM 0 HB THR A 124 16.531 27.082 44.889 1.00 0.00 H new ATOM 0 HG1 THR A 124 15.518 25.391 45.718 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.890 28.185 46.375 1.00 0.00 H new ATOM 0 HG22 THR A 124 15.219 29.168 44.929 1.00 0.00 H new ATOM 0 HG23 THR A 124 13.713 28.228 45.041 1.00 0.00 H new ATOM 1962 N GLY A 125 14.055 29.103 42.618 1.00 0.00 N ATOM 1963 CA GLY A 125 12.856 29.883 42.185 1.00 0.00 C ATOM 1964 C GLY A 125 12.180 30.711 43.305 1.00 0.00 C ATOM 1965 O GLY A 125 11.713 31.810 43.008 1.00 0.00 O ATOM 0 H GLY A 125 14.869 29.670 42.853 1.00 0.00 H new ATOM 0 HA2 GLY A 125 13.150 30.558 41.381 1.00 0.00 H new ATOM 0 HA3 GLY A 125 12.122 29.193 41.769 1.00 0.00 H new ATOM 1969 N MET A 126 12.083 30.291 44.552 1.00 0.00 N ATOM 1970 CA MET A 126 11.384 31.214 45.528 1.00 0.00 C ATOM 1971 C MET A 126 11.678 30.952 47.022 1.00 0.00 C ATOM 1972 O MET A 126 10.749 30.909 47.826 1.00 0.00 O ATOM 1973 CB MET A 126 9.891 30.973 45.272 1.00 0.00 C ATOM 1974 CG MET A 126 9.404 31.850 44.118 1.00 0.00 C ATOM 1975 SD MET A 126 7.645 32.216 44.342 1.00 0.00 S ATOM 1976 CE MET A 126 7.503 33.455 43.031 1.00 0.00 C ATOM 0 H MET A 126 12.432 29.407 44.924 1.00 0.00 H new ATOM 0 HA MET A 126 11.734 32.232 45.359 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.720 29.922 45.037 1.00 0.00 H new ATOM 0 HB3 MET A 126 9.320 31.195 46.173 1.00 0.00 H new ATOM 0 HG2 MET A 126 9.978 32.776 44.083 1.00 0.00 H new ATOM 0 HG3 MET A 126 9.563 31.341 43.167 1.00 0.00 H new ATOM 0 HE1 MET A 126 6.479 33.825 42.989 1.00 0.00 H new ATOM 0 HE2 MET A 126 8.180 34.284 43.239 1.00 0.00 H new ATOM 0 HE3 MET A 126 7.765 33.004 42.074 1.00 0.00 H new ATOM 1986 N THR A 127 12.915 30.826 47.439 1.00 0.00 N ATOM 1987 CA THR A 127 13.183 30.618 48.896 1.00 0.00 C ATOM 1988 C THR A 127 14.688 30.733 49.209 1.00 0.00 C ATOM 1989 O THR A 127 15.349 29.713 49.382 1.00 0.00 O ATOM 1990 CB THR A 127 12.707 29.195 49.179 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.346 29.038 48.804 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.852 28.933 50.659 1.00 0.00 C ATOM 0 H THR A 127 13.741 30.858 46.842 1.00 0.00 H new ATOM 0 HA THR A 127 12.677 31.366 49.506 1.00 0.00 H new ATOM 0 HB THR A 127 13.306 28.490 48.602 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.888 29.903 48.864 1.00 0.00 H new ATOM 0 HG21 THR A 127 12.517 27.920 50.884 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.898 29.042 50.947 1.00 0.00 H new ATOM 0 HG23 THR A 127 12.246 29.648 51.216 1.00 0.00 H new ATOM 2000 N PRO A 128 15.215 31.935 49.297 1.00 0.00 N