USER MOD reduce.3.24.130724 H: found=0, std=0, add=1040, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1034 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 HIS : no HD1:sc= -9.48! C(o=-11!,f=-21!) USER MOD Set 1.2: A 132 GLN : amide:sc= -1.78 K(o=-11,f=-18!) USER MOD Set 2.1: A 42 CYS SG : rot 72:sc= 0.393 USER MOD Set 2.2: A 69 CYS SG : rot -132:sc= -0.601 USER MOD Set 2.3: A 72 CYS SG : rot -80:sc= -0.487 USER MOD Single : A 8 THR OG1 : rot 37:sc= 0.497 USER MOD Single : A 11 GLN : amide:sc= -0.818 K(o=-0.82,f=-5.7!) USER MOD Single : A 14 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.016) USER MOD Single : A 15 SER OG : rot -141:sc= -3.79! USER MOD Single : A 22 ASN :FLIP amide:sc= -0.607 F(o=-1.8!,f=-0.61) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -27:sc= 0.555 USER MOD Single : A 41 SER OG : rot -142:sc= 0.368 USER MOD Single : A 46 HIS :FLIP no HE2:sc= -4.03! C(o=-6.5!,f=-4!) USER MOD Single : A 51 ASN : amide:sc= -2.86 X(o=-2.9,f=-2.9) USER MOD Single : A 53 SER OG : rot 180:sc= -0.46 USER MOD Single : A 55 TYR OH : rot 120:sc= -0.423 USER MOD Single : A 57 ASN : amide:sc= -4.27! C(o=-4.3!,f=-17!) 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= -1.8 K(o=-1.8,f=-5.5!) USER MOD Single : A 76 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.2) USER MOD Single : A 78 ASN : amide:sc= -12.9! C(o=-13!,f=-17!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 82 HIS : no HD1:sc= -0.595 X(o=-0.59,f=-0.62) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0343 USER MOD Single : A 89 HIS : no HE2:sc= -2.28! C(o=-2.3!,f=-4.9!) USER MOD Single : A 91 CYS SG : rot 120:sc= -3.83! USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 105:sc= -13.2! USER MOD Single : A 108 GLN : amide:sc= -0.0325 K(o=-0.033,f=-0.7) USER MOD Single : A 111 MET CE :methyl 144:sc= -12.5! (180deg=-14.9!) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HE2:sc= -0.0678 K(o=-0.068,f=-1.4) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.0373 USER MOD Single : A 124 THR OG1 : rot 170:sc= 0 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 127 THR OG1 : rot -53:sc= -0.699! USER MOD Single : A 129 LYS NZ :NH3+ -117:sc= 2.08 (180deg=-0.512) USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 118 N THR A 8 6.403 15.401 19.946 1.00 0.00 N ATOM 119 CA THR A 8 5.539 16.526 19.579 1.00 0.00 C ATOM 120 C THR A 8 6.366 17.800 19.477 1.00 0.00 C ATOM 121 O THR A 8 6.142 18.748 20.222 1.00 0.00 O ATOM 122 CB THR A 8 4.546 16.620 20.737 1.00 0.00 C ATOM 123 OG1 THR A 8 3.996 15.334 20.991 1.00 0.00 O ATOM 124 CG2 THR A 8 3.423 17.595 20.392 1.00 0.00 C ATOM 0 HA THR A 8 5.045 16.392 18.617 1.00 0.00 H new ATOM 0 HB THR A 8 5.067 16.981 21.624 1.00 0.00 H new ATOM 0 HG1 THR A 8 4.686 14.651 20.856 1.00 0.00 H new ATOM 0 HG21 THR A 8 2.723 17.653 21.225 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.844 18.582 20.203 1.00 0.00 H new ATOM 0 HG23 THR A 8 2.900 17.247 19.501 1.00 0.00 H new ATOM 132 N ASP A 9 7.302 17.857 18.553 1.00 0.00 N ATOM 133 CA ASP A 9 8.127 19.107 18.400 1.00 0.00 C ATOM 134 C ASP A 9 7.206 20.319 18.430 1.00 0.00 C ATOM 135 O ASP A 9 7.576 21.395 18.900 1.00 0.00 O ATOM 136 CB ASP A 9 8.821 19.010 17.040 1.00 0.00 C ATOM 137 CG ASP A 9 7.796 18.662 15.958 1.00 0.00 C ATOM 138 OD1 ASP A 9 7.427 17.502 15.871 1.00 0.00 O ATOM 139 OD2 ASP A 9 7.397 19.560 15.235 1.00 0.00 O ATOM 0 H ASP A 9 7.529 17.103 17.905 1.00 0.00 H new ATOM 0 HA ASP A 9 8.858 19.209 19.202 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.308 19.956 16.802 1.00 0.00 H new ATOM 0 HB3 ASP A 9 9.601 18.249 17.073 1.00 0.00 H new ATOM 144 N ASP A 10 5.991 20.155 17.974 1.00 0.00 N ATOM 145 CA ASP A 10 5.030 21.257 18.013 1.00 0.00 C ATOM 146 C ASP A 10 4.938 21.744 19.451 1.00 0.00 C ATOM 147 O ASP A 10 4.993 22.945 19.732 1.00 0.00 O ATOM 148 CB ASP A 10 3.730 20.613 17.555 1.00 0.00 C ATOM 149 CG ASP A 10 3.721 20.503 16.030 1.00 0.00 C ATOM 150 OD1 ASP A 10 3.576 21.527 15.381 1.00 0.00 O ATOM 151 OD2 ASP A 10 3.856 19.396 15.535 1.00 0.00 O ATOM 0 H ASP A 10 5.635 19.287 17.574 1.00 0.00 H new ATOM 0 HA ASP A 10 5.289 22.116 17.394 1.00 0.00 H new ATOM 0 HB2 ASP A 10 3.625 19.624 18.002 1.00 0.00 H new ATOM 0 HB3 ASP A 10 2.880 21.207 17.892 1.00 0.00 H new ATOM 156 N GLN A 11 4.849 20.834 20.385 1.00 0.00 N ATOM 157 CA GLN A 11 4.808 21.286 21.785 1.00 0.00 C ATOM 158 C GLN A 11 6.219 21.586 22.258 1.00 0.00 C ATOM 159 O GLN A 11 6.404 22.434 23.120 1.00 0.00 O ATOM 160 CB GLN A 11 4.187 20.199 22.632 1.00 0.00 C ATOM 161 CG GLN A 11 4.002 20.795 24.024 1.00 0.00 C ATOM 162 CD GLN A 11 2.510 20.906 24.348 1.00 0.00 C ATOM 163 OE1 GLN A 11 2.010 21.990 24.638 1.00 0.00 O ATOM 164 NE2 GLN A 11 1.767 19.834 24.314 1.00 0.00 N ATOM 0 H GLN A 11 4.805 19.826 20.236 1.00 0.00 H new ATOM 0 HA GLN A 11 4.210 22.193 21.872 1.00 0.00 H new ATOM 0 HB2 GLN A 11 3.232 19.880 22.216 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.829 19.319 22.668 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.499 20.170 24.766 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.468 21.779 24.073 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.181 18.934 24.073 1.00 0.00 H new ATOM 0 HE22 GLN A 11 0.772 19.896 24.528 1.00 0.00 H new ATOM 173 N ARG A 12 7.239 20.971 21.687 1.00 0.00 N ATOM 174 CA ARG A 12 8.606 21.350 22.111 1.00 0.00 C ATOM 175 C ARG A 12 8.671 22.844 21.917 1.00 0.00 C ATOM 176 O ARG A 12 9.143 23.589 22.769 1.00 0.00 O ATOM 177 CB ARG A 12 9.593 20.658 21.171 1.00 0.00 C ATOM 178 CG ARG A 12 9.821 19.196 21.586 1.00 0.00 C ATOM 179 CD ARG A 12 8.517 18.415 21.541 1.00 0.00 C ATOM 180 NE ARG A 12 7.990 18.454 22.935 1.00 0.00 N ATOM 181 CZ ARG A 12 8.558 17.752 23.885 1.00 0.00 C ATOM 182 NH1 ARG A 12 9.599 17.001 23.630 1.00 0.00 N ATOM 183 NH2 ARG A 12 8.082 17.801 25.097 1.00 0.00 N ATOM 0 H ARG A 12 7.175 20.248 20.970 1.00 0.00 H new ATOM 0 HA ARG A 12 8.840 21.069 23.138 1.00 0.00 H new ATOM 0 HB2 ARG A 12 9.214 20.694 20.150 1.00 0.00 H new ATOM 0 HB3 ARG A 12 10.542 21.193 21.178 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.551 18.734 20.921 1.00 0.00 H new ATOM 0 HG3 ARG A 12 10.238 19.159 22.592 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.813 18.865 20.841 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.683 17.389 21.211 1.00 0.00 H new ATOM 0 HE ARG A 12 7.179 19.033 23.152 1.00 0.00 H new ATOM 0 HH11 ARG A 12 9.977 16.957 22.684 1.00 0.00 H new ATOM 0 HH12 ARG A 12 10.032 16.459 24.378 1.00 0.00 H new ATOM 0 HH21 ARG A 12 7.271 18.384 25.303 1.00 0.00 H new ATOM 0 HH22 ARG A 12 8.521 17.256 25.840 1.00 0.00 H new ATOM 197 N TRP A 13 8.129 23.296 20.813 1.00 0.00 N ATOM 198 CA TRP A 13 8.094 24.739 20.570 1.00 0.00 C ATOM 199 C TRP A 13 7.247 25.385 21.650 1.00 0.00 C ATOM 200 O TRP A 13 7.597 26.431 22.191 1.00 0.00 O ATOM 201 CB TRP A 13 7.420 24.948 19.221 1.00 0.00 C ATOM 202 CG TRP A 13 7.456 26.411 18.931 1.00 0.00 C ATOM 203 CD1 TRP A 13 6.393 27.178 18.599 1.00 0.00 C ATOM 204 CD2 TRP A 13 8.597 27.303 18.998 1.00 0.00 C ATOM 205 NE1 TRP A 13 6.817 28.485 18.447 1.00 0.00 N ATOM 206 CE2 TRP A 13 8.170 28.612 18.686 1.00 0.00 C ATOM 207 CE3 TRP A 13 9.951 27.096 19.294 1.00 0.00 C ATOM 208 CZ2 TRP A 13 9.060 29.686 18.674 1.00 0.00 C ATOM 209 CZ3 TRP A 13 10.851 28.169 19.282 1.00 0.00 C ATOM 210 CH2 TRP A 13 10.410 29.465 18.976 1.00 0.00 C ATOM 0 H TRP A 13 7.715 22.717 20.082 1.00 0.00 H new ATOM 0 HA TRP A 13 9.094 25.172 20.578 1.00 0.00 H new ATOM 0 HB2 TRP A 13 7.938 24.389 18.442 1.00 0.00 H new ATOM 0 HB3 TRP A 13 6.392 24.586 19.244 1.00 0.00 H new ATOM 0 HD1 TRP A 13 5.379 26.827 18.473 1.00 0.00 H new ATOM 0 HE1 TRP A 13 6.205 29.260 18.190 1.00 0.00 H new ATOM 0 HE3 TRP A 13 10.303 26.103 19.533 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 8.711 30.680 18.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 11.893 27.997 19.510 1.00 0.00 H new ATOM 0 HH2 TRP A 13 11.108 30.289 18.973 1.00 0.00 H new ATOM 221 N GLN A 14 6.145 24.765 22.013 1.00 0.00 N ATOM 222 CA GLN A 14 5.325 25.364 23.095 1.00 0.00 C ATOM 223 C GLN A 14 6.194 25.403 24.349 1.00 0.00 C ATOM 224 O GLN A 14 6.099 26.309 25.163 1.00 0.00 O ATOM 225 CB GLN A 14 4.113 24.438 23.262 1.00 0.00 C ATOM 226 CG GLN A 14 3.334 24.815 24.529 1.00 0.00 C ATOM 227 CD GLN A 14 2.024 25.509 24.144 1.00 0.00 C ATOM 228 OE1 GLN A 14 0.983 25.255 24.744 1.00 0.00 O ATOM 229 NE2 GLN A 14 2.021 26.378 23.170 1.00 0.00 N ATOM 0 H GLN A 14 5.793 23.895 21.614 1.00 0.00 H new ATOM 0 HA GLN A 14 4.982 26.378 22.887 1.00 0.00 H new ATOM 0 HB2 GLN A 14 3.464 24.515 22.390 1.00 0.00 H new ATOM 0 HB3 GLN A 14 4.443 23.401 23.323 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.124 23.922 25.117 1.00 0.00 H new ATOM 0 HG3 GLN A 14 3.936 25.474 25.154 1.00 0.00 H new ATOM 0 HE21 GLN A 14 2.886 26.589 22.672 1.00 0.00 H new ATOM 0 HE22 GLN A 14 1.154 26.846 22.907 1.00 0.00 H new ATOM 238 N SER A 15 7.082 24.453 24.478 1.00 0.00 N ATOM 239 CA SER A 15 8.011 24.433 25.633 1.00 0.00 C ATOM 240 C SER A 15 9.009 25.570 25.462 1.00 0.00 C ATOM 241 O SER A 15 9.500 26.164 26.425 1.00 0.00 O ATOM 242 CB SER A 15 8.713 23.072 25.557 1.00 0.00 C ATOM 243 OG SER A 15 10.119 23.251 25.652 1.00 0.00 O ATOM 0 H SER A 15 7.200 23.682 23.820 1.00 0.00 H new ATOM 0 HA SER A 15 7.514 24.563 26.594 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.364 22.427 26.363 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.463 22.575 24.620 1.00 0.00 H new ATOM 0 HG SER A 15 10.570 22.634 25.038 1.00 0.00 H new ATOM 249 N VAL A 16 9.312 25.873 24.235 1.00 0.00 N ATOM 250 CA VAL A 16 10.287 26.944 23.945 1.00 0.00 C ATOM 251 C VAL A 16 9.708 28.305 24.202 1.00 0.00 C ATOM 252 O VAL A 16 10.386 29.236 24.633 1.00 0.00 O ATOM 253 CB VAL A 16 10.633 26.776 22.470 1.00 0.00 C ATOM 254 CG1 VAL A 16 11.690 27.788 22.083 1.00 0.00 C ATOM 255 CG2 VAL A 16 11.179 25.375 22.216 1.00 0.00 C ATOM 0 H VAL A 16 8.918 25.416 23.413 1.00 0.00 H new ATOM 0 HA VAL A 16 11.164 26.868 24.588 1.00 0.00 H new ATOM 0 HB VAL A 16 9.731 26.928 21.877 1.00 0.00 H new ATOM 0 HG11 VAL A 16 11.939 27.669 21.028 1.00 0.00 H new ATOM 0 HG12 VAL A 16 11.310 28.795 22.255 1.00 0.00 H new ATOM 0 HG13 VAL A 16 12.584 27.630 22.687 1.00 0.00 H new ATOM 0 HG21 VAL A 16 11.423 25.266 21.159 1.00 0.00 H new ATOM 0 HG22 VAL A 16 12.077 25.221 22.814 1.00 0.00 H new ATOM 0 HG23 VAL A 16 10.427 24.636 22.493 1.00 0.00 H new ATOM 265 N LEU A 17 8.482 28.429 23.934 1.00 0.00 N ATOM 266 CA LEU A 17 7.802 29.707 24.129 1.00 0.00 C ATOM 267 C LEU A 17 7.232 29.757 25.536 1.00 0.00 C ATOM 268 O LEU A 17 7.140 30.806 26.170 1.00 0.00 O ATOM 269 CB LEU A 17 6.701 29.643 23.096 1.00 0.00 C ATOM 270 CG LEU A 17 7.268 29.372 21.686 1.00 0.00 C ATOM 271 CD1 LEU A 17 6.430 30.127 20.670 1.00 0.00 C ATOM 272 CD2 LEU A 17 8.732 29.825 21.544 1.00 0.00 C ATOM 0 H LEU A 17 7.891 27.679 23.575 