ATOM 2001 CA PRO A 128 16.670 32.051 49.574 1.00 0.00 C ATOM 2002 C PRO A 128 17.040 31.685 51.012 1.00 0.00 C ATOM 2003 O PRO A 128 17.060 30.512 51.381 1.00 0.00 O ATOM 2004 CB PRO A 128 16.945 33.530 49.269 1.00 0.00 C ATOM 2005 CG PRO A 128 15.636 34.233 49.472 1.00 0.00 C ATOM 2006 CD PRO A 128 14.540 33.236 49.199 1.00 0.00 C ATOM 0 HA PRO A 128 17.267 31.360 48.980 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.712 33.931 49.931 1.00 0.00 H new ATOM 0 HB3 PRO A 128 17.306 33.659 48.249 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.561 34.617 50.489 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.552 35.088 48.802 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.731 33.322 49.925 1.00 0.00 H new ATOM 0 HD3 PRO A 128 14.101 33.385 48.213 1.00 0.00 H new ATOM 2014 N LYS A 129 17.367 32.656 51.827 1.00 0.00 N ATOM 2015 CA LYS A 129 17.771 32.343 53.216 1.00 0.00 C ATOM 2016 C LYS A 129 16.636 31.624 53.965 1.00 0.00 C ATOM 2017 O LYS A 129 16.871 30.899 54.933 1.00 0.00 O ATOM 2018 CB LYS A 129 18.127 33.674 53.851 1.00 0.00 C ATOM 2019 CG LYS A 129 18.500 33.455 55.321 1.00 0.00 C ATOM 2020 CD LYS A 129 19.691 32.495 55.408 1.00 0.00 C ATOM 2021 CE LYS A 129 20.599 32.878 56.581 1.00 0.00 C ATOM 2022 NZ LYS A 129 20.937 34.319 56.377 1.00 0.00 N ATOM 0 H LYS A 129 17.369 33.647 51.584 1.00 0.00 H new ATOM 0 HA LYS A 129 18.621 31.662 53.252 1.00 0.00 H new ATOM 0 HB2 LYS A 129 18.960 34.132 53.318 1.00 0.00 H new ATOM 0 HB3 LYS A 129 17.284 34.361 53.777 1.00 0.00 H new ATOM 0 HG2 LYS A 129 18.751 34.407 55.789 1.00 0.00 H new ATOM 0 HG3 LYS A 129 17.649 33.046 55.866 1.00 0.00 H new ATOM 0 HD2 LYS A 129 19.334 31.473 55.534 1.00 0.00 H new ATOM 0 HD3 LYS A 129 20.257 32.522 54.477 1.00 0.00 H new ATOM 0 HE2 LYS A 129 20.092 32.726 57.534 1.00 0.00 H new ATOM 0 HE3 LYS A 129 21.499 32.263 56.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 21.910 34.496 56.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 20.857 34.555 55.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 20.279 34.911 56.923 1.00 0.00 H new ATOM 2036 N ALA A 130 15.417 31.767 53.520 1.00 0.00 N ATOM 2037 CA ALA A 130 14.300 31.042 54.200 1.00 0.00 C ATOM 2038 C ALA A 130 14.472 29.544 53.923 1.00 0.00 C ATOM 2039 O ALA A 130 14.157 28.710 54.770 1.00 0.00 O ATOM 2040 CB ALA A 130 13.018 31.572 53.556 1.00 0.00 C ATOM 0 H ALA A 130 15.146 32.346 52.725 1.00 0.00 H new ATOM 0 HA ALA A 130 14.279 31.191 55.280 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.155 31.083 54.007 1.00 0.00 H new ATOM 0 HB2 ALA A 130 12.949 