1.00 0.00 H new ATOM 0 HA LEU A 17 8.437 30.586 24.020 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.994 28.857 23.363 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.147 30.582 23.093 1.00 0.00 H new ATOM 0 HG LEU A 17 7.232 28.296 21.517 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.820 29.944 19.669 1.00 0.00 H new ATOM 0 HD12 LEU A 17 5.396 29.785 20.725 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.471 31.195 20.886 1.00 0.00 H new ATOM 0 HD21 LEU A 17 9.082 29.612 20.534 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.801 30.896 21.734 1.00 0.00 H new ATOM 0 HD23 LEU A 17 9.350 29.288 22.263 1.00 0.00 H new ATOM 284 N ALA A 18 6.855 28.620 26.021 1.00 0.00 N ATOM 285 CA ALA A 18 6.283 28.532 27.394 1.00 0.00 C ATOM 286 C ALA A 18 7.389 28.536 28.450 1.00 0.00 C ATOM 287 O ALA A 18 7.119 28.692 29.639 1.00 0.00 O ATOM 288 CB ALA A 18 5.521 27.209 27.451 1.00 0.00 C ATOM 0 H ALA A 18 6.917 27.731 25.524 1.00 0.00 H new ATOM 0 HA ALA A 18 5.637 29.386 27.600 1.00 0.00 H new ATOM 0 HB1 ALA A 18 5.077 27.087 28.439 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.734 27.210 26.697 1.00 0.00 H new ATOM 0 HB3 ALA A 18 6.208 26.385 27.258 1.00 0.00 H new ATOM 294 N ARG A 19 8.629 28.351 28.054 1.00 0.00 N ATOM 295 CA ARG A 19 9.737 28.328 29.046 1.00 0.00 C ATOM 296 C ARG A 19 9.619 27.088 29.911 1.00 0.00 C ATOM 297 O ARG A 19 9.837 27.121 31.118 1.00 0.00 O ATOM 298 CB ARG A 19 9.618 29.608 29.880 1.00 0.00 C ATOM 299 CG ARG A 19 9.175 30.783 29.000 1.00 0.00 C ATOM 300 CD ARG A 19 9.775 32.084 29.543 1.00 0.00 C ATOM 301 NE ARG A 19 9.075 33.178 28.803 1.00 0.00 N ATOM 302 CZ ARG A 19 9.272 34.433 29.126 1.00 0.00 C ATOM 303 NH1 ARG A 19 10.084 34.751 30.103 1.00 0.00 N ATOM 304 NH2 ARG A 19 8.652 35.374 28.468 1.00 0.00 N ATOM 0 H ARG A 19 8.914 28.216 27.084 1.00 0.00 H new ATOM 0 HA ARG A 19 10.712 28.292 28.561 1.00 0.00 H new ATOM 0 HB2 ARG A 19 8.900 29.458 30.686 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.577 29.836 30.346 1.00 0.00 H new ATOM 0 HG2 ARG A 19 9.498 30.623 27.971 1.00 0.00 H new ATOM 0 HG3 ARG A 19 8.087 30.850 28.985 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.617 32.172 30.618 1.00 0.00 H new ATOM 0 HD3 ARG A 19 10.851 32.121 29.375 1.00 0.00 H new ATOM 0 HE ARG A 19 8.439 32.946 28.040 1.00 0.00 H new ATOM 0 HH11 ARG A 19 10.570 34.019 30.621 1.00 0.00 H new ATOM 0 HH12 ARG A 19 10.230 35.731 30.346 1.00 0.00 H new ATOM 0 HH21 ARG A 19 8.018 35.131 27.707 1.00 0.00 H new ATOM 0 HH22 ARG A 19 8.801 36.352 28.715 1.00 0.00 H new ATOM 318 N ASP A 20 9.296 25.987 29.297 1.00 0.00 N ATOM 319 CA ASP A 20 9.179 24.719 30.052 1.00 0.00 C ATOM 320 C ASP A 20 10.576 24.261 30.493 1.00 0.00 C ATOM 321 O ASP A 20 11.385 23.844 29.668 1.00 0.00 O ATOM 322 CB ASP A 20 8.567 23.727 29.060 1.00 0.00 C ATOM 323 CG ASP A 20 8.409 22.362 29.729 1.00 0.00 C ATOM 324 OD1 ASP A 20 7.905 22.321 30.840 1.00 0.00 O ATOM 325 OD2 ASP A 20 8.794 21.378 29.117 1.00 0.00 O ATOM 0 H ASP A 20 9.107 25.914 28.297 1.00 0.00 H new ATOM 0 HA ASP A 20 8.570 24.812 30.951 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.598 24.090 28.719 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.203 23.640 28.179 1.00 0.00 H new ATOM 330 N PRO A 21 10.822 24.340 31.776 1.00 0.00 N ATOM 331 CA PRO A 21 12.133 23.916 32.333 1.00 0.00 C ATOM 332 C PRO A 21 12.266 22.391 32.264 1.00 0.00 C ATOM 333 O PRO A 21 13.210 21.807 32.792 1.00 0.00 O ATOM 334 CB PRO A 21 12.086 24.397 33.781 1.00 0.00 C ATOM 335 CG PRO A 21 10.632 24.479 34.110 1.00 0.00 C ATOM 336 CD PRO A 21 9.914 24.818 32.831 1.00 0.00 C ATOM 0 HA PRO A 21 12.985 24.323 31.788 1.00 0.00 H new ATOM 0 HB2 PRO A 21 12.603 23.704 34.445 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.572 25.367 33.891 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.274 23.533 34.515 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.450 25.240 34.869 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.943 24.325 32.776 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.733 25.890 32.747 1.00 0.00 H new ATOM 344 N ASN A 22 11.321 21.736 31.642 1.00 0.00 N ATOM 345 CA ASN A 22 11.345 20.267 31.544 1.00 0.00 C ATOM 346 C ASN A 22 11.764 19.865 30.147 1.00 0.00 C ATOM 347 O ASN A 22 12.112 18.716 29.876 1.00 0.00 O ATOM 348 CB ASN A 22 9.891 19.933 31.769 1.00 0.00 C ATOM 349 CG ASN A 22 9.641 18.471 31.451 1.00 0.00 C ATOM 350 OD1 ASN A 22 9.529 18.129 30.203 1.00 0.00 O flip ATOM 351 ND2 ASN A 22 9.546 17.630 32.341 1.00 0.00 N flip ATOM 0 H ASN A 22 10.520 22.178 31.191 1.00 0.00 H new ATOM 0 HA ASN A 22 12.029 19.770 32.232 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.617 20.141 32.803 1.00 0.00 H new ATOM 0 HB3 ASN A 22 9.263 20.563 31.140 1.00 0.00 H new ATOM 0 HD21 ASN A 22 9.636 17.909 33.318 1.00 0.00 H new ATOM 0 HD22 ASN A 22 9.378 16.653 32.103 1.00 0.00 H new ATOM 358 N ALA A 23 11.789 20.813 29.274 1.00 0.00 N ATOM 359 CA ALA A 23 12.247 20.533 27.898 1.00 0.00 C ATOM 360 C ALA A 23 13.588 21.220 27.703 1.00 0.00 C ATOM 361 O ALA A 23 14.271 21.058 26.688 1.00 0.00 O ATOM 362 CB ALA A 23 11.210 21.151 26.977 1.00 0.00 C ATOM 0 H ALA A 23 11.511 21.778 29.452 1.00 0.00 H new ATOM 0 HA ALA A 23 12.359 19.467 27.698 1.00 0.00 H new ATOM 0 HB1 ALA A 23 11.495 20.976 25.939 1.00 0.00 H new ATOM 0 HB2 ALA A 23 10.237 20.697 27.168 1.00 0.00 H new ATOM 0 HB3 ALA A 23 11.152 22.224 27.162 1.00 0.00 H new ATOM 368 N ASP A 24 13.975 21.975 28.689 1.00 0.00 N ATOM 369 CA ASP A 24 15.254 22.687 28.648 1.00 0.00 C ATOM 370 C ASP A 24 16.316 21.646 28.945 1.00 0.00 C ATOM 371 O ASP A 24 16.231 20.975 29.943 1.00 0.00 O ATOM 372 CB ASP A 24 15.090 23.707 29.791 1.00 0.00 C ATOM 373 CG ASP A 24 16.045 24.885 29.643 1.00 0.00 C ATOM 374 OD1 ASP A 24 16.623 25.024 28.590 1.00 0.00 O ATOM 375 OD2 ASP A 24 16.167 25.643 30.592 1.00 0.00 O ATOM 0 H ASP A 24 13.434 22.125 29.541 1.00 0.00 H new ATOM 0 HA ASP A 24 15.524 23.181 27.714 1.00 0.00 H new ATOM 0 HB2 ASP A 24 14.063 24.072 29.807 1.00 0.00 H new ATOM 0 HB3 ASP A 24 15.268 23.213 30.746 1.00 0.00 H new ATOM 380 N GLY A 25 17.277 21.457 28.088 1.00 0.00 N ATOM 381 CA GLY A 25 18.308 20.384 28.341 1.00 0.00 C ATOM 382 C GLY A 25 17.927 19.184 27.475 1.00 0.00 C ATOM 383 O GLY A 25 18.781 18.471 26.949 1.00 0.00 O ATOM 0 H GLY A 25 17.403 21.988 27.226 1.00 0.00 H new ATOM 0 HA2 GLY A 25 19.306 20.741 28.087 1.00 0.00 H new ATOM 0 HA3 GLY A 25 18.327 20.108 29.395 1.00 0.00 H new ATOM 387 N GLU A 26 16.646 18.970 27.300 1.00 0.00 N ATOM 388 CA GLU A 26 16.170 17.853 26.456 1.00 0.00 C ATOM 389 C GLU A 26 16.345 18.236 24.983 1.00 0.00 C ATOM 390 O GLU A 26 16.778 17.432 24.164 1.00 0.00 O ATOM 391 CB GLU A 26 14.691 17.681 26.811 1.00 0.00 C ATOM 392 CG GLU A 26 14.218 16.284 26.400 1.00 0.00 C ATOM 393 CD GLU A 26 14.819 15.240 27.346 1.00 0.00 C ATOM 394 OE1 GLU A 26 14.857 15.501 28.537 1.00 0.00 O ATOM 395 OE2 GLU A 26 15.230 14.198 26.863 1.00 0.00 O ATOM 0 H GLU A 26 15.906 19.536 27.716 1.00 0.00 H new ATOM 0 HA GLU A 26 16.720 16.926 26.621 1.00 0.00 H new ATOM 0 HB2 GLU A 26 14.546 17.824 27.882 1.00 0.00 H new ATOM 0 HB3 GLU A 26 14.095 18.440 26.304 1.00 0.00 H new ATOM 0 HG2 GLU A 26 13.130 16.234 26.431 1.00 0.00 H new ATOM 0 HG3 GLU A 26 14.518 16.075 25.373 1.00 0.00 H new ATOM 402 N PHE A 27 16.038 19.465 24.641 1.00 0.00 N ATOM 403 CA PHE A 27 16.219 19.915 23.226 1.00 0.00 C ATOM 404 C PHE A 27 16.533 21.400 23.170 1.00 0.00 C ATOM 405 O PHE A 27 16.405 22.136 24.146 1.00 0.00 O ATOM 406 CB PHE A 27 14.906 19.646 22.478 1.00 0.00 C ATOM 407 CG PHE A 27 13.838 20.682 22.812 1.00 0.00 C ATOM 408 CD1 PHE A 27 13.914 21.994 22.302 1.00 0.00 C ATOM 409 CD2 PHE A 27 12.757 20.317 23.616 1.00 0.00 C ATOM 410 CE1 PHE A 27 12.904 22.921 22.606 1.00 0.00 C ATOM 411 CE2 PHE A 27 11.750 21.247 23.920 1.00 0.00 C ATOM 412 CZ PHE A 27 11.824 22.544 23.415 1.00 0.00 C ATOM 0 H PHE A 27 15.672 20.172 25.278 1.00 0.00 H new ATOM 0 HA PHE A 27 17.049 19.374 22.771 1.00 0.00 H new ATOM 0 HB2 PHE A 27 15.093 19.650 21.404 1.00 0.00 H new ATOM 0 HB3 PHE A 27 14.540 18.652 22.734 1.00 0.00 H new ATOM 0 HD1 PHE A 27 14.747 22.285 21.679 1.00 0.00 H new ATOM 0 HD2 PHE A 27 12.695 19.312 24.007 1.00 0.00 H new ATOM 0 HE1 PHE A 27 12.960 23.926 22.215 1.00 0.00 H new ATOM 0 HE2 PHE A 27 10.918 20.957 24.545 1.00 0.00 H new ATOM 0 HZ PHE A 27 11.048 23.259 23.647 1.00 0.00 H new ATOM 422 N VAL A 28 16.896 21.842 22.016 1.00 0.00 N ATOM 423 CA VAL A 28 17.184 23.279 21.803 1.00 0.00 C ATOM 424 C VAL A 28 16.400 23.712 20.600 1.00 0.00 C ATOM 425 O VAL A 28 15.801 22.890 19.912 1.00 0.00 O ATOM 426 CB VAL A 28 18.681 23.412 21.507 1.00 0.00 C ATOM 427 CG1 VAL A 28 19.395 22.139 21.904 1.00 0.00 C ATOM 428 CG2 VAL A 28 18.921 23.628 20.022 1.00 0.00 C ATOM 0 H VAL A 28 17.010 21.258 21.188 1.00 0.00 H new ATOM 0 HA VAL A 28 16.919 23.884 22.670 1.00 0.00 H new ATOM 0 HB VAL A 28 19.058 24.264 22.072 1.00 0.00 H new ATOM 0 HG11 VAL A 28 20.460 22.238 21.692 1.00 0.00 H new ATOM 0 HG12 VAL A 28 19.252 21.959 22.970 1.00 0.00 H new ATOM 0 HG13 VAL A 28 18.988 21.302 21.337 1.00 0.00 H new ATOM 0 HG21 VAL A 28 19.991 23.720 19.836 1.00 0.00 H new ATOM 0 HG22 VAL A 28 18.527 22.780 19.463 1.00 0.00 H new ATOM 0 HG23 VAL A 28 18.418 24.540 19.701 1.00 0.00 H new ATOM 438 N PHE A 29 16.442 24.951 20.285 1.00 0.00 N ATOM 439 CA PHE A 29 15.743 25.375 19.068 1.00 0.00 C ATOM 440 C PHE A 29 16.610 26.360 18.323 1.00 0.00 C ATOM 441 O PHE A 29 17.035 27.386 18.844 1.00 0.00 O ATOM 442 CB PHE A 29 14.371 25.899 19.487 1.00 0.00 C ATOM 443 CG PHE A 29 14.316 27.415 19.651 1.00 0.00 C ATOM 444 CD1 PHE A 29 14.096 28.239 18.538 1.00 0.00 C ATOM 445 CD2 PHE A 29 14.402 27.987 20.929 1.00 0.00 C ATOM 446 CE1 PHE A 29 13.974 29.631 18.705 1.00 0.00 C ATOM 447 CE2 PHE A 29 14.268 29.376 21.090 1.00 0.00 C ATOM 448 CZ PHE A 29 14.055 30.194 19.981 1.00 0.00 C ATOM 0 H PHE A 29 16.922 25.684 20.807 1.00 0.00 H new ATOM 0 HA PHE A 29 15.567 24.561 18.365 1.00 0.00 H new ATOM 0 HB2 PHE A 29 13.634 25.596 18.743 1.00 0.00 H new ATOM 0 HB3 PHE A 29 14.085 25.430 20.429 1.00 0.00 H new ATOM 0 HD1 PHE A 29 14.020 27.805 17.552 1.00 0.00 H new ATOM 0 HD2 PHE A 29 14.572 27.358 21.791 1.00 0.00 H new ATOM 0 HE1 PHE A 29 13.817 30.265 17.845 1.00 0.00 H new ATOM 0 HE2 PHE A 29 14.330 29.812 22.076 1.00 0.00 H new ATOM 0 HZ PHE A 29 13.953 31.262 20.108 1.00 0.00 H new ATOM 458 N ALA A 30 16.936 25.994 17.128 1.00 0.00 N ATOM 459 CA ALA A 30 17.866 26.815 16.306 1.00 0.00 C ATOM 460 C ALA A 30 17.152 27.727 15.323 1.00 0.00 C ATOM 461 O ALA A 30 16.544 27.284 14.351 1.00 0.00 O ATOM 462 CB ALA A 30 18.709 25.796 15.545 1.00 0.00 C ATOM 0 H ALA A 30 16.595 25.148 16.672 1.00 0.00 H new ATOM 0 HA ALA A 30 18.449 27.480 16.943 1.00 0.00 H new ATOM 0 HB1 ALA A 30 19.426 26.318 14.911 1.00 0.00 H new ATOM 0 HB2 ALA A 30 19.244 25.165 