32.648 53.715 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.035 31.363 52.486 1.00 0.00 H new ATOM 2046 N TRP A 131 15.023 29.175 52.770 1.00 0.00 N ATOM 2047 CA TRP A 131 15.253 27.724 52.527 1.00 0.00 C ATOM 2048 C TRP A 131 16.266 27.278 53.563 1.00 0.00 C ATOM 2049 O TRP A 131 16.118 26.237 54.197 1.00 0.00 O ATOM 2050 CB TRP A 131 15.861 27.607 51.128 1.00 0.00 C ATOM 2051 CG TRP A 131 14.986 26.798 50.208 1.00 0.00 C ATOM 2052 CD1 TRP A 131 15.196 26.694 48.874 1.00 0.00 C ATOM 2053 CD2 TRP A 131 13.803 25.974 50.495 1.00 0.00 C ATOM 2054 NE1 TRP A 131 14.222 25.884 48.323 1.00 0.00 N ATOM 2055 CE2 TRP A 131 13.344 25.415 49.277 1.00 0.00 C ATOM 2056 CE3 TRP A 131 13.083 25.661 51.671 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 12.224 24.583 49.224 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 11.958 24.823 51.617 1.00 0.00 C ATOM 2059 CH2 TRP A 131 11.529 24.287 50.398 1.00 0.00 C ATOM 0 H TRP A 131 15.309 29.804 52.020 1.00 0.00 H new ATOM 0 HA TRP A 131 14.346 27.123 52.595 1.00 0.00 H new ATOM 0 HB2 TRP A 131 16.007 28.603 50.710 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.845 27.143 51.196 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.998 27.169 48.328 1.00 0.00 H new ATOM 0 HE1 TRP A 131 14.160 25.660 47.330 1.00 0.00 H new ATOM 0 HE3 TRP A 131 13.401 26.070 52.619 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 11.897 24.171 48.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 11.419 24.590 52.524 1.00 0.00 H new ATOM 0 HH2 TRP A 131 10.661 23.645 50.365 1.00 0.00 H new ATOM 2070 N GLN A 132 17.269 28.085 53.793 1.00 0.00 N ATOM 2071 CA GLN A 132 18.274 27.746 54.842 1.00 0.00 C ATOM 2072 C GLN A 132 17.541 27.521 56.163 1.00 0.00 C ATOM 2073 O GLN A 132 17.899 26.654 56.956 1.00 0.00 O ATOM 2074 CB GLN A 132 19.182 28.970 54.940 1.00 0.00 C ATOM 2075 CG GLN A 132 20.389 28.634 55.815 1.00 0.00 C ATOM 2076 CD GLN A 132 20.038 28.863 57.285 1.00 0.00 C ATOM 2077 OE1 GLN A 132 19.267 29.764 57.612 1.00 0.00 O ATOM 2078 NE2 GLN A 132 20.566 28.092 58.196 1.00 0.00 N ATOM 0 H GLN A 132 17.435 28.963 53.300 1.00 0.00 H new ATOM 0 HA GLN A 132 18.845 26.846 54.611 1.00 0.00 H new ATOM 0 HB2 GLN A 132 19.512 29.273 53.946 1.00 0.00 H new ATOM 0 HB3 GLN A 132 18.634 29.811 55.364 1.00 0.00 H new ATOM 0 HG2 GLN A 132 20.686 27.597 55.659 1.00 0.00 H new ATOM 0 HG3 GLN A 132 21.239 29.255 55.533 1.00 0.00 H new ATOM 0 HE21 GLN A 132 21.205 27.345 57.924 1.00 0.00 H new ATOM 0 HE22 GLN A 132 20.339 28.236 59.180 1.00 0.00 H new ATOM 2087 N GLN A 133 16.506 28.284 56.405 1.00 0.00 N ATOM 2088 CA GLN A 133 15.728 28.106 57.667 1.00 0.00 C ATOM 2089 C GLN A 133 15.023 26.747 57.647 1.00 0.00 C ATOM 2090 O GLN A 133 15.097 25.976 58.602 1.00 0.00 O ATOM 2091 CB GLN A 133 14.706 29.243 57.679 1.00 0.00 C ATOM 2092 CG GLN A 133 14.212 29.466 59.109 1.00 0.00 C ATOM 2093 CD GLN A 133 12.744 29.895 59.083 1.00 0.00 C ATOM 2094 OE1 GLN A 133 11.936 29.320 58.357 1.00 0.00 O ATOM 2095 NE2 GLN A 133 12.350 30.880 59.844 1.00 0.00 N ATOM 0 H GLN A 133 16.167 29.020 55.785 1.00 0.00 H new ATOM 0 HA GLN A 133 16.362 28.132 58.553 1.00 0.00 H new ATOM 0 HB2 GLN A 133 15.157 30.157 57.292 1.00 0.00 H new ATOM 0 HB3 GLN A 133 13.867 29.000 57.026 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.324 28.551 59.690 1.00 0.00 H new ATOM 0 HG3 GLN A 133 14.816 30.230 59.598 1.00 0.00 H new ATOM 0 HE21 GLN A 133 13.020 31.358 60.447 1.00 0.00 H new ATOM 0 HE22 GLN A 133 11.373 31.172 59.836 1.00 0.00 H new ATOM 2104 N ALA A 134 14.349 26.430 56.567 1.00 0.00 N ATOM 2105 CA ALA A 134 13.656 25.109 56.486 1.00 0.00 C ATOM 2106 C ALA A 134 14.683 23.999 56.670 1.00 0.00 C ATOM 2107 O ALA A 134 14.455 23.019 57.375 1.00 0.00 O ATOM 2108 CB ALA A 134 13.038 25.056 55.087 1.00 0.00 C ATOM 0 H ALA A 134 14.250 27.025 55.745 1.00 0.00 H new ATOM 0 HA ALA A 134 12.893 24.983 57.254 1.00 0.00 H new ATOM 0 HB1 ALA A 134 12.512 24.110 54.957 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.336 25.881 54.968 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.826 25.139 54.338 1.00 0.00 H new ATOM 2114 N TRP A 135 15.831 24.167 56.080 1.00 0.00 N ATOM 2115 CA TRP A 135 16.923 23.163 56.243 1.00 0.00 C ATOM 2116 C TRP A 135 17.161 22.957 57.728 1.00 0.00 C ATOM 2117 O TRP A 135 17.167 21.842 58.247 1.00 0.00 O ATOM 2118 CB TRP A 135 18.140 23.840 55.634 1.00 0.00 C ATOM 2119 CG TRP A 135 17.873 24.197 54.210 1.00 0.00 C ATOM 2120 CD1 TRP A 135 18.674 24.979 53.473 1.00 0.00 C ATOM 2121 CD2 TRP A 135 16.780 23.780 53.334 1.00 0.00 C ATOM 2122 NE1 TRP A 135 18.140 25.104 52.205 1.00 0.00 N ATOM 2123 CE2 TRP A 135 16.977 24.375 52.067 1.00 0.00 C ATOM 2124 CE3 TRP A 135 15.646 22.959 53.511 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 16.087 24.166 51.013 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 14.750 22.747 52.451 1.00 0.00 C ATOM 2127 CH2 TRP A 135 14.971 23.348 51.204 1.00 0.00 C ATOM 0 H TRP A 135 16.064 24.963 55.486 1.00 0.00 H new ATOM 0 HA TRP A 135 16.702 22.200 55.784 1.00 0.00 H new ATOM 0 HB2 TRP A 135 18.388 24.737 56.201 1.00 0.00 H new ATOM 0 HB3 TRP A 135 19.003 23.176 55.694 1.00 0.00 H new ATOM 0 HD1 TRP A 135 19.590 25.438 53.815 1.00 0.00 H new ATOM 0 HE1 TRP A 135 18.555 25.666 51.462 1.00 0.00 H new ATOM 0 HE3 TRP A 135 15.466 22.491 54.468 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 16.260 24.634 50.