16.254 1.00 0.00 H new ATOM 0 HB3 ALA A 30 18.060 25.177 14.926 1.00 0.00 H new ATOM 468 N VAL A 31 17.266 28.999 15.543 1.00 0.00 N ATOM 469 CA VAL A 31 16.660 29.980 14.618 1.00 0.00 C ATOM 470 C VAL A 31 17.696 30.266 13.520 1.00 0.00 C ATOM 471 O VAL A 31 18.676 30.988 13.734 1.00 0.00 O ATOM 472 CB VAL A 31 16.412 31.227 15.466 1.00 0.00 C ATOM 473 CG1 VAL A 31 15.358 32.097 14.799 1.00 0.00 C ATOM 474 CG2 VAL A 31 15.919 30.830 16.851 1.00 0.00 C ATOM 0 H VAL A 31 17.761 29.406 16.337 1.00 0.00 H new ATOM 0 HA VAL A 31 15.736 29.641 14.151 1.00 0.00 H new ATOM 0 HB VAL A 31 17.347 31.779 15.558 1.00 0.00 H new ATOM 0 HG11 VAL A 31 15.183 32.986 15.405 1.00 0.00 H new ATOM 0 HG12 VAL A 31 15.705 32.395 13.810 1.00 0.00 H new ATOM 0 HG13 VAL A 31 14.429 31.534 14.703 1.00 0.00 H new ATOM 0 HG21 VAL A 31 15.746 31.726 17.446 1.00 0.00 H new ATOM 0 HG22 VAL A 31 14.988 30.270 16.759 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.670 30.209 17.340 1.00 0.00 H new ATOM 484 N ARG A 32 17.509 29.689 12.366 1.00 0.00 N ATOM 485 CA ARG A 32 18.467 29.879 11.237 1.00 0.00 C ATOM 486 C ARG A 32 18.501 31.331 10.782 1.00 0.00 C ATOM 487 O ARG A 32 19.438 31.788 10.132 1.00 0.00 O ATOM 488 CB ARG A 32 17.846 29.067 10.117 1.00 0.00 C ATOM 489 CG ARG A 32 18.183 27.585 10.283 1.00 0.00 C ATOM 490 CD ARG A 32 18.000 26.865 8.942 1.00 0.00 C ATOM 491 NE ARG A 32 16.561 27.050 8.593 1.00 0.00 N ATOM 492 CZ ARG A 32 16.122 26.759 7.393 1.00 0.00 C ATOM 493 NH1 ARG A 32 16.937 26.300 6.476 1.00 0.00 N ATOM 494 NH2 ARG A 32 14.860 26.928 7.107 1.00 0.00 N ATOM 0 H ARG A 32 16.718 29.082 12.152 1.00 0.00 H new ATOM 0 HA ARG A 32 19.481 29.592 11.514 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.764 29.203 10.117 1.00 0.00 H new ATOM 0 HB3 ARG A 32 18.212 29.424 9.154 1.00 0.00 H new ATOM 0 HG2 ARG A 32 19.210 27.472 10.632 1.00 0.00 H new ATOM 0 HG3 ARG A 32 17.538 27.137 11.039 1.00 0.00 H new ATOM 0 HD2 ARG A 32 18.649 27.289 8.176 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.253 25.808 9.025 1.00 0.00 H new ATOM 0 HE ARG A 32 15.913 27.406 9.295 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.925 26.166 6.693 1.00 0.00 H new ATOM 0 HH12 ARG A 32 16.584 26.077 5.545 1.00 0.00 H new ATOM 0 HH21 ARG A 32 14.220 27.285 7.816 1.00 0.00 H new ATOM 0 HH22 ARG A 32 14.514 26.703 6.174 1.00 0.00 H new ATOM 508 N THR A 33 17.482 32.048 11.114 1.00 0.00 N ATOM 509 CA THR A 33 17.400 33.480 10.717 1.00 0.00 C ATOM 510 C THR A 33 18.477 34.266 11.447 1.00 0.00 C ATOM 511 O THR A 33 19.012 35.251 10.943 1.00 0.00 O ATOM 512 CB THR A 33 15.999 33.931 11.150 1.00 0.00 C ATOM 513 OG1 THR A 33 15.634 35.098 10.427 1.00 0.00 O ATOM 514 CG2 THR A 33 15.972 34.237 12.652 1.00 0.00 C ATOM 0 H THR A 33 16.686 31.705 11.652 1.00 0.00 H new ATOM 0 HA THR A 33 17.555 33.637 9.650 1.00 0.00 H new ATOM 0 HB THR A 33 15.293 33.127 10.942 1.00 0.00 H new ATOM 0 HG1 THR A 33 14.738 35.386 10.701 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.970 34.555 12.941 1.00 0.00 H new ATOM 0 HG22 THR A 33 16.243 33.341 13.211 1.00 0.00 H new ATOM 0 HG23 THR A 33 16.683 35.032 12.874 1.00 0.00 H new ATOM 522 N THR A 34 18.800 33.841 12.632 1.00 0.00 N ATOM 523 CA THR A 34 19.849 34.558 13.415 1.00 0.00 C ATOM 524 C THR A 34 21.031 33.631 13.713 1.00 0.00 C ATOM 525 O THR A 34 21.962 33.999 14.425 1.00 0.00 O ATOM 526 CB THR A 34 19.155 34.993 14.706 1.00 0.00 C ATOM 527 OG1 THR A 34 20.084 35.675 15.536 1.00 0.00 O ATOM 528 CG2 THR A 34 18.610 33.773 15.445 1.00 0.00 C ATOM 0 H THR A 34 18.387 33.031 13.095 1.00 0.00 H new ATOM 0 HA THR A 34 20.258 35.408 12.869 1.00 0.00 H new ATOM 0 HB THR A 34 18.327 35.658 14.459 1.00 0.00 H new ATOM 0 HG1 THR A 34 20.991 35.358 15.341 1.00 0.00 H new ATOM 0 HG21 THR A 34 18.118 34.094 16.363 1.00 0.00 H new ATOM 0 HG22 THR A 34 17.892 33.254 14.810 1.00 0.00 H new ATOM 0 HG23 THR A 34 19.431 33.099 15.690 1.00 0.00 H new ATOM 536 N GLY A 35 21.018 32.440 13.175 1.00 0.00 N ATOM 537 CA GLY A 35 22.142 31.497 13.420 1.00 0.00 C ATOM 538 C GLY A 35 22.278 31.229 14.919 1.00 0.00 C ATOM 539 O GLY A 35 23.378 31.043 15.434 1.00 0.00 O ATOM 0 H GLY A 35 20.275 32.081 12.576 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.966 30.562 12.889 1.00 0.00 H new ATOM 0 HA3 GLY A 35 23.070 31.915 13.031 1.00 0.00 H new ATOM 543 N ILE A 36 21.181 31.195 15.630 1.00 0.00 N ATOM 544 CA ILE A 36 21.260 30.926 17.102 1.00 0.00 C ATOM 545 C ILE A 36 20.378 29.742 17.450 1.00 0.00 C ATOM 546 O ILE A 36 19.480 29.369 16.704 1.00 0.00 O ATOM 547 CB ILE A 36 20.680 32.166 17.802 1.00 0.00 C ATOM 548 CG1 ILE A 36 21.609 33.359 17.644 1.00 0.00 C ATOM 549 CG2 ILE A 36 20.488 31.900 19.315 1.00 0.00 C ATOM 550 CD1 ILE A 36 20.930 34.560 18.291 1.00 0.00 C ATOM 0 H ILE A 36 20.241 31.340 15.262 1.00 0.00 H new ATOM 0 HA ILE A 36 22.286 30.718 17.404 1.00 0.00 H new ATOM 0 HB ILE A 36 19.718 32.381 17.337 1.00 0.00 H new ATOM 0 HG12 ILE A 36 22.570 33.161 18.118 1.00 0.00 H new ATOM 0 HG13 ILE A 36 21.807 33.553 16.590 1.00 0.00 H new ATOM 0 HG21 ILE A 36 20.077 32.790 19.792 1.00 0.00 H new ATOM 0 HG22 ILE A 36 19.802 31.064 19.453 1.00 0.00 H new ATOM 0 HG23 ILE A 36 21.450 31.658 19.767 1.00 0.00 H new ATOM 0 HD11 ILE A 36 21.572 35.436 18.195 1.00 0.00 H new ATOM 0 HD12 ILE A 36 19.979 34.751 17.795 1.00 0.00 H new ATOM 0 HD13 ILE A 36 20.753 34.353 19.347 1.00 0.00 H new ATOM 562 N PHE A 37 20.572 29.204 18.606 1.00 0.00 N ATOM 563 CA PHE A 37 19.699 28.109 19.070 1.00 0.00 C ATOM 564 C PHE A 37 19.598 28.219 20.575 1.00 0.00 C ATOM 565 O PHE A 37 20.596 28.165 21.296 1.00 0.00 O ATOM 566 CB PHE A 37 20.313 26.780 18.613 1.00 0.00 C ATOM 567 CG PHE A 37 21.368 26.292 19.566 1.00 0.00 C ATOM 568 CD1 PHE A 37 20.982 25.651 20.745 1.00 0.00 C ATOM 569 CD2 PHE A 37 22.722 26.437 19.255 1.00 0.00 C ATOM 570 CE1 PHE A 37 21.941 25.152 21.615 1.00 0.00 C ATOM 571 CE2 PHE A 37 23.686 25.944 20.134 1.00 0.00 C ATOM 572 CZ PHE A 37 23.294 25.296 21.314 1.00 0.00 C ATOM 0 H PHE A 37 21.307 29.478 19.258 1.00 0.00 H new ATOM 0 HA PHE A 37 18.693 28.165 18.654 1.00 0.00 H new ATOM 0 HB2 PHE A 37 19.528 26.029 18.525 1.00 0.00 H new ATOM 0 HB3 PHE A 37 20.749 26.903 17.622 1.00 0.00 H new ATOM 0 HD1 PHE A 37 19.934 25.543 20.981 1.00 0.00 H new ATOM 0 HD2 PHE A 37 23.020 26.927 18.340 1.00 0.00 H new ATOM 0 HE1 PHE A 37 21.639 24.653 22.524 1.00 0.00 H new ATOM 0 HE2 PHE A 37 24.735 26.061 19.906 1.00 0.00 H new ATOM 0 HZ PHE A 37 24.041 24.908 21.990 1.00 0.00 H new ATOM 596 N ARG A 39 17.408 27.475 24.377 1.00 0.00 N ATOM 597 CA ARG A 39 16.699 26.430 25.081 1.00 0.00 C ATOM 598 C ARG A 39 15.219 26.762 24.967 1.00 0.00 C ATOM 599 O ARG A 39 14.865 27.835 24.484 1.00 0.00 O ATOM 600 CB ARG A 39 17.203 26.600 26.495 1.00 0.00 C ATOM 601 CG ARG A 39 18.422 25.697 26.725 1.00 0.00 C ATOM 602 CD ARG A 39 19.551 26.473 27.430 1.00 0.00 C ATOM 603 NE ARG A 39 18.887 27.459 28.346 1.00 0.00 N ATOM 604 CZ ARG A 39 19.339 27.671 29.553 1.00 0.00 C ATOM 605 NH1 ARG A 39 20.385 27.034 30.007 1.00 0.00 N ATOM 606 NH2 ARG A 39 18.733 28.538 30.318 1.00 0.00 N ATOM 0 HA ARG A 39 16.843 25.412 24.719 1.00 0.00 H new ATOM 0 HB2 ARG A 39 17.472 27.641 26.672 1.00 0.00 H new ATOM 0 HB3 ARG A 39 16.414 26.349 27.204 1.00 0.00 H new ATOM 0 HG2 ARG A 39 18.134 24.836 27.329 1.00 0.00 H new ATOM 0 HG3 ARG A 39 18.780 25.312 25.770 1.00 0.00 H new ATOM 0 HD2 ARG A 39 20.195 25.796 27.991 1.00 0.00 H new ATOM 0 HD3 ARG A 39 20.182 26.984 26.703 1.00 0.00 H new ATOM 0 HE ARG A 39 18.068 27.973 28.020 1.00 0.00 H new ATOM 0 HH11 ARG A 39 20.865 26.356 29.416 1.00 0.00 H new ATOM 0 HH12 ARG A 39 20.721 27.215 30.953 1.00 0.00 H new ATOM 0 HH21 ARG A 39 17.916 29.041 29.971 1.00 0.00 H new ATOM 0 HH22 ARG A 39 19.076 28.712 31.263 1.00 0.00 H new ATOM 620 N PRO A 40 14.396 25.874 25.400 1.00 0.00 N ATOM 621 CA PRO A 40 12.952 26.132 25.326 1.00 0.00 C ATOM 622 C PRO A 40 12.555 27.241 26.297 1.00 0.00 C ATOM 623 O PRO A 40 11.441 27.756 26.254 1.00 0.00 O ATOM 624 CB PRO A 40 12.328 24.807 25.731 1.00 0.00 C ATOM 625 CG PRO A 40 13.376 24.122 26.540 1.00 0.00 C ATOM 626 CD PRO A 40 14.702 24.579 25.996 1.00 0.00 C ATOM 0 HA PRO A 40 12.629 26.464 24.340 1.00 0.00 H new ATOM 0 HB2 PRO A 40 11.418 24.960 26.311 1.00 0.00 H new ATOM 0 HB3 PRO A 40 12.054 24.216 24.857 1.00 0.00 H new ATOM 0 HG2 PRO A 40 13.281 24.378 27.595 1.00 0.00 H new ATOM 0 HG3 PRO A 40 13.278 23.039 26.465 1.00 0.00 H new ATOM 0 HD2 PRO A 40 15.451 24.666 26.783 1.00 0.00 H new ATOM 0 HD3 PRO A 40 15.096 23.880 25.258 1.00 0.00 H new ATOM 634 N SER A 41 13.417 27.597 27.200 1.00 0.00 N ATOM 635 CA SER A 41 13.057 28.626 28.173 1.00 0.00 C ATOM 636 C SER A 41 13.911 29.903 28.035 1.00 0.00 C ATOM 637 O SER A 41 14.137 30.608 29.017 1.00 0.00 O ATOM 638 CB SER A 41 13.241 27.915 29.510 1.00 0.00 C ATOM 639 OG SER A 41 14.627 27.742 29.770 1.00 0.00 O ATOM 0 H SER A 41 14.356 27.212 27.297 1.00 0.00 H new ATOM 0 HA SER A 41 12.043 29.003 28.040 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.780 28.496 30.309 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.741 26.947 29.491 1.00 0.00 H new ATOM 0 HG SER A 41 14.775 26.869 30.190 1.00 0.00 H new ATOM 645 N CYS A 42 14.369 30.242 26.840 1.00 0.00 N ATOM 646 CA CYS A 42 15.167 31.498 26.683 1.00 0.00 C ATOM 647 C CYS A 42 14.389 32.659 27.291 1.00 0.00 C ATOM 648 O CYS A 42 13.189 32.819 27.074 1.00 0.00 O ATOM 649 CB CYS A 42 15.356 31.737 25.187 1.00 0.00 C ATOM 650 SG CYS A 42 16.414 33.202 24.962 1.00 0.00 S ATOM 0 H CYS A 42 14.223 29.707 25.984 1.00 0.00 H new ATOM 0 HA CYS A 42 16.132 31.415 27.182 1.00 0.00 H new ATOM 0 HB2 CYS A 42 15.813 30.865 24.719 1.00 0.00 H new ATOM 0 HB3 CYS A 42 14.391 31.889 24.703 1.00 0.00 H new ATOM 0 HG CYS A 42 17.637 32.908 25.289 1.00 0.00 H new ATOM 655 N ARG A 43 15.053 33.447 28.058 1.00 0.00 N ATOM 656 CA ARG A 43 14.381 34.601 28.722 1.00 0.00 C ATOM 657 C ARG A 43 14.660 35.925 28.005 1.00 0.00 C ATOM 658 O ARG A 43 14.288 36.986 28.503 1.00 0.00 O ATOM 659 CB ARG A 43 14.958 34.629 30.141 1.00 0.00 C ATOM 660 CG ARG A 43 16.473 34.867 30.088 1.00 0.00 C ATOM 661 CD ARG A 43 17.177 33.940 31.087 1.00 0.00 C ATOM 662 NE ARG A 43 16.796 32.556 30.673 1.00 0.00 N ATOM 663 CZ ARG A 43 16.827 31.566 31.533 1.00 0.00 C ATOM 664 NH1 ARG A 43 17.194 31.764 32.774 1.00 0.00 N ATOM 665 NH2 ARG A 43 16.489 30.366 31.146 1.00 0.00 N ATOM 0 H ARG A 43 16.047 33.351 28.265 1.00 0.00 H new ATOM 0 HA ARG A 43 13.297 34.484 28.708 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.478 35.417 30.722 1.00 0.00 H new ATOM 0 HB3 ARG A 43 14.747 33.687 30.647 1.00 0.00 H new ATOM 0 HG2 ARG A 43 16.845 34.681 29.080 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.696 35.908 30.323 1.00 0.00 H new ATOM 0 HD2 ARG A 43 18.258 34.077 31.056 1.00 0.00 H new ATOM 0 HD3 ARG A 43 16.858 34.147 32.109 1.00 0.00 H new ATOM 0 HE