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 13.885 22.117 52.597 1.00 0.00 H new ATOM 0 HH2 TRP A 135 14.279 23.179 50.392 1.00 0.00 H new ATOM 2138 N ARG A 136 17.349 24.046 58.409 1.00 0.00 N ATOM 2139 CA ARG A 136 17.588 23.991 59.880 1.00 0.00 C ATOM 2140 C ARG A 136 16.369 23.391 60.591 1.00 0.00 C ATOM 2141 O ARG A 136 16.476 22.854 61.692 1.00 0.00 O ATOM 2142 CB ARG A 136 17.792 25.447 60.302 1.00 0.00 C ATOM 2143 CG ARG A 136 18.052 25.516 61.808 1.00 0.00 C ATOM 2144 CD ARG A 136 17.803 26.941 62.305 1.00 0.00 C ATOM 2145 NE ARG A 136 18.992 27.721 61.849 1.00 0.00 N ATOM 2146 CZ ARG A 136 19.210 28.930 62.304 1.00 0.00 C ATOM 2147 NH1 ARG A 136 18.393 29.478 63.166 1.00 0.00 N ATOM 2148 NH2 ARG A 136 20.257 29.594 61.893 1.00 0.00 N ATOM 0 H ARG A 136 17.348 24.984 58.009 1.00 0.00 H new ATOM 0 HA ARG A 136 18.445 23.368 60.137 1.00 0.00 H new ATOM 0 HB2 ARG A 136 18.632 25.879 59.758 1.00 0.00 H new ATOM 0 HB3 ARG A 136 16.911 26.036 60.048 1.00 0.00 H new ATOM 0 HG2 ARG A 136 17.400 24.818 62.333 1.00 0.00 H new ATOM 0 HG3 ARG A 136 19.078 25.218 62.025 1.00 0.00 H new ATOM 0 HD2 ARG A 136 16.881 27.348 61.891 1.00 0.00 H new ATOM 0 HD3 ARG A 136 17.705 26.969 63.390 1.00 0.00 H new ATOM 0 HE ARG A 136 19.640 27.309 61.178 1.00 0.00 H new ATOM 0 HH11 ARG A 136 17.575 28.963 63.492 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.574 30.420 63.513 1.00 0.00 H new ATOM 0 HH21 ARG A 136 20.898 29.171 61.222 1.00 0.00 H new ATOM 0 HH22 ARG A 136 20.433 30.536 62.243 1.00 0.00 H new ATOM 2162 N ALA A 137 15.215 23.477 59.988 1.00 0.00 N ATOM 2163 CA ALA A 137 13.988 22.917 60.631 1.00 0.00 C ATOM 2164 C ALA A 137 13.909 21.395 60.437 1.00 0.00 C ATOM 2165 O ALA A 137 13.530 20.659 61.346 1.00 0.00 O ATOM 2166 CB ALA A 137 12.824 23.608 59.921 1.00 0.00 C ATOM 0 H ALA A 137 15.067 23.911 59.077 1.00 0.00 H new ATOM 0 HA ALA A 137 13.979 23.090 61.707 1.00 0.00 H new ATOM 0 HB1 ALA A 137 11.881 23.251 60.336 1.00 0.00 H new ATOM 0 HB2 ALA A 137 12.899 24.686 60.064 1.00 0.00 H new ATOM 0 HB3 ALA A 137 12.861 23.380 58.856 1.00 0.00 H new ATOM 2172 N ARG A 138 14.259 20.908 59.272 1.00 0.00 N ATOM 2173 CA ARG A 138 14.200 19.438 59.030 1.00 0.00 C ATOM 2174 C ARG A 138 15.474 18.791 59.539 1.00 0.00 C ATOM 2175 O ARG A 138 15.490 17.605 59.862 1.00 0.00 O ATOM 2176 CB