ARG A 43 16.508 32.379 29.711 1.00 0.00 H new ATOM 0 HH11 ARG A 43 17.461 32.698 33.084 1.00 0.00 H new ATOM 0 HH12 ARG A 43 17.213 30.984 33.431 1.00 0.00 H new ATOM 0 HH21 ARG A 43 16.203 30.203 30.180 1.00 0.00 H new ATOM 0 HH22 ARG A 43 16.511 29.591 31.809 1.00 0.00 H new ATOM 679 N ALA A 44 15.330 35.917 26.881 1.00 0.00 N ATOM 680 CA ALA A 44 15.625 37.229 26.226 1.00 0.00 C ATOM 681 C ALA A 44 14.536 37.652 25.241 1.00 0.00 C ATOM 682 O ALA A 44 14.032 38.772 25.294 1.00 0.00 O ATOM 683 CB ALA A 44 16.940 37.005 25.494 1.00 0.00 C ATOM 0 H ALA A 44 15.677 35.087 26.400 1.00 0.00 H new ATOM 0 HA ALA A 44 15.674 38.030 26.963 1.00 0.00 H new ATOM 0 HB1 ALA A 44 17.233 37.922 24.983 1.00 0.00 H new ATOM 0 HB2 ALA A 44 17.713 36.727 26.211 1.00 0.00 H new ATOM 0 HB3 ALA A 44 16.818 36.205 24.763 1.00 0.00 H new ATOM 689 N ARG A 45 14.173 36.781 24.348 1.00 0.00 N ATOM 690 CA ARG A 45 13.122 37.104 23.326 1.00 0.00 C ATOM 691 C ARG A 45 13.033 35.902 22.355 1.00 0.00 C ATOM 692 O ARG A 45 13.736 34.911 22.543 1.00 0.00 O ATOM 693 CB ARG A 45 13.629 38.389 22.628 1.00 0.00 C ATOM 694 CG ARG A 45 12.475 39.130 21.938 1.00 0.00 C ATOM 695 CD ARG A 45 12.388 40.569 22.485 1.00 0.00 C ATOM 696 NE ARG A 45 13.206 41.407 21.548 1.00 0.00 N ATOM 697 CZ ARG A 45 13.533 42.635 21.850 1.00 0.00 C ATOM 698 NH1 ARG A 45 13.155 43.170 22.980 1.00 0.00 N ATOM 699 NH2 ARG A 45 14.245 43.330 21.009 1.00 0.00 N ATOM 0 H ARG A 45 14.561 35.841 24.275 1.00 0.00 H new ATOM 0 HA ARG A 45 12.125 37.270 23.734 1.00 0.00 H new ATOM 0 HB2 ARG A 45 14.100 39.044 23.361 1.00 0.00 H new ATOM 0 HB3 ARG A 45 14.392 38.132 21.893 1.00 0.00 H new ATOM 0 HG2 ARG A 45 12.634 39.148 20.860 1.00 0.00 H new ATOM 0 HG3 ARG A 45 11.536 38.606 22.113 1.00 0.00 H new ATOM 0 HD2 ARG A 45 11.355 40.914 22.518 1.00 0.00 H new ATOM 0 HD3 ARG A 45 12.776 40.626 23.502 1.00 0.00 H new ATOM 0 HE ARG A 45 13.512 41.011 20.659 1.00 0.00 H new ATOM 0 HH11 ARG A 45 12.597 42.628 23.640 1.00 0.00 H new ATOM 0 HH12 ARG A 45 13.418 44.130 23.203 1.00 0.00 H new ATOM 0 HH21 ARG A 45 14.541 42.914 20.126 1.00 0.00 H new ATOM 0 HH22 ARG A 45 14.507 44.290 21.234 1.00 0.00 H new ATOM 713 N HIS A 46 12.180 35.927 21.355 1.00 0.00 N ATOM 714 CA HIS A 46 12.076 34.735 20.447 1.00 0.00 C ATOM 715 C HIS A 46 11.907 35.062 18.973 1.00 0.00 C ATOM 716 O HIS A 46 11.445 36.127 18.585 1.00 0.00 O ATOM 717 CB HIS A 46 10.832 34.001 20.895 1.00 0.00 C ATOM 718 CG HIS A 46 11.196 32.995 21.922 1.00 0.00 C ATOM 719 ND1 HIS A 46 11.499 33.096 23.250 1.00 0.00 N flip ATOM 720 CD2 HIS A 46 11.249 31.656 21.615 1.00 0.00 C flip ATOM 721 CE1 HIS A 46 11.724 31.829 23.768 1.00 0.00 C flip ATOM 722 NE2 HIS A 46 11.555 31.006 22.731 1.00 0.00 N flip ATOM 0 H HIS A 46 11.561 36.706 21.130 1.00 0.00 H new ATOM 0 HA HIS A 46 13.006 34.172 20.522 1.00 0.00 H new ATOM 0 HB2 HIS A 46 10.107 34.706 21.302 1.00 0.00 H new ATOM 0 HB3 HIS A 46 10.358 33.512 20.044 1.00 0.00 H new ATOM 0 HD1 HIS A 46 11.552 33.967 23.778 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.074 31.215 20.645 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.979 31.567 24.784 1.00 0.00 H new ATOM 730 N ALA A 47 12.219 34.089 18.160 1.00 0.00 N ATOM 731 CA ALA A 47 12.060 34.212 16.694 1.00 0.00 C ATOM 732 C ALA A 47 10.994 33.220 16.221 1.00 0.00 C ATOM 733 O ALA A 47 10.652 32.271 16.925 1.00 0.00 O ATOM 734 CB ALA A 47 13.426 33.867 16.109 1.00 0.00 C ATOM 0 H ALA A 47 12.588 33.189 18.467 1.00 0.00 H new ATOM 0 HA ALA A 47 11.741 35.207 16.384 1.00 0.00 H new ATOM 0 HB1 ALA A 47 13.385 33.937 15.022 1.00 0.00 H new ATOM 0 HB2 ALA A 47 14.172 34.565 16.489 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.699 32.852 16.397 1.00 0.00 H new ATOM 740 N LEU A 48 10.438 33.433 15.061 1.00 0.00 N ATOM 741 CA LEU A 48 9.373 32.534 14.558 1.00 0.00 C ATOM 742 C LEU A 48 9.815 31.066 14.535 1.00 0.00 C ATOM 743 O LEU A 48 11.001 30.748 14.534 1.00 0.00 O ATOM 744 CB LEU A 48 9.077 33.025 13.142 1.00 0.00 C ATOM 745 CG LEU A 48 8.596 34.480 13.192 1.00 0.00 C ATOM 746 CD1 LEU A 48 9.299 35.288 12.099 1.00 0.00 C ATOM 747 CD2 LEU A 48 7.079 34.530 12.971 1.00 0.00 C ATOM 0 H LEU A 48 10.682 34.201 14.436 1.00 0.00 H new ATOM 0 HA LEU A 48 8.497 32.566 15.207 1.00 0.00 H new ATOM 0 HB2 LEU A 48 9.972 32.948 12.525 1.00 0.00 H new ATOM 0 HB3 LEU A 48 8.317 32.396 12.680 1.00 0.00 H new ATOM 0 HG LEU A 48 8.832 34.905 14.167 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.957 36.322 12.134 1.00 0.00 H new ATOM 0 HD12 LEU A 48 10.377 35.256 12.259 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.065 34.862 11.124 1.00 0.00 H new ATOM 0 HD21 LEU A 48 6.740 35.565 13.007 1.00 0.00 H new ATOM 0 HD22 LEU A 48 6.839 34.103 11.997 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.579 33.957 13.752 1.00 0.00 H new ATOM 759 N ARG A 49 8.862 30.169 14.495 1.00 0.00 N ATOM 760 CA ARG A 49 9.179 28.708 14.447 1.00 0.00 C ATOM 761 C ARG A 49 9.770 28.381 13.085 1.00 0.00 C ATOM 762 O ARG A 49 10.588 27.480 12.912 1.00 0.00 O ATOM 763 CB ARG A 49 7.816 28.054 14.543 1.00 0.00 C ATOM 764 CG ARG A 49 7.956 26.606 15.022 1.00 0.00 C ATOM 765 CD ARG A 49 7.066 25.694 14.172 1.00 0.00 C ATOM 766 NE ARG A 49 5.721 25.757 14.818 1.00 0.00 N ATOM 767 CZ ARG A 49 4.772 26.530 14.337 1.00 0.00 C ATOM 768 NH1 ARG A 49 4.973 27.270 13.276 1.00 0.00 N ATOM 769 NH2 ARG A 49 3.609 26.559 14.929 1.00 0.00 N ATOM 0 H ARG A 49 7.866 30.389 14.494 1.00 0.00 H new ATOM 0 HA ARG A 49 9.878 28.389 15.221 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.184 28.613 15.233 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.324 28.077 13.570 1.00 0.00 H new ATOM 0 HG2 ARG A 49 8.996 26.287 14.948 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.673 26.531 16.072 1.00 0.00 H new ATOM 0 HD2 ARG A 49 7.024 26.036 13.138 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.448 24.673 14.155 1.00 0.00 H new ATOM 0 HE ARG A 49 5.535 25.191 15.646 1.00 0.00 H new ATOM 0 HH11 ARG A 49 5.879 27.254 12.807 1.00 0.00 H new ATOM 0 HH12 ARG A 49 4.224 27.863 12.918 1.00 0.00 H new ATOM 0 HH21 ARG A 49 3.443 25.986 15.756 1.00 0.00 H new ATOM 0 HH22 ARG A 49 2.866 27.155 14.564 1.00 0.00 H new ATOM 783 N GLU A 50 9.332 29.130 12.127 1.00 0.00 N ATOM 784 CA GLU A 50 9.768 28.988 10.720 1.00 0.00 C ATOM 785 C GLU A 50 11.261 28.712 10.611 1.00 0.00 C ATOM 786 O GLU A 50 11.699 27.675 10.120 1.00 0.00 O ATOM 787 CB GLU A 50 9.457 30.365 10.172 1.00 0.00 C ATOM 788 CG GLU A 50 9.477 30.319 8.674 1.00 0.00 C ATOM 789 CD GLU A 50 10.918 30.316 8.161 1.00 0.00 C ATOM 790 OE1 GLU A 50 11.474 31.390 8.010 1.00 0.00 O ATOM 791 OE2 GLU A 50 11.439 29.237 7.928 1.00 0.00 O ATOM 0 H GLU A 50 8.652 29.876 12.270 1.00 0.00 H new ATOM 0 HA GLU A 50 9.285 28.160 10.200 1.00 0.00 H new ATOM 0 HB2 GLU A 50 8.480 30.697 10.524 1.00 0.00 H new ATOM 0 HB3 GLU A 50 10.189 31.087 10.535 1.00 0.00 H new ATOM 0 HG2 GLU A 50 8.958 29.427 8.324 1.00 0.00 H new ATOM 0 HG3 GLU A 50 8.942 31.178 8.270 1.00 0.00 H new ATOM 798 N ASN A 51 12.037 29.636 11.073 1.00 0.00 N ATOM 799 CA ASN A 51 13.513 29.480 11.028 1.00 0.00 C ATOM 800 C ASN A 51 13.975 28.804 12.305 1.00 0.00 C ATOM 801 O ASN A 51 15.137 28.855 12.669 1.00 0.00 O ATOM 802 CB ASN A 51 14.046 30.909 10.999 1.00 0.00 C ATOM 803 CG ASN A 51 13.633 31.596 9.698 1.00 0.00 C ATOM 804 OD1 ASN A 51 13.970 31.137 8.609 1.00 0.00 O ATOM 805 ND2 ASN A 51 12.911 32.683 9.757 1.00 0.00 N ATOM 0 H ASN A 51 11.711 30.509 11.488 1.00 0.00 H new ATOM 0 HA ASN A 51 13.852 28.886 10.179 1.00 0.00 H new ATOM 0 HB2 ASN A 51 13.660 31.467 11.852 1.00 0.00 H new ATOM 0 HB3 ASN A 51 15.132 30.902 11.087 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.626 33.153 8.898 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.633 33.062 10.662 1.00 0.00 H new ATOM 812 N VAL A 52 13.074 28.194 12.999 1.00 0.00 N ATOM 813 CA VAL A 52 13.436 27.544 14.281 1.00 0.00 C ATOM 814 C VAL A 52 13.297 26.015 14.199 1.00 0.00 C ATOM 815 O VAL A 52 12.243 25.484 13.858 1.00 0.00 O ATOM 816 CB VAL A 52 12.428 28.150 15.258 1.00 0.00 C ATOM 817 CG1 VAL A 52 12.100 27.166 16.376 1.00 0.00 C ATOM 818 CG2 VAL A 52 13.016 29.421 15.870 1.00 0.00 C ATOM 0 H VAL A 52 12.092 28.114 12.735 1.00 0.00 H new ATOM 0 HA VAL A 52 14.473 27.711 14.572 1.00 0.00 H new ATOM 0 HB VAL A 52 11.513 28.382 14.712 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.381 27.618 17.059 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.673 26.259 15.949 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.011 26.917 16.920 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.299 29.855 16.567 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.936 29.177 16.401 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.233 30.139 15.079 1.00 0.00 H new ATOM 828 N SER A 53 14.342 25.303 14.533 1.00 0.00 N ATOM 829 CA SER A 53 14.291 23.816 14.515 1.00 0.00 C ATOM 830 C SER A 53 14.712 23.295 15.885 1.00 0.00 C ATOM 831 O SER A 53 15.065 24.070 16.763 1.00 0.00 O ATOM 832 CB SER A 53 15.283 23.382 13.442 1.00 0.00 C ATOM 833 OG SER A 53 16.458 24.174 13.540 1.00 0.00 O ATOM 0 H SER A 53 15.238 25.696 14.821 1.00 0.00 H new ATOM 0 HA SER A 53 13.295 23.429 14.301 1.00 0.00 H new ATOM 0 HB2 SER A 53 15.530 22.328 13.564 1.00 0.00 H new ATOM 0 HB3 SER A 53 14.838 23.492 12.453 1.00 0.00 H new ATOM 0 HG SER A 53 17.098 23.896 12.852 1.00 0.00 H new ATOM 839 N PHE A 54 14.643 22.013 16.105 1.00 0.00 N ATOM 840 CA PHE A 54 14.992 21.471 17.425 1.00 0.00 C ATOM 841 C PHE A 54 16.188 20.537 17.369 1.00 0.00 C ATOM 842 O PHE A 54 16.435 19.845 16.384 1.00 0.00 O ATOM 843 CB PHE A 54 13.753 20.710 17.829 1.00 0.00 C ATOM 844 CG PHE A 54 12.611 21.680 17.868 1.00 0.00 C ATOM 845 CD1 PHE A 54 12.577 22.665 18.857 1.00 0.00 C ATOM 846 CD2 PHE A 54 11.612 21.620 16.894 1.00 0.00 C ATOM 847 CE1 PHE A 54 11.537 23.592 18.877 1.00 0.00 C ATOM 848 CE2 PHE A 54 10.576 22.551 16.909 1.00 0.00 C ATOM 849 CZ PHE A 54 10.540 23.535 17.902 1.00 0.00 C ATOM 0 H PHE A 54 14.356 21.320 15.414 1.00 0.00 H new ATOM 0 HA PHE A 54 15.276 22.257 18.125 1.00 0.00 H new ATOM 0 HB2 PHE A 54 13.549 19.908 17.119 1.00 0.00 H new ATOM 0 HB3 PHE A 54 13.892 20.244 18.805 1.00 0.00 H new ATOM 0 HD1 PHE A 54 13.355 22.708 19.605 1.00 0.00 H new ATOM 0 HD2 PHE A 54 11.643 20.855 16.132 1.00 0.00 H new ATOM 0 HE1 PHE A 54 11.503 24.352 19.644 1.00 0.00 H new ATOM 0 HE2 PHE A 54 9.803 22.513 16.156 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.736 24.255 17.914 1.00 0.00 H new ATOM 859 N TYR A 55 16.910 20.499 18.439 1.00 0.00 N ATOM 860 CA TYR A 55 18.093 19.607 18.535 1.00 0.00 C ATOM 861 C TYR A 55 17.997 18.796 19.814 1.00 0.00 C ATOM 862 O TYR A 55 17.382 19.227 20.784 1.00 0.00 O ATOM 863 CB TYR A 55 19.299 20.542 18.615 1.00 0.00 C ATOM 864 CG TYR A 55 19.597 21.103 17.250 1.00 0.00 C ATOM 865 CD1 TYR A 55 19.688 20.239 16.160 1.00 0.00 C