ARG A 138 14.086 19.294 57.510 1.00 0.00 C ATOM 2177 CG ARG A 138 13.542 17.907 57.161 1.00 0.00 C ATOM 2178 CD ARG A 138 13.767 17.634 55.671 1.00 0.00 C ATOM 2179 NE ARG A 138 15.196 17.218 55.566 1.00 0.00 N ATOM 2180 CZ ARG A 138 15.660 16.693 54.458 1.00 0.00 C ATOM 2181 NH1 ARG A 138 14.882 16.522 53.420 1.00 0.00 N ATOM 2182 NH2 ARG A 138 16.913 16.337 54.389 1.00 0.00 N ATOM 0 H ARG A 138 14.582 21.466 58.481 1.00 0.00 H new ATOM 0 HA ARG A 138 13.367 18.956 59.542 1.00 0.00 H new ATOM 0 HB2 ARG A 138 13.426 20.065 57.111 1.00 0.00 H new ATOM 0 HB3 ARG A 138 15.062 19.439 57.047 1.00 0.00 H new ATOM 0 HG2 ARG A 138 14.042 17.146 57.761 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.479 17.851 57.396 1.00 0.00 H new ATOM 0 HD2 ARG A 138 13.101 16.852 55.308 1.00 0.00 H new ATOM 0 HD3 ARG A 138 13.570 18.523 55.073 1.00 0.00 H new ATOM 0 HE ARG A 138 15.818 17.343 56.364 1.00 0.00 H new ATOM 0 HH11 ARG A 138 13.901 16.798 53.467 1.00 0.00 H new ATOM 0 HH12 ARG A 138 15.256 16.112 52.564 1.00 0.00 H new ATOM 0 HH21 ARG A 138 17.525 16.468 55.194 1.00 0.00 H new ATOM 0 HH22 ARG A 138 17.280 15.928 53.530 1.00 0.00 H new ATOM 2196 N ARG A 139 16.544 19.528 59.650 1.00 0.00 N ATOM 2197 CA ARG A 139 17.797 18.919 60.176 1.00 0.00 C ATOM 2198 C ARG A 139 18.278 19.695 61.405 1.00 0.00 C ATOM 2199 O ARG A 139 19.322 19.344 61.932 1.00 0.00 O ATOM 2200 CB ARG A 139 18.821 19.016 59.047 1.00 0.00 C ATOM 2201 CG ARG A 139 19.794 17.842 59.163 1.00 0.00 C ATOM 2202 CD ARG A 139 21.168 18.253 58.630 1.00 0.00 C ATOM 2203 NE ARG A 139 22.087 17.158 59.061 1.00 0.00 N ATOM 2204 CZ ARG A 139 22.400 17.001 60.328 1.00 0.00 C ATOM 2205 NH1 ARG A 139 21.914 17.801 61.243 1.00 0.00 N ATOM 2206 NH2 ARG A 139 23.205 16.037 60.679 1.00 0.00 N ATOM 2207 OXT ARG A 139 17.595 20.626 61.798 1.00 0.00 O ATOM 0 H ARG A 139 16.605 20.516 59.402 1.00 0.00 H new ATOM 0 HA ARG A 139 17.646 17.884 60.482 1.00 0.00 H new ATOM 0 HB2 ARG A 139 18.319 18.996 58.080 1.00 0.00 H new ATOM 0 HB3 ARG A 139 19.361 19.961 59.107 1.00 0.00 H new ATOM 0 HG2 ARG A 139 19.877 17.528 60.203 1.00 0.00 H new ATOM 0 HG3 ARG A 139 19.416 16.988 58.601 1.00 0.00 H new ATOM 0 HD2 ARG A 139 21.157 18.356 57.545 1.00 0.00 H new ATOM 0 HD3 ARG A 139 21.479 19.215 59.038 1.00 0.00 H new ATOM 0 HE ARG A 139 22.477 16.524 58.364 1.00 0.00 H new ATOM 0 HH11 ARG A 139 21.284 18.558 60.976 1.00 0.00 H new ATOM 0 HH12 ARG A 139 22.165 17.668 62.223 1.00 0.00 H new ATOM 0 HH21 ARG A 139 23.588 15.410 59.972 1.00 0.00 H new ATOM 0 HH22 ARG A 139 23.451 15.910 61.661 1.00 0.00 H new