ATOM 866 CD2 TYR A 55 19.789 22.478 17.073 1.00 0.00 C ATOM 867 CE1 TYR A 55 19.972 20.739 14.888 1.00 0.00 C ATOM 868 CE2 TYR A 55 20.072 22.981 15.800 1.00 0.00 C ATOM 869 CZ TYR A 55 20.165 22.113 14.706 1.00 0.00 C ATOM 870 OH TYR A 55 20.447 22.610 13.449 1.00 0.00 O ATOM 0 H TYR A 55 16.730 21.059 19.272 1.00 0.00 H new ATOM 0 HA TYR A 55 18.165 18.919 17.693 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.097 21.352 19.316 1.00 0.00 H new ATOM 0 HB3 TYR A 55 20.166 20.001 18.994 1.00 0.00 H new ATOM 0 HD1 TYR A 55 19.538 19.179 16.300 1.00 0.00 H new ATOM 0 HD2 TYR A 55 19.719 23.148 17.917 1.00 0.00 H new ATOM 0 HE1 TYR A 55 20.043 20.067 14.046 1.00 0.00 H new ATOM 0 HE2 TYR A 55 20.219 24.042 15.660 1.00 0.00 H new ATOM 0 HH TYR A 55 19.750 23.246 13.185 1.00 0.00 H new ATOM 880 N ALA A 56 18.611 17.653 19.862 1.00 0.00 N ATOM 881 CA ALA A 56 18.563 16.863 21.115 1.00 0.00 C ATOM 882 C ALA A 56 19.380 17.602 22.167 1.00 0.00 C ATOM 883 O ALA A 56 19.003 17.685 23.333 1.00 0.00 O ATOM 884 CB ALA A 56 19.193 15.518 20.786 1.00 0.00 C ATOM 0 H ALA A 56 19.139 17.235 19.096 1.00 0.00 H new ATOM 0 HA ALA A 56 17.551 16.725 21.497 1.00 0.00 H new ATOM 0 HB1 ALA A 56 19.187 14.887 21.674 1.00 0.00 H new ATOM 0 HB2 ALA A 56 18.623 15.034 19.993 1.00 0.00 H new ATOM 0 HB3 ALA A 56 20.220 15.669 20.455 1.00 0.00 H new ATOM 890 N ASN A 57 20.495 18.158 21.768 1.00 0.00 N ATOM 891 CA ASN A 57 21.326 18.906 22.723 1.00 0.00 C ATOM 892 C ASN A 57 21.886 20.160 22.079 1.00 0.00 C ATOM 893 O ASN A 57 21.891 20.332 20.854 1.00 0.00 O ATOM 894 CB ASN A 57 22.476 17.990 23.084 1.00 0.00 C ATOM 895 CG ASN A 57 23.210 17.573 21.818 1.00 0.00 C ATOM 896 OD1 ASN A 57 24.213 18.183 21.457 1.00 0.00 O ATOM 897 ND2 ASN A 57 22.758 16.572 21.119 1.00 0.00 N ATOM 0 H ASN A 57 20.857 18.119 20.815 1.00 0.00 H new ATOM 0 HA ASN A 57 20.740 19.205 23.592 1.00 0.00 H new ATOM 0 HB2 ASN A 57 23.160 18.499 23.763 1.00 0.00 H new ATOM 0 HB3 ASN A 57 22.103 17.110 23.607 1.00 0.00 H new ATOM 0 HD21 ASN A 57 23.238 16.289 20.264 1.00 0.00 H new ATOM 0 HD22 ASN A 57 21.924 16.071 21.426 1.00 0.00 H new ATOM 904 N ALA A 58 22.383 21.022 22.894 1.00 0.00 N ATOM 905 CA ALA A 58 22.979 22.268 22.385 1.00 0.00 C ATOM 906 C ALA A 58 24.233 21.961 21.569 1.00 0.00 C ATOM 907 O ALA A 58 24.625 22.752 20.729 1.00 0.00 O ATOM 908 CB ALA A 58 23.339 23.064 23.634 1.00 0.00 C ATOM 0 H ALA A 58 22.403 20.917 23.908 1.00 0.00 H new ATOM 0 HA ALA A 58 22.301 22.814 21.729 1.00 0.00 H new ATOM 0 HB1 ALA A 58 23.791 24.012 23.343 1.00 0.00 H new ATOM 0 HB2 ALA A 58 22.437 23.255 24.216 1.00 0.00 H new ATOM 0 HB3 ALA A 58 24.046 22.495 24.237 1.00 0.00 H new ATOM 914 N SER A 59 24.873 20.832 21.774 1.00 0.00 N ATOM 915 CA SER A 59 26.095 20.546 20.967 1.00 0.00 C ATOM 916 C SER A 59 25.678 20.226 19.540 1.00 0.00 C ATOM 917 O SER A 59 26.334 20.622 18.580 1.00 0.00 O ATOM 918 CB SER A 59 26.774 19.348 21.633 1.00 0.00 C ATOM 919 OG SER A 59 28.139 19.303 21.235 1.00 0.00 O ATOM 0 H SER A 59 24.608 20.115 22.449 1.00 0.00 H new ATOM 0 HA SER A 59 26.780 21.393 20.927 1.00 0.00 H new ATOM 0 HB2 SER A 59 26.702 19.430 22.717 1.00 0.00 H new ATOM 0 HB3 SER A 59 26.269 18.425 21.349 1.00 0.00 H new ATOM 0 HG SER A 59 28.579 18.538 21.661 1.00 0.00 H new ATOM 925 N GLU A 60 24.570 19.557 19.378 1.00 0.00 N ATOM 926 CA GLU A 60 24.085 19.264 18.012 1.00 0.00 C ATOM 927 C GLU A 60 23.811 20.606 17.345 1.00 0.00 C ATOM 928 O GLU A 60 24.282 20.902 16.242 1.00 0.00 O ATOM 929 CB GLU A 60 22.799 18.461 18.212 1.00 0.00 C ATOM 930 CG GLU A 60 22.343 17.875 16.877 1.00 0.00 C ATOM 931 CD GLU A 60 23.454 17.006 16.280 1.00 0.00 C ATOM 932 OE1 GLU A 60 23.862 16.064 16.940 1.00 0.00 O ATOM 933 OE2 GLU A 60 23.877 17.297 15.173 1.00 0.00 O ATOM 0 H GLU A 60 23.984 19.204 20.135 1.00 0.00 H new ATOM 0 HA GLU A 60 24.784 18.705 17.390 1.00 0.00 H new ATOM 0 HB2 GLU A 60 22.967 17.661 18.933 1.00 0.00 H new ATOM 0 HB3 GLU A 60 22.019 19.102 18.624 1.00 0.00 H new ATOM 0 HG2 GLU A 60 21.442 17.279 17.021 1.00 0.00 H new ATOM 0 HG3 GLU A 60 22.087 18.678 16.186 1.00 0.00 H new ATOM 940 N ALA A 61 23.102 21.454 18.040 1.00 0.00 N ATOM 941 CA ALA A 61 22.838 22.815 17.500 1.00 0.00 C ATOM 942 C ALA A 61 24.170 23.502 17.269 1.00 0.00 C ATOM 943 O ALA A 61 24.418 24.118 16.235 1.00 0.00 O ATOM 944 CB ALA A 61 22.089 23.529 18.609 1.00 0.00 C ATOM 0 H ALA A 61 22.696 21.262 18.956 1.00 0.00 H new ATOM 0 HA ALA A 61 22.279 22.806 16.564 1.00 0.00 H new ATOM 0 HB1 ALA A 61 21.854 24.545 18.293 1.00 0.00 H new ATOM 0 HB2 ALA A 61 21.165 22.994 18.827 1.00 0.00 H new ATOM 0 HB3 ALA A 61 22.710 23.562 19.505 1.00 0.00 H new ATOM 950 N LEU A 62 25.043 23.375 18.225 1.00 0.00 N ATOM 951 CA LEU A 62 26.385 23.976 18.101 1.00 0.00 C ATOM 952 C LEU A 62 27.074 23.357 16.881 1.00 0.00 C ATOM 953 O LEU A 62 27.901 23.983 16.222 1.00 0.00 O ATOM 954 CB LEU A 62 27.080 23.577 19.409 1.00 0.00 C ATOM 955 CG LEU A 62 26.546 24.407 20.588 1.00 0.00 C ATOM 956 CD1 LEU A 62 27.044 23.798 21.900 1.00 0.00 C ATOM 957 CD2 LEU A 62 27.022 25.860 20.499 1.00 0.00 C ATOM 0 H LEU A 62 24.876 22.872 19.097 1.00 0.00 H new ATOM 0 HA LEU A 62 26.392 25.057 17.960 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.919 22.517 19.603 1.00 0.00 H new ATOM 0 HB3 LEU A 62 28.156 23.723 19.313 1.00 0.00 H new ATOM 0 HG LEU A 62 25.457 24.395 20.552 1.00 0.00 H new ATOM 0 HD11 LEU A 62 26.668 24.384 22.739 1.00 0.00 H new ATOM 0 HD12 LEU A 62 26.686 22.772 21.984 1.00 0.00 H new ATOM 0 HD13 LEU A 62 28.134 23.804 21.913 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.630 26.424 21.345 1.00 0.00 H new ATOM 0 HD22 LEU A 62 28.111 25.888 20.518 1.00 0.00 H new ATOM 0 HD23 LEU A 62 26.664 26.304 19.570 1.00 0.00 H new ATOM 969 N ALA A 63 26.721 22.135 16.562 1.00 0.00 N ATOM 970 CA ALA A 63 27.313 21.461 15.388 1.00 0.00 C ATOM 971 C ALA A 63 26.623 21.933 14.103 1.00 0.00 C ATOM 972 O ALA A 63 27.142 21.758 13.002 1.00 0.00 O ATOM 973 CB ALA A 63 27.066 19.969 15.615 1.00 0.00 C ATOM 0 H ALA A 63 26.039 21.578 17.078 1.00 0.00 H new ATOM 0 HA ALA A 63 28.375 21.683 15.278 1.00 0.00 H new ATOM 0 HB1 ALA A 63 27.479 19.401 14.781 1.00 0.00 H new ATOM 0 HB2 ALA A 63 27.549 19.657 16.541 1.00 0.00 H new ATOM 0 HB3 ALA A 63 25.994 19.784 15.684 1.00 0.00 H new ATOM 979 N ALA A 64 25.468 22.544 14.222 1.00 0.00 N ATOM 980 CA ALA A 64 24.758 23.040 12.997 1.00 0.00 C ATOM 981 C ALA A 64 25.401 24.325 12.501 1.00 0.00 C ATOM 982 O ALA A 64 24.981 24.924 11.513 1.00 0.00 O ATOM 983 CB ALA A 64 23.301 23.288 13.401 1.00 0.00 C ATOM 0 H ALA A 64 24.989 22.720 15.105 1.00 0.00 H new ATOM 0 HA ALA A 64 24.817 22.313 12.187 1.00 0.00 H new ATOM 0 HB1 ALA A 64 22.741 23.652 12.539 1.00 0.00 H new ATOM 0 HB2 ALA A 64 22.858 22.357 13.755 1.00 0.00 H new ATOM 0 HB3 ALA A 64 23.266 24.032 14.197 1.00 0.00 H new ATOM 989 N GLY A 65 26.408 24.746 13.180 1.00 0.00 N ATOM 990 CA GLY A 65 27.119 25.995 12.794 1.00 0.00 C ATOM 991 C GLY A 65 26.368 27.197 13.362 1.00 0.00 C ATOM 992 O GLY A 65 26.246 28.236 12.716 1.00 0.00 O ATOM 0 H GLY A 65 26.784 24.276 14.004 1.00 0.00 H new ATOM 0 HA2 GLY A 65 28.141 25.978 13.173 1.00 0.00 H new ATOM 0 HA3 GLY A 65 27.183 26.071 11.708 1.00 0.00 H new ATOM 996 N PHE A 66 25.861 27.076 14.561 1.00 0.00 N ATOM 997 CA PHE A 66 25.118 28.213 15.171 1.00 0.00 C ATOM 998 C PHE A 66 25.844 28.753 16.394 1.00 0.00 C ATOM 999 O PHE A 66 26.654 28.070 17.018 1.00 0.00 O ATOM 1000 CB PHE A 66 23.762 27.647 15.594 1.00 0.00 C ATOM 1001 CG PHE A 66 22.917 27.352 14.382 1.00 0.00 C ATOM 1002 CD1 PHE A 66 22.810 28.300 13.358 1.00 0.00 C ATOM 1003 CD2 PHE A 66 22.218 26.143 14.293 1.00 0.00 C ATOM 1004 CE1 PHE A 66 22.006 28.041 12.247 1.00 0.00 C ATOM 1005 CE2 PHE A 66 21.416 25.883 13.178 1.00 0.00 C ATOM 1006 CZ PHE A 66 21.309 26.834 12.157 1.00 0.00 C ATOM 0 H PHE A 66 25.930 26.240 15.141 1.00 0.00 H new ATOM 0 HA PHE A 66 25.024 29.036 14.462 1.00 0.00 H new ATOM 0 HB2 PHE A 66 23.906 26.736 16.176 1.00 0.00 H new ATOM 0 HB3 PHE A 66 23.248 28.360 16.239 1.00 0.00 H new ATOM 0 HD1 PHE A 66 23.350 29.233 13.428 1.00 0.00 H new ATOM 0 HD2 PHE A 66 22.298 25.412 15.084 1.00 0.00 H new ATOM 0 HE1 PHE A 66 21.923 28.773 11.458 1.00 0.00 H new ATOM 0 HE2 PHE A 66 20.879 24.949 13.105 1.00 0.00 H new ATOM 0 HZ PHE A 66 20.686 26.634 11.298 1.00 0.00 H new ATOM 1016 N ARG A 67 25.533 29.960 16.764 1.00 0.00 N ATOM 1017 CA ARG A 67 26.157 30.556 17.968 1.00 0.00 C ATOM 1018 C ARG A 67 25.156 30.429 19.116 1.00 0.00 C ATOM 1019 O ARG A 67 24.055 30.973 19.040 1.00 0.00 O ATOM 1020 CB ARG A 67 26.401 32.026 17.617 1.00 0.00 C ATOM 1021 CG ARG A 67 27.608 32.138 16.682 1.00 0.00 C ATOM 1022 CD ARG A 67 28.852 32.517 17.492 1.00 0.00 C ATOM 1023 NE ARG A 67 29.805 33.085 16.494 1.00 0.00 N ATOM 1024 CZ ARG A 67 30.448 32.304 15.659 1.00 0.00 C ATOM 1025 NH1 ARG A 67 30.269 31.007 15.681 1.00 0.00 N ATOM 1026 NH2 ARG A 67 31.276 32.825 14.795 1.00 0.00 N ATOM 0 H ARG A 67 24.868 30.562 16.279 1.00 0.00 H new ATOM 0 HA ARG A 67 27.089 30.074 18.264 1.00 0.00 H new ATOM 0 HB2 ARG A 67 25.517 32.447 17.138 1.00 0.00 H new ATOM 0 HB3 ARG A 67 26.577 32.603 18.525 1.00 0.00 H new ATOM 0 HG2 ARG A 67 27.771 31.191 16.167 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.418 32.889 15.915 1.00 0.00 H new ATOM 0 HD2 ARG A 67 28.612 33.245 18.267 1.00 0.00 H new ATOM 0 HD3 ARG A 67 29.277 31.647 17.993 1.00 0.00 H new ATOM 0 HE ARG A 67 29.958 34.093 16.461 1.00 0.00 H new ATOM 0 HH11 ARG A 67 29.623 30.593 16.353 1.00 0.00 H new ATOM 0 HH12 ARG A 67 30.775 30.411 15.026 1.00 0.00 H new ATOM 0 HH21 ARG A 67 31.420 33.834 14.772 1.00 0.00 H new ATOM 0 HH22 ARG A 67 31.779 32.223 14.143 1.00 0.00 H new ATOM 1040 N PRO A 68 25.533 29.707 20.133 1.00 0.00 N ATOM 1041 CA PRO A 68 24.617 29.508 21.275 1.00 0.00 C ATOM 1042 C PRO A 68 24.309 30.847 21.952 1.00 0.00 C ATOM 1043 O PRO A 68 25.192 31.654 22.231 1.00 0.00 O ATOM 1044 CB PRO A 68 25.363 28.518 22.173 1.00 0.00 C ATOM 1045 CG PRO A 68 26.801 28.656 21.792 1.00 0.00 C ATOM 1046 CD PRO A 68 26.822 29.031 20.333 1.00 0.00 C ATOM 0 HA PRO A 68 23.638 29.117 20.999 1.00 0.00 H new ATOM 0 HB2 PRO A 68 25.210 28.749 23.227 1.00 0.00 H new ATOM 0 HB3 PRO A 68 25.009 27.499 22.016 1.00 0.00 H new ATOM 0 HG2 PRO A 68 27.291 29.420 22.396 1.00 0.00 H new ATOM 0 HG3 PRO A 68 27.338 27.723 21.961 1.00 0.00 H new ATOM 0 HD2 PRO A 68 27.660 29.688 20.100 1.00 0.00 H new ATOM 0 HD3 PRO A 68 26.918 28.153 19.694 1.00 0.00 H new ATOM 1054 N CYS A 69 23.046 31.095 22.181 1.00 0.00 N ATOM 1055 CA CYS A 69 22.602 32.378 22.798 1.00 0.00 C ATOM 1056 C CYS A 69 23.357 32.634 24.110 1.00 0.00 C ATOM 1057 O CYS A 69 23.282 31.856 25.054 1.00 0.00 O ATOM 1058 CB CYS A 69 21.101 32.158 23.005 1.00 0.00 C ATOM 1059 SG CYS A 69 20.387 33.300 24.226 1.00 0.00 S ATOM 0 H CYS A 69 22.289 30.448 21.961 1.00 0.00 H new ATOM 0 HA CYS A 69 22.803 33.261 22.191 1.00 0.00 H new ATOM 0 HB2 CYS A 69 20.585 32.281 22.053 1.00 0.00 H new ATOM 0 HB3 CYS A 69 20.930 31.132 23.330 1.00 0.00 H new ATOM 0 HG CYS A 69 19.651 32.633 25.065 1.00 0.00 H new ATOM 1064 N LYS A 70 24.080 33.722 24.176 1.00 0.00 N ATOM 1065 CA LYS A 70 24.867 34.062 25.410 1.00 0.00 C ATOM 1066 C LYS A 70 24.005 33.974 26.676 1.00 0.00 C ATOM 1067 O LYS A 70 24.508 34.041 27.793 1.00 0.00 O ATOM 1068 CB LYS A 70 25.336 35.501 25.183 1.00 0.00 C ATOM 1069 CG LYS A 70 26.669 35.729 25.897 1.00 0.00 C ATOM 1070 CD LYS A 70 27.524 36.700 25.080 1.00 0.00 C ATOM 1071 CE LYS A 70 26.903 38.099 25.133 1.00 0.00 C ATOM 1072 NZ LYS A 70 28.063 39.035 25.117 1.00 0.00 N ATOM 0 H LYS A 70 24.163 34.401 23.420 1.00 0.00 H new ATOM 0 HA LYS A 70 25.692 33.367 25.563 1.00 0.00 H new ATOM 0 HB2 LYS A 70 25.447 35.693 24.116 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.588 36.200 25.557 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.495 36.131 26.895 1.00 0.00 H new ATOM 0 HG3 LYS A 70 27.194 34.782 26.022 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.540 36.727 25.474 1.00 0.00 H new ATOM 0 HD3 LYS A 70 27.592 36.360 24.047 1.00 0.00 H new ATOM 0 HE2 LYS A 70 26.245 38.271 24.282 1.00 0.00 H new ATOM 0 HE3 LYS A 70 26.302 38.230 26.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 27.718 40.016 25.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.668 38.852 25.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 28.613 38.892 24.246 1.00 0.00 H new ATOM 1086 N ARG A 71 22.722 33.825 26.522 1.00 0.00 N ATOM 1087 CA ARG A 71 21.822 33.728 27.702 1.00 0.00 C ATOM 1088 C ARG A 71 21.539 32.255 27.980 1.00 0.00 C ATOM 1089 O ARG A 71 21.523 31.795 29.117 1.00 0.00 O ATOM 1090 CB ARG A 71 20.545 34.422 27.249 1.00 0.00 C ATOM 1091 CG ARG A 71 19.847 35.080 28.446 1.00 0.00 C ATOM 1092 CD ARG A 71 19.487 36.534 28.108 1.00 0.00 C ATOM 1093 NE ARG A 71 19.825 37.313 29.339 1.00 0.00 N ATOM 1094 CZ ARG A 71 19.127 38.366 29.689 1.00 0.00 C ATOM 1095 NH1 ARG A 71 18.109 38.771 28.972 1.00 0.00 N ATOM 1096 NH2 ARG A 71 19.453 39.019 30.772 1.00 0.00 N ATOM 0 H ARG A 71 22.252 33.766 25.618 1.00 0.00 H new ATOM 0 HA ARG A 71 22.239 34.170 28.607 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.779 35.175 26.496 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.876 33.700 26.781 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.946 34.524 28.703 1.00 0.00 H new ATOM 0 HG3 ARG A 71 20.499 35.051 29.319 1.00 0.00 H new ATOM 0 HD2 ARG A 71 20.053 36.891 27.247 1.00 0.00 H new ATOM 0 HD3 ARG A 71 18.431 36.631 27.857 1.00 0.00 H new ATOM 0 HE ARG A 71 20.613 37.020 29.917 1.00 0.00 H new ATOM 0 HH11 ARG A 71 17.848 38.265 28.126 1.00 0.00 H new ATOM 0 HH12 ARG A 71 17.577 39.593 29.260 1.00 0.00 H new ATOM 0 HH21 ARG A 71 20.244 38.708 31.336 1.00 0.00 H new ATOM 0 HH22 ARG A 71 18.917 39.840 31.054 1.00 0.00 H new ATOM 1110 N CYS A 72 21.322 31.520 26.930 1.00 0.00 N ATOM 1111 CA CYS A 72 21.035 30.055 27.054 1.00 0.00 C ATOM 1112 C CYS A 72 22.321 29.244 26.883 1.00 0.00 C ATOM 1113 O CYS A 72 22.317 28.017 26.958 1.00 0.00 O ATOM 1114 CB CYS A 72 20.090 29.734 25.892 1.00 0.00 C ATOM 1115 SG CYS A 72 18.488 30.512 26.158 1.00 0.00 S ATOM 0 H CYS A 72 21.330 31.872 25.973 1.00 0.00 H new ATOM 0 HA CYS A 72 20.611 29.811 28.028 1.00 0.00 H new ATOM 0 HB2 CYS A 72 20.522 30.086 24.955 1.00 0.00 H new ATOM 0 HB3 CYS A 72 19.967 28.655 25.801 1.00 0.00 H new ATOM 0 HG CYS A 72 17.789 29.794 26.987 1.00 0.00 H new ATOM 1120 N GLN A 73 23.409 29.905 26.617 1.00 0.00 N ATOM 1121 CA GLN A 73 24.691 29.185 26.392 1.00 0.00 C ATOM 1122 C GLN A 73 25.486 29.003 27.703 1.00 0.00 C ATOM 1123 O GLN A 73 26.036 27.928 27.935 1.00 0.00 O ATOM 1124 CB GLN A 73 25.431 30.072 25.381 1.00 0.00 C ATOM 1125 CG GLN A 73 26.884 29.606 25.221 1.00 0.00 C ATOM 1126 CD GLN A 73 27.693 30.692 24.507 1.00 0.00 C ATOM 1127 OE1 GLN A 73 27.256 31.836 24.407 1.00 0.00 O ATOM 1128 NE2 GLN A 73 28.860 30.394 24.004 1.00 0.00 N ATOM 0 H GLN A 73 23.467 30.921 26.545 1.00 0.00 H new ATOM 0 HA GLN A 73 24.546 28.169 26.024 1.00 0.00 H new ATOM 0 HB2 GLN A 73 24.923 30.037 24.417 1.00 0.00 H new ATOM 0 HB3 GLN A 73 25.410 31.109 25.715 1.00 0.00 H new ATOM 0 HG2 GLN A 73 27.319 29.396 26.198 1.00 0.00 H new ATOM 0 HG3 GLN A 73 26.919 28.678 24.651 1.00 0.00 H new ATOM 0 HE21 GLN A 73 29.224 29.445 24.087 1.00 0.00 H new ATOM 0 HE22 GLN A 73 29.408 31.111 23.528 1.00 0.00 H new ATOM 1137 N PRO A 74 25.549 30.028 28.522 1.00 0.00 N ATOM 1138 CA PRO A 74 26.309 29.921 29.791 1.00 0.00 C ATOM 1139 C PRO A 74 25.480 29.228 30.883 1.00 0.00 C ATOM 1140 O PRO A 74 26.024 28.566 31.766 1.00 0.00 O ATOM 1141 CB PRO A 74 26.579 31.371 30.169 1.00 0.00 C ATOM 1142 CG PRO A 74 25.491 32.166 29.514 1.00 0.00 C ATOM 1143 CD PRO A 74 24.946 31.357 28.360 1.00 0.00 C ATOM 0 HA PRO A 74 27.216 29.326 29.684 1.00 0.00 H new ATOM 0 HB2 PRO A 74 26.565 31.503 31.251 1.00 0.00 H new ATOM 0 HB3 PRO A 74 27.562 31.690 29.822 1.00 0.00 H new ATOM 0 HG2 PRO A 74 24.699 32.389 30.229 1.00 0.00 H new ATOM 0 HG3 PRO A 74 25.879 33.121 29.159 1.00 0.00 H new ATOM 0 HD2 PRO A 74 23.858 31.305 28.391 1.00 0.00 H new ATOM 0 HD3 PRO A 74 25.216 31.801 27.402 1.00 0.00 H new ATOM 1151 N ASP A 75 24.181 29.378 30.855 1.00 0.00 N ATOM 1152 CA ASP A 75 23.334 28.739 31.908 1.00 0.00 C ATOM 1153 C ASP A 75 23.014 27.279 31.556 1.00 0.00 C ATOM 1154 O ASP A 75 23.420 26.769 30.513 1.00 0.00 O ATOM 1155 CB ASP A 75 22.061 29.586 31.965 1.00 0.00 C ATOM 1156 CG ASP A 75 21.329 29.542 30.620 1.00 0.00 C ATOM 1157 OD1 ASP A 75 21.796 28.852 29.727 1.00 0.00 O ATOM 1158 OD2 ASP A 75 20.298 30.186 30.513 1.00 0.00 O ATOM 0 H ASP A 75 23.671 29.913 30.152 1.00 0.00 H new ATOM 0 HA ASP A 75 23.843 28.707 32.871 1.00 0.00 H new ATOM 0 HB2 ASP A 75 21.406 29.217 32.755 1.00 0.00 H new ATOM 0 HB3 ASP A 75 22.313 30.616 32.215 1.00 0.00 H new ATOM 1163 N LYS A 76 22.307 26.594 32.422 1.00 0.00 N ATOM 1164 CA LYS A 76 21.966 25.161 32.167 1.00 0.00 C ATOM 1165 C LYS A 76 20.455 24.976 31.933 1.00 0.00 C ATOM 1166 O LYS A 76 19.628 25.602 32.587 1.00 0.00 O ATOM 1167 CB LYS A 76 22.407 24.433 33.436 1.00 0.00 C ATOM 1168 CG LYS A 76 23.877 24.025 33.309 1.00 0.00 C ATOM 1169 CD LYS A 76 24.264 23.121 34.483 1.00 0.00 C ATOM 1170 CE LYS A 76 25.612 23.569 35.053 1.00 0.00 C ATOM 1171 NZ LYS A 76 26.611 23.254 33.992 1.00 0.00 N ATOM 0 H LYS A 76 21.950 26.970 33.300 1.00 0.00 H new ATOM 0 HA LYS A 76 22.456 24.779 31.271 1.00 0.00 H new ATOM 0 HB2 LYS A 76 22.272 25.079 34.304 1.00 0.00 H new ATOM 0 HB3 LYS A 76 21.787 23.551 33.596 1.00 0.00 H new ATOM 0 HG2 LYS A 76 24.039 23.503 32.366 1.00 0.00 H new ATOM 0 HG3 LYS A 76 24.511 24.912 33.296 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.498 23.165 35.257 1.00 0.00 H new ATOM 0 HD3 LYS A 76 24.324 22.084 34.152 1.00 0.00 H new ATOM 0 HE2 LYS A 76 25.607 24.634 35.285 1.00 0.00 H new ATOM 0 HE3 LYS A 76 25.842 23.042 35.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 27.569 23.292 34.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 26.431 22.301 33.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 26.531 23.949 33.223 1.00 0.00 H new ATOM 1185 N ALA A 77 20.096 24.126 31.004 1.00 0.00 N ATOM 1186 CA ALA A 77 18.651 23.865 30.695 1.00 0.00 C ATOM 1187 C ALA A 77 18.093 22.789 31.658 1.00 0.00 C ATOM 1188 O ALA A 77 17.923 23.054 32.838 1.00 0.00 O ATOM 1189 CB ALA A 77 18.698 23.391 29.249 1.00 0.00 C ATOM 0 H ALA A 77 20.753 23.591 30.435 1.00 0.00 H new ATOM 0 HA ALA A 77 17.995 24.727 30.821 1.00 0.00 H new ATOM 0 HB1 ALA A 77 17.688 23.167 28.907 1.00 0.00 H new ATOM 0 HB2 ALA A 77 19.128 24.173 28.623 1.00 0.00 H new ATOM 0 HB3 ALA A 77 19.312 22.493 29.180 1.00 0.00 H new ATOM 1195 N ASN A 78 17.856 21.558 31.226 1.00 0.00 N ATOM 1196 CA ASN A 78 17.396 20.531 32.219 1.00 0.00 C ATOM 1197 C ASN A 78 18.476 20.395 33.268 1.00 0.00 C ATOM 1198 O ASN A 78 18.183 20.164 34.439 1.00 0.00 O ATOM 1199 CB ASN A 78 17.204 19.176 31.510 1.00 0.00 C ATOM 1200 CG ASN A 78 15.855 19.113 30.783 1.00 0.00 C ATOM 1201 OD1 ASN A 78 15.773 18.620 29.660 1.00 0.00 O ATOM 1202 ND2 ASN A 78 14.780 19.576 31.369 1.00 0.00 N ATOM 0 H ASN A 78 17.958 21.235 30.264 1.00 0.00 H new ATOM 0 HA ASN A 78 16.450 20.831 32.670 1.00 0.00 H new ATOM 0 HB2 ASN A 78 18.012 19.019 30.795 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.264 18.369 32.241 1.00 0.00 H new ATOM 0 HD21 ASN A 78 13.879 19.527 30.894 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.844 19.986 32.301 1.00 0.00 H new ATOM 1209 N PRO A 79 19.703 20.609 32.851 1.00 0.00 N ATOM 1210 CA PRO A 79 20.816 20.575 33.831 1.00 0.00 C ATOM 1211 C PRO A 79 20.555 21.672 34.895 1.00 0.00 C ATOM 1212 O PRO A 79 21.099 21.641 35.996 1.00 0.00 O ATOM 1213 CB PRO A 79 22.023 20.861 32.921 1.00 0.00 C ATOM 1214 CG PRO A 79 21.448 21.614 31.789 1.00 0.00 C ATOM 1215 CD PRO A 79 20.191 20.886 31.494 1.00 0.00 C ATOM 0 HA PRO A 79 20.951 19.655 34.399 1.00 0.00 H new ATOM 0 HB2 PRO A 79 22.785 21.442 33.440 1.00 0.00 H new ATOM 0 HB3 PRO A 79 22.498 19.939 32.586 1.00 0.00 H new ATOM 0 HG2 PRO A 79 21.257 22.654 32.054 1.00 0.00 H new ATOM 0 HG3 PRO A 79 22.119 21.622 30.930 1.00 0.00 H new ATOM 0 HD2 PRO A 79 19.490 21.490 30.919 1.00 0.00 H new ATOM 0 HD3 PRO A 79 20.367 19.973 30.925 1.00 0.00 H new ATOM 1223 N ARG A 80 19.686 22.624 34.577 1.00 0.00 N ATOM 1224 CA ARG A 80 19.334 23.698 35.542 1.00 0.00 C ATOM 1225 C ARG A 80 18.778 23.063 36.824 1.00 0.00 C ATOM 1226 O ARG A 80 19.364 23.166 37.901 1.00 0.00 O ATOM 1227 CB ARG A 80 18.248 24.546 34.880 1.00 0.00 C ATOM 1228 CG ARG A 80 18.180 25.920 35.556 1.00 0.00 C ATOM 1229 CD ARG A 80 19.526 26.637 35.413 1.00 0.00 C ATOM 1230 NE ARG A 80 19.213 27.930 34.735 1.00 0.00 N ATOM 1231 CZ ARG A 80 20.089 28.908 34.732 1.00 0.00 C ATOM 1232 NH1 ARG A 80 21.249 28.767 35.321 1.00 0.00 N ATOM 1233 NH2 ARG A 80 19.801 30.033 34.135 1.00 0.00 N ATOM 0 H ARG A 80 19.210 22.688 33.677 1.00 0.00 H new ATOM 0 HA ARG A 80 20.203 24.303 35.799 1.00 0.00 H new ATOM 0 HB2 ARG A 80 18.462 24.663 33.818 1.00 0.00 H new ATOM 0 HB3 ARG A 80 17.284 24.044 34.957 1.00 0.00 H new ATOM 0 HG2 ARG A 80 17.389 26.519 35.104 1.00 0.00 H new ATOM 0 HG3 ARG A 80 17.930 25.804 36.611 1.00 0.00 H new ATOM 0 HD2 ARG A 80 19.988 26.805 36.386 1.00 0.00 H new ATOM 0 HD3 ARG A 80 20.227 26.044 34.825 1.00 0.00 H new ATOM 0 HE ARG A 80 18.313 28.054 34.271 1.00 0.00 H new ATOM 0 HH11 ARG A 80 21.480 27.891 35.789 1.00 0.00 H new ATOM 0 HH12 ARG A 80 21.922 29.534 35.312 1.00 0.00 H new ATOM 0 HH21 ARG A 80 18.899 30.149 33.674 1.00 0.00 H new ATOM 0 HH22 ARG A 80 20.478 30.796 34.130 1.00 0.00 H new ATOM 1247 N GLN A 81 17.652 22.399 36.722 1.00 0.00 N ATOM 1248 CA GLN A 81 17.028 21.733 37.913 1.00 0.00 C ATOM 1249 C GLN A 81 18.045 20.851 38.665 1.00 0.00 C ATOM 1250 O GLN A 81 17.996 20.723 39.888 1.00 0.00 O ATOM 1251 CB GLN A 81 15.902 20.870 37.338 1.00 0.00 C ATOM 1252 CG GLN A 81 14.887 21.760 36.615 1.00 0.00 C ATOM 1253 CD GLN A 81 13.639 21.927 37.483 1.00 0.00 C ATOM 1254 OE1 GLN A 81 12.886 20.977 37.687 1.00 0.00 O ATOM 1255 NE2 GLN A 81 13.375 23.093 38.009 1.00 0.00 N ATOM 0 H GLN A 81 17.130 22.288 35.853 1.00 0.00 H new ATOM 0 HA GLN A 81 16.668 22.466 38.635 1.00 0.00 H new ATOM 0 HB2 GLN A 81 16.312 20.134 36.647 1.00 0.00 H new ATOM 0 HB3 GLN A 81 15.410 20.317 38.138 1.00 0.00 H new ATOM 0 HG2 GLN A 81 15.328 22.734 36.404 1.00 0.00 H new ATOM 0 HG3 GLN A 81 14.618 21.317 35.656 1.00 0.00 H new ATOM 0 HE21 GLN A 81 13.999 23.882 37.840 1.00 0.00 H new ATOM 0 HE22 GLN A 81 12.545 23.215 38.589 1.00 0.00 H new ATOM 1264 N HIS A 82 18.963 20.229 37.950 1.00 0.00 N ATOM 1265 CA HIS A 82 19.969 19.345 38.619 1.00 0.00 C ATOM 1266 C HIS A 82 20.923 20.217 39.458 1.00 0.00 C ATOM 1267 O HIS A 82 21.291 19.874 40.585 1.00 0.00 O ATOM 1268 CB HIS A 82 20.724 18.657 37.479 1.00 0.00 C ATOM 1269 CG HIS A 82 19.758 17.883 36.622 1.00 0.00 C ATOM 1270 ND1 HIS A 82 18.504 17.500 37.076 1.00 0.00 N ATOM 1271 CD2 HIS A 82 19.847 17.415 35.333 1.00 0.00 C ATOM 1272 CE1 HIS A 82 17.897 16.833 36.077 1.00 0.00 C ATOM 1273 NE2 HIS A 82 18.672 16.753 34.992 1.00 0.00 N ATOM 0 H HIS A 82 19.055 20.298 36.936 1.00 0.00 H new ATOM 0 HA HIS A 82 19.514 18.614 39.288 1.00 0.00 H new ATOM 0 HB2 HIS A 82 21.245 19.400 36.875 1.00 0.00 H new ATOM 0 HB3 HIS A 82 21.482 17.987 37.885 1.00 0.00 H new ATOM 0 HD2 HIS A 82 20.700 17.542 34.683 1.00 0.00 H new ATOM 0 HE1 HIS A 82 16.904 16.413 36.144 1.00 0.00 H new ATOM 0 HE2 HIS A 82 18.450 16.303 34.104 1.00 0.00 H new ATOM 1281 N ARG A 83 21.286 21.364 38.952 1.00 0.00 N ATOM 1282 CA ARG A 83 22.162 22.284 39.731 1.00 0.00 C ATOM 1283 C ARG A 83 21.364 22.830 40.920 1.00 0.00 C ATOM 1284 O ARG A 83 21.921 23.176 41.974 1.00 0.00 O ATOM 1285 CB ARG A 83 22.532 23.411 38.766 1.00 0.00 C ATOM 1286 CG ARG A 83 23.714 24.206 39.333 1.00 0.00 C ATOM 1287 CD ARG A 83 23.351 25.693 39.416 1.00 0.00 C ATOM 1288 NE ARG A 83 24.131 26.343 38.319 1.00 0.00 N ATOM 1289 CZ ARG A 83 23.642 26.431 37.104 1.00 0.00 C ATOM 1290 NH1 ARG A 83 22.459 25.954 36.816 1.00 0.00 N ATOM 1291 NH2 ARG A 83 24.349 27.004 36.168 1.00 0.00 N ATOM 0 H ARG A 83 21.013 21.704 38.030 1.00 0.00 H new ATOM 0 HA ARG A 83 23.054 21.794 40.120 1.00 0.00 H new ATOM 0 HB2 ARG A 83 22.792 22.998 37.791 1.00 0.00 H new ATOM 0 HB3 ARG A 83 21.677 24.070 38.615 1.00 0.00 H new ATOM 0 HG2 ARG A 83 23.975 23.831 40.323 1.00 0.00 H new ATOM 0 HG3 ARG A 83 24.591 24.072 38.700 1.00 0.00 H new ATOM 0 HD2 ARG A 83 22.280 25.846 39.283 1.00 0.00 H new ATOM 0 HD3 ARG A 83 23.614 26.110 40.388 1.00 0.00 H new ATOM 0 HE ARG A 83 25.056 26.724 38.517 1.00 0.00 H new ATOM 0 HH11 ARG A 83 21.900 25.505 37.541 1.00 0.00 H new ATOM 0 HH12 ARG A 83 22.095 26.031 35.866 1.00 0.00 H new ATOM 0 HH21 ARG A 83 25.273 27.379 36.384 1.00 0.00 H new ATOM 0 HH22 ARG A 83 23.978 27.077 35.221 1.00 0.00 H new ATOM 1305 N LEU A 84 20.060 22.885 40.798 1.00 0.00 N ATOM 1306 CA LEU A 84 19.273 23.378 41.930 1.00 0.00 C ATOM 1307 C LEU A 84 19.190 22.245 42.956 1.00 0.00 C ATOM 1308 O LEU A 84 19.200 22.478 44.172 1.00 0.00 O ATOM 1309 CB LEU A 84 17.921 23.824 41.398 1.00 0.00 C ATOM 1310 CG LEU A 84 17.891 25.366 41.395 1.00 0.00 C ATOM 1311 CD1 LEU A 84 18.030 25.924 42.831 1.00 0.00 C ATOM 1312 CD2 LEU A 84 19.062 25.881 40.550 1.00 0.00 C ATOM 0 H LEU A 84 19.529 22.611 39.971 1.00 0.00 H new ATOM 0 HA LEU A 84 19.719 24.239 42.428 1.00 0.00 H new ATOM 0 HB2 LEU A 84 17.763 23.438 40.391 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.118 23.429 42.021 1.00 0.00 H new ATOM 0 HG LEU A 84 16.938 25.697 40.981 1.00 0.00 H new ATOM 0 HD11 LEU A 84 18.006 27.013 42.802 1.00 0.00 H new ATOM 0 HD12 LEU A 84 17.206 25.559 43.444 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.976 25.593 43.260 1.00 0.00 H new ATOM 0 HD21 LEU A 84 19.052 26.971 40.540 1.00 0.00 H new ATOM 0 HD22 LEU A 84 20.001 25.531 40.978 1.00 0.00 H new ATOM 0 HD23 LEU A 84 18.967 25.508 39.530 1.00 0.00 H new ATOM 1324 N ASP A 85 19.229 21.015 42.504 1.00 0.00 N ATOM 1325 CA ASP A 85 19.281 19.882 43.470 1.00 0.00 C ATOM 1326 C ASP A 85 20.570 20.055 44.289 1.00 0.00 C ATOM 1327 O ASP A 85 20.613 19.837 45.508 1.00 0.00 O ATOM 1328 CB ASP A 85 19.359 18.622 42.611 1.00 0.00 C ATOM 1329 CG ASP A 85 17.951 18.108 42.313 1.00 0.00 C ATOM 1330 OD1 ASP A 85 17.195 18.833 41.687 1.00 0.00 O ATOM 1331 OD2 ASP A 85 17.652 16.994 42.713 1.00 0.00 O ATOM 0 H ASP A 85 19.227 20.752 41.519 1.00 0.00 H new ATOM 0 HA ASP A 85 18.428 19.834 44.147 1.00 0.00 H new ATOM 0 HB2 ASP A 85 19.881 18.838 41.679 1.00 0.00 H new ATOM 0 HB3 ASP A 85 19.934 17.854 43.128 1.00 0.00 H new ATOM 1336 N LYS A 86 21.615 20.501 43.635 1.00 0.00 N ATOM 1337 CA LYS A 86 22.911 20.756 44.351 1.00 0.00 C ATOM 1338 C LYS A 86 22.677 21.737 45.527 1.00 0.00 C ATOM 1339 O LYS A 86 23.085 21.491 46.665 1.00 0.00 O ATOM 1340 CB LYS A 86 23.833 21.387 43.306 1.00 0.00 C ATOM 1341 CG LYS A 86 25.279 21.343 43.805 1.00 0.00 C ATOM 1342 CD LYS A 86 26.152 22.234 42.918 1.00 0.00 C ATOM 1343 CE LYS A 86 26.278 23.623 43.550 1.00 0.00 C ATOM 1344 NZ LYS A 86 27.542 23.577 44.338 1.00 0.00 N ATOM 0 H LYS A 86 21.629 20.701 42.635 1.00 0.00 H new ATOM 0 HA LYS A 86 23.339 19.844 44.768 1.00 0.00 H new ATOM 0 HB2 LYS A 86 23.747 20.852 42.360 1.00 0.00 H new ATOM 0 HB3 LYS A 86 23.534 22.418 43.117 1.00 0.00 H new ATOM 0 HG2 LYS A 86 25.328 21.682 44.840 1.00 0.00 H new ATOM 0 HG3 LYS A 86 25.650 20.318 43.787 1.00 0.00 H new ATOM 0 HD2 LYS A 86 27.139 21.788 42.797 1.00 0.00 H new ATOM 0 HD3 LYS A 86 25.714 22.315 41.923 1.00 0.00 H new ATOM 0 HE2 LYS A 86 26.317 24.401 42.788 1.00 0.00 H new ATOM 0 HE3 LYS A 86 25.423 23.845 44.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 27.696 24.495 44.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 27.474 22.832 45.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 28.340 23.371 43.703 1.00 0.00 H new ATOM 1358 N ILE A 87 22.008 22.838 45.278 1.00 0.00 N ATOM 1359 CA ILE A 87 21.730 23.827 46.390 1.00 0.00 C ATOM 1360 C ILE A 87 20.972 23.129 47.557 1.00 0.00 C ATOM 1361 O ILE A 87 21.282 23.332 48.729 1.00 0.00 O ATOM 1362 CB ILE A 87 20.920 24.980 45.769 1.00 0.00 C ATOM 1363 CG1 ILE A 87 21.302 25.168 44.289 1.00 0.00 C ATOM 1364 CG2 ILE A 87 21.266 26.264 46.530 1.00 0.00 C ATOM 1365 CD1 ILE A 87 20.868 26.554 43.798 1.00 0.00 C ATOM 0 H ILE A 87 21.641 23.101 44.363 1.00 0.00 H new ATOM 0 HA ILE A 87 22.651 24.219 46.821 1.00 0.00 H new ATOM 0 HB ILE A 87 19.855 24.755 45.834 1.00 0.00 H new ATOM 0 HG12 ILE A 87 22.379 25.053 44.167 1.00 0.00 H new ATOM 0 HG13 ILE A 87 20.828 24.396 43.683 1.00 0.00 H new ATOM 0 HG21 ILE A 87 20.705 27.099 46.110 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.006 26.145 47.582 1.00 0.00 H new ATOM 0 HG23 ILE A 87 22.334 26.463 46.441 1.00 0.00 H new ATOM 0 HD11 ILE A 87 21.145 26.672 42.750 1.00 0.00 H new ATOM 0 HD12 ILE A 87 19.788 26.655 43.901 1.00 0.00 H new ATOM 0 HD13 ILE A 87 21.363 27.322 44.393 1.00 0.00 H new ATOM 1377 N THR A 88 20.028 22.266 47.269 1.00 0.00 N ATOM 1378 CA THR A 88 19.332 21.514 48.370 1.00 0.00 C ATOM 1379 C THR A 88 20.417 20.854 49.245 1.00 0.00 C ATOM 1380 O THR A 88 20.382 20.895 50.476 1.00 0.00 O ATOM 1381 CB THR A 88 18.482 20.458 47.661 1.00 0.00 C ATOM 1382 OG1 THR A 88 17.714 21.079 46.639 1.00 0.00 O ATOM 1383 CG2 THR A 88 17.545 19.789 48.668 1.00 0.00 C ATOM 0 H THR A 88 19.708 22.048 46.325 1.00 0.00 H new ATOM 0 HA THR A 88 18.711 22.142 49.009 1.00 0.00 H new ATOM 0 HB THR A 88 19.135 19.704 47.221 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.170 20.404 46.182 1.00 0.00 H new ATOM 0 HG21 THR A 88 16.941 19.037 48.159 1.00 0.00 H new ATOM 0 HG22 THR A 88 18.134 19.312 49.452 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.891 20.540 49.112 1.00 0.00 H new ATOM 1391 N HIS A 89 21.430 20.302 48.622 1.00 0.00 N ATOM 1392 CA HIS A 89 22.555 19.722 49.419 1.00 0.00 C ATOM 1393 C HIS A 89 23.109 20.852 50.301 1.00 0.00 C ATOM 1394 O HIS A 89 23.412 20.660 51.477 1.00 0.00 O ATOM 1395 CB HIS A 89 23.598 19.259 48.402 1.00 0.00 C ATOM 1396 CG HIS A 89 24.661 18.466 49.110 1.00 0.00 C ATOM 1397 ND1 HIS A 89 25.652 19.072 49.867 1.00 0.00 N ATOM 1398 CD2 HIS A 89 24.898 17.117 49.190 1.00 0.00 C ATOM 1399 CE1 HIS A 89 26.434 18.096 50.366 1.00 0.00 C ATOM 1400 NE2 HIS A 89 26.018 16.886 49.983 1.00 0.00 N ATOM 0 H HIS A 89 21.526 20.228 47.609 1.00 0.00 H new ATOM 0 HA HIS A 89 22.259 18.887 50.054 1.00 0.00 H new ATOM 0 HB2 HIS A 89 23.126 18.650 47.631 1.00 0.00 H new ATOM 0 HB3 HIS A 89 24.042 20.119 47.901 1.00 0.00 H new ATOM 0 HD1 HIS A 89 25.768 20.074 50.018 1.00 0.00 H new ATOM 0 HD2 HIS A 89 24.306 16.351 48.711 1.00 0.00 H new ATOM 0 HE1 HIS A 89 27.292 18.270 50.998 1.00 0.00 H new ATOM 1408 N ALA A 90 23.180 22.056 49.755 1.00 0.00 N ATOM 1409 CA ALA A 90 23.637 23.237 50.563 1.00 0.00 C ATOM 1410 C ALA A 90 22.754 23.316 51.803 1.00 0.00 C ATOM 1411 O ALA A 90 23.194 23.695 52.882 1.00 0.00 O ATOM 1412 CB ALA A 90 23.432 24.490 49.681 1.00 0.00 C ATOM 0 H ALA A 90 22.940 22.266 48.786 1.00 0.00 H new ATOM 0 HA ALA A 90 24.681 23.159 50.866 1.00 0.00 H new ATOM 0 HB1 ALA A 90 23.752 25.377 50.229 1.00 0.00 H new ATOM 0 HB2 ALA A 90 24.022 24.394 48.770 1.00 0.00 H new ATOM 0 HB3 ALA A 90 22.377 24.584 49.422 1.00 0.00 H new ATOM 1418 N CYS A 91 21.516 22.902 51.678 1.00 0.00 N ATOM 1419 CA CYS A 91 20.609 22.898 52.866 1.00 0.00 C ATOM 1420 C CYS A 91 21.195 21.958 53.914 1.00 0.00 C ATOM 1421 O CYS A 91 21.472 22.343 55.058 1.00 0.00 O ATOM 1422 CB CYS A 91 19.262 22.331 52.352 1.00 0.00 C ATOM 1423 SG CYS A 91 18.383 21.405 53.664 1.00 0.00 S ATOM 0 H CYS A 91 21.097 22.569 50.810 1.00 0.00 H new ATOM 0 HA CYS A 91 20.486 23.886 53.309 1.00 0.00 H new ATOM 0 HB2 CYS A 91 18.633 23.148 51.997 1.00 0.00 H new ATOM 0 HB3 CYS A 91 19.443 21.675 51.500 1.00 0.00 H new ATOM 0 HG CYS A 91 17.226 21.955 53.882 1.00 0.00 H new ATOM 1429 N ARG A 92 21.394 20.729 53.541 1.00 0.00 N ATOM 1430 CA ARG A 92 21.965 19.739 54.502 1.00 0.00 C ATOM 1431 C ARG A 92 23.230 20.296 55.175 1.00 0.00 C ATOM 1432 O ARG A 92 23.340 20.338 56.397 1.00 0.00 O ATOM 1433 CB ARG A 92 22.305 18.512 53.651 1.00 0.00 C ATOM 1434 CG ARG A 92 22.480 17.291 54.557 1.00 0.00 C ATOM 1435 CD ARG A 92 22.741 16.049 53.699 1.00 0.00 C ATOM 1436 NE ARG A 92 24.151 16.191 53.229 1.00 0.00 N ATOM 1437 CZ ARG A 92 24.733 15.224 52.561 1.00 0.00 C ATOM 1438 NH1 ARG A 92 24.092 14.115 52.293 1.00 0.00 N ATOM 1439 NH2 ARG A 92 25.967 15.370 52.160 1.00 0.00 N ATOM 0 H ARG A 92 21.187 20.362 52.612 1.00 0.00 H new ATOM 0 HA ARG A 92 21.267 19.503 55.305 1.00 0.00 H new ATOM 0 HB2 ARG A 92 21.512 18.329 52.926 1.00 0.00 H new ATOM 0 HB3 ARG A 92 23.219 18.691 53.085 1.00 0.00 H new ATOM 0 HG2 ARG A 92 23.310 17.452 55.245 1.00 0.00 H new ATOM 0 HG3 ARG A 92 21.587 17.145 55.164 1.00 0.00 H new ATOM 0 HD2 ARG A 92 22.608 15.135 54.278 1.00 0.00 H new ATOM 0 HD3 ARG A 92 22.049 15.998 52.859 1.00 0.00 H new ATOM 0 HE ARG A 92 24.666 17.048 53.429 1.00 0.00 H new ATOM 0 HH11 ARG A 92 23.128 13.995 52.604 1.00 0.00 H new ATOM 0 HH12 ARG A 92 24.556 13.371 51.773 1.00 0.00 H new ATOM 0 HH21 ARG A 92 26.472 16.232 52.367 1.00 0.00 H new ATOM 0 HH22 ARG A 92 26.426 14.622 51.640 1.00 0.00 H new ATOM 1453 N LEU A 93 24.184 20.710 54.392 1.00 0.00 N ATOM 1454 CA LEU A 93 25.466 21.256 54.947 1.00 0.00 C ATOM 1455 C LEU A 93 25.234 22.442 55.908 1.00 0.00 C ATOM 1456 O LEU A 93 25.943 22.584 56.914 1.00 0.00 O ATOM 1457 CB LEU A 93 26.229 21.715 53.696 1.00 0.00 C ATOM 1458 CG LEU A 93 27.724 21.882 53.986 1.00 0.00 C ATOM 1459 CD1 LEU A 93 27.949 23.150 54.811 1.00 0.00 C ATOM 1460 CD2 LEU A 93 28.257 20.660 54.743 1.00 0.00 C ATOM 0 H LEU A 93 24.135 20.696 53.373 1.00 0.00 H new ATOM 0 HA LEU A 93 26.002 20.515 55.540 1.00 0.00 H new ATOM 0 HB2 LEU A 93 26.091 20.988 52.896 1.00 0.00 H new ATOM 0 HB3 LEU A 93 25.817 22.660 53.343 1.00 0.00 H new ATOM 0 HG LEU A 93 28.262 21.968 53.042 1.00 0.00 H new ATOM 0 HD11 LEU A 93 29.013 23.267 55.016 1.00 0.00 H new ATOM 0 HD12 LEU A 93 27.590 24.015 54.254 1.00 0.00 H new ATOM 0 HD13 LEU A 93 27.404 23.073 55.752 1.00 0.00 H new ATOM 0 HD21 LEU A 93 29.320 20.791 54.943 1.00 0.00 H new ATOM 0 HD22 LEU A 93 27.721 20.554 55.686 1.00 0.00 H new ATOM 0 HD23 LEU A 93 28.109 19.765 54.139 1.00 0.00 H new ATOM 1472 N LEU A 94 24.268 23.289 55.600 1.00 0.00 N ATOM 1473 CA LEU A 94 23.978 24.502 56.441 1.00 0.00 C ATOM 1474 C LEU A 94 23.390 24.086 57.785 1.00 0.00 C ATOM 1475 O LEU A 94 23.291 24.886 58.715 1.00 0.00 O ATOM 1476 CB LEU A 94 22.923 25.287 55.616 1.00 0.00 C ATOM 1477 CG LEU A 94 23.562 26.466 54.864 1.00 0.00 C ATOM 1478 CD1 LEU A 94 24.239 25.966 53.583 1.00 0.00 C ATOM 1479 CD2 LEU A 94 22.467 27.468 54.475 1.00 0.00 C ATOM 0 H LEU A 94 23.660 23.186 54.787 1.00 0.00 H new ATOM 0 HA LEU A 94 24.871 25.089 56.655 1.00 0.00 H new ATOM 0 HB2 LEU A 94 22.444 24.616 54.903 1.00 0.00 H new ATOM 0 HB3 LEU A 94 22.142 25.657 56.280 1.00 0.00 H new ATOM 0 HG LEU A 94 24.302 26.939 55.510 1.00 0.00 H new ATOM 0 HD11 LEU A 94 24.689 26.808 53.057 1.00 0.00 H new ATOM 0 HD12 LEU A 94 25.013 25.243 53.839 1.00 0.00 H new ATOM 0 HD13 LEU A 94 23.497 25.491 52.941 1.00 0.00 H new ATOM 0 HD21 LEU A 94 22.914 28.307 53.941 1.00 0.00 H new ATOM 0 HD22 LEU A 94 21.736 26.977 53.832 1.00 0.00 H new ATOM 0 HD23 LEU A 94 21.972 27.833 55.375 1.00 0.00 H new ATOM 1491 N GLU A 95 23.037 22.844 57.920 1.00 0.00 N ATOM 1492 CA GLU A 95 22.502 22.369 59.224 1.00 0.00 C ATOM 1493 C GLU A 95 23.257 21.107 59.648 1.00 0.00 C ATOM 1494 O GLU A 95 23.073 20.593 60.749 1.00 0.00 O ATOM 1495 CB GLU A 95 21.025 22.065 58.983 1.00 0.00 C ATOM 1496 CG GLU A 95 20.423 21.401 60.233 1.00 0.00 C ATOM 1497 CD GLU A 95 20.676 22.274 61.467 1.00 0.00 C ATOM 1498 OE1 GLU A 95 21.822 22.383 61.872 1.00 0.00 O ATOM 1499 OE2 GLU A 95 19.717 22.816 61.990 1.00 0.00 O ATOM 0 H GLU A 95 23.094 22.137 57.187 1.00 0.00 H new ATOM 0 HA GLU A 95 22.622 23.107 60.017 1.00 0.00 H new ATOM 0 HB2 GLU A 95 20.487 22.985 58.753 1.00 0.00 H new ATOM 0 HB3 GLU A 95 20.915 21.407 58.121 1.00 0.00 H new ATOM 0 HG2 GLU A 95 19.352 21.254 60.096 1.00 0.00 H new ATOM 0 HG3 GLU A 95 20.864 20.415 60.379 1.00 0.00 H new ATOM 1506 N GLN A 96 24.118 20.605 58.800 1.00 0.00 N ATOM 1507 CA GLN A 96 24.895 19.397 59.163 1.00 0.00 C ATOM 1508 C GLN A 96 26.199 19.810 59.845 1.00 0.00 C ATOM 1509 O GLN A 96 26.405 19.542 61.027 1.00 0.00 O ATOM 1510 CB GLN A 96 25.179 18.686 57.839 1.00 0.00 C ATOM 1511 CG GLN A 96 25.817 17.322 58.116 1.00 0.00 C ATOM 1512 CD GLN A 96 26.539 16.830 56.861 1.00 0.00 C ATOM 1513 OE1 GLN A 96 27.401 17.521 56.323 1.00 0.00 O ATOM 1514 NE2 GLN A 96 26.233 15.663 56.360 1.00 0.00 N ATOM 0 H GLN A 96 24.312 20.984 57.873 1.00 0.00 H new ATOM 0 HA GLN A 96 24.358 18.749 59.856 1.00 0.00 H new ATOM 0 HB2 GLN A 96 24.254 18.559 57.277 1.00 0.00 H new ATOM 0 HB3 GLN A 96 25.845 19.292 57.224 1.00 0.00 H new ATOM 0 HG2 GLN A 96 26.520 17.400 58.945 1.00 0.00 H new ATOM 0 HG3 GLN A 96 25.052 16.605 58.413 1.00 0.00 H new ATOM 0 HE21 GLN A 96 25.518 15.088 56.806 1.00 0.00 H new ATOM 0 HE22 GLN A 96 26.709 15.326 55.523 1.00 0.00 H new ATOM 1523 N GLU A 97 27.087 20.468 59.135 1.00 0.00 N ATOM 1524 CA GLU A 97 28.361 20.894 59.788 1.00 0.00 C ATOM 1525 C GLU A 97 28.202 22.270 60.442 1.00 0.00 C ATOM 1526 O GLU A 97 27.098 22.696 60.778 1.00 0.00 O ATOM 1527 CB GLU A 97 29.419 20.904 58.682 1.00 0.00 C ATOM 1528 CG GLU A 97 29.184 22.066 57.720 1.00 0.00 C ATOM 1529 CD GLU A 97 30.196 21.974 56.573 1.00 0.00 C ATOM 1530 OE1 GLU A 97 30.583 20.865 56.240 1.00 0.00 O ATOM 1531 OE2 GLU A 97 30.571 23.008 56.050 1.00 0.00 O ATOM 0 H GLU A 97 26.986 20.723 58.152 1.00 0.00 H new ATOM 0 HA GLU A 97 28.652 20.216 60.590 1.00 0.00 H new ATOM 0 HB2 GLU A 97 30.412 20.986 59.123 1.00 0.00 H new ATOM 0 HB3 GLU A 97 29.390 19.961 58.135 1.00 0.00 H new ATOM 0 HG2 GLU A 97 28.167 22.032 57.329 1.00 0.00 H new ATOM 0 HG3 GLU A 97 29.293 23.016 58.243 1.00 0.00 H new ATOM 1538 N THR A 98 29.286 22.979 60.606 1.00 0.00 N ATOM 1539 CA THR A 98 29.215 24.340 61.213 1.00 0.00 C ATOM 1540 C THR A 98 29.399 25.416 60.120 1.00 0.00 C ATOM 1541 O THR A 98 28.472 26.175 59.845 1.00 0.00 O ATOM 1542 CB THR A 98 30.335 24.370 62.266 1.00 0.00 C ATOM 1543 OG1 THR A 98 29.884 23.712 63.442 1.00 0.00 O ATOM 1544 CG2 THR A 98 30.711 25.815 62.605 1.00 0.00 C ATOM 0 H THR A 98 30.223 22.673 60.344 1.00 0.00 H new ATOM 0 HA THR A 98 28.251 24.551 61.676 1.00 0.00 H new ATOM 0 HB THR A 98 31.214 23.864 61.866 1.00 0.00 H new ATOM 0 HG1 THR A 98 30.594 23.726 64.117 1.00 0.00 H new ATOM 0 HG21 THR A 98 31.505 25.819 63.352 1.00 0.00 H new ATOM 0 HG22 THR A 98 31.058 26.322 61.704 1.00 0.00 H new ATOM 0 HG23 THR A 98 29.838 26.335 63.001 1.00 0.00 H new ATOM 1552 N PRO A 99 30.522 25.402 59.460 1.00 0.00 N ATOM 1553 CA PRO A 99 30.697 26.348 58.354 1.00 0.00 C ATOM 1554 C PRO A 99 29.645 25.983 57.313 1.00 0.00 C ATOM 1555 O PRO A 99 29.476 24.820 56.965 1.00 0.00 O ATOM 1556 CB PRO A 99 32.127 26.094 57.876 1.00 0.00 C ATOM 1557 CG PRO A 99 32.426 24.704 58.330 1.00 0.00 C ATOM 1558 CD PRO A 99 31.695 24.538 59.637 1.00 0.00 C ATOM 0 HA PRO A 99 30.571 27.403 58.596 1.00 0.00 H new ATOM 0 HB2 PRO A 99 32.206 26.184 56.793 1.00 0.00 H new ATOM 0 HB3 PRO A 99 32.824 26.812 58.308 1.00 0.00 H new ATOM 0 HG2 PRO A 99 32.089 23.971 57.597 1.00 0.00 H new ATOM 0 HG3 PRO A 99 33.498 24.556 58.459 1.00 0.00 H new ATOM 0 HD2 PRO A 99 31.411 23.501 59.814 1.00 0.00 H new ATOM 0 HD3 PRO A 99 32.304 24.851 60.485 1.00 0.00 H new ATOM 1566 N VAL A 100 28.913 26.934 56.840 1.00 0.00 N ATOM 1567 CA VAL A 100 27.845 26.621 55.855 1.00 0.00 C ATOM 1568 C VAL A 100 28.515 26.416 54.509 1.00 0.00 C ATOM 1569 O VAL A 100 29.673 26.796 54.339 1.00 0.00 O ATOM 1570 CB VAL A 100 26.982 27.890 55.876 1.00 0.00 C ATOM 1571 CG1 VAL A 100 26.248 28.101 54.555 1.00 0.00 C ATOM 1572 CG2 VAL A 100 25.970 27.798 57.023 1.00 0.00 C ATOM 0 H VAL A 100 29.002 27.919 57.089 1.00 0.00 H new ATOM 0 HA VAL A 100 27.254 25.729 56.063 1.00 0.00 H new ATOM 0 HB VAL A 100 27.643 28.744 56.025 1.00 0.00 H new ATOM 0 HG11 VAL A 100 25.649 29.010 54.613 1.00 0.00 H new ATOM 0 HG12 VAL A 100 26.973 28.195 53.747 1.00 0.00 H new ATOM 0 HG13 VAL A 100 25.597 27.249 54.361 1.00 0.00 H new ATOM 0 HG21 VAL A 100 25.356 28.698 57.040 1.00 0.00 H new ATOM 0 HG22 VAL A 100 25.332 26.926 56.876 1.00 0.00 H new ATOM 0 HG23 VAL A 100 26.501 27.704 57.970 1.00 0.00 H new ATOM 1582 N THR A 101 27.848 25.857 53.531 1.00 0.00 N ATOM 1583 CA THR A 101 28.573 25.724 52.248 1.00 0.00 C ATOM 1584 C THR A 101 27.955 26.699 51.306 1.00 0.00 C ATOM 1585 O THR A 101 26.979 26.431 50.606 1.00 0.00 O ATOM 1586 CB THR A 101 28.299 24.339 51.682 1.00 0.00 C ATOM 1587 OG1 THR A 101 27.335 23.690 52.468 1.00 0.00 O ATOM 1588 CG2 THR A 101 29.591 23.522 51.681 1.00 0.00 C ATOM 0 H THR A 101 26.890 25.508 53.563 1.00 0.00 H new ATOM 0 HA THR A 101 29.642 25.888 52.383 1.00 0.00 H new ATOM 0 HB THR A 101 27.928 24.434 50.661 1.00 0.00 H new ATOM 0 HG1 THR A 101 26.476 23.686 51.996 1.00 0.00 H new ATOM 0 HG21 THR A 101 29.394 22.530 51.275 1.00 0.00 H new ATOM 0 HG22 THR A 101 30.338 24.024 51.066 1.00 0.00 H new ATOM 0 HG23 THR A 101 29.964 23.429 52.701 1.00 0.00 H new ATOM 1596 N LEU A 102 28.568 27.793 51.241 1.00 0.00 N ATOM 1597 CA LEU A 102 28.156 28.829 50.316 1.00 0.00 C ATOM 1598 C LEU A 102 29.418 29.315 49.626 1.00 0.00 C ATOM 1599 O LEU A 102 29.399 29.719 48.469 1.00 0.00 O ATOM 1600 CB LEU A 102 27.458 29.914 51.147 1.00 0.00 C ATOM 1601 CG LEU A 102 25.940 29.799 50.920 1.00 0.00 C ATOM 1602 CD1 LEU A 102 25.379 28.637 51.743 1.00 0.00 C ATOM 1603 CD2 LEU A 102 25.229 31.092 51.337 1.00 0.00 C ATOM 0 H LEU A 102 29.377 28.032 51.814 1.00 0.00 H new ATOM 0 HA LEU A 102 27.457 28.499 49.548 1.00 0.00 H new ATOM 0 HB2 LEU A 102 27.694 29.792 52.204 1.00 0.00 H new ATOM 0 HB3 LEU A 102 27.811 30.902 50.854 1.00 0.00 H new ATOM 0 HG LEU A 102 25.767 29.623 49.858 1.00 0.00 H new ATOM 0 HD11 LEU A 102 24.304 28.560 51.579 1.00 0.00 H new ATOM 0 HD12 LEU A 102 25.860 27.708 51.436 1.00 0.00 H new ATOM 0 HD13 LEU A 102 25.572 28.814 52.801 1.00 0.00 H new ATOM 0 HD21 LEU A 102 24.157 30.989 51.168 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.413 31.284 52.394 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.611 31.924 50.746 1.00 0.00 H new ATOM 1615 N GLU A 103 30.535 29.299 50.338 1.00 0.00 N ATOM 1616 CA GLU A 103 31.833 29.789 49.769 1.00 0.00 C ATOM 1617 C GLU A 103 32.047 29.384 48.302 1.00 0.00 C ATOM 1618 O GLU A 103 32.443 30.215 47.489 1.00 0.00 O ATOM 1619 CB GLU A 103 32.906 29.151 50.651 1.00 0.00 C ATOM 1620 CG GLU A 103 34.220 29.917 50.491 1.00 0.00 C ATOM 1621 CD GLU A 103 34.332 30.976 51.590 1.00 0.00 C ATOM 1622 OE1 GLU A 103 33.313 31.545 51.943 1.00 0.00 O ATOM 1623 OE2 GLU A 103 35.437 31.200 52.058 1.00 0.00 O ATOM 0 H GLU A 103 30.595 28.962 51.299 1.00 0.00 H new ATOM 0 HA GLU A 103 31.859 30.879 49.767 1.00 0.00 H new ATOM 0 HB2 GLU A 103 32.590 29.164 51.694 1.00 0.00 H new ATOM 0 HB3 GLU A 103 33.046 28.106 50.374 1.00 0.00 H new ATOM 0 HG2 GLU A 103 35.063 29.229 50.547 1.00 0.00 H new ATOM 0 HG3 GLU A 103 34.260 30.390 49.510 1.00 0.00 H new ATOM 1630 N ALA A 104 31.808 28.151 47.927 1.00 0.00 N ATOM 1631 CA ALA A 104 32.030 27.784 46.493 1.00 0.00 C ATOM 1632 C ALA A 104 30.929 28.425 45.648 1.00 0.00 C ATOM 1633 O ALA A 104 31.164 28.913 44.542 1.00 0.00 O ATOM 1634 CB ALA A 104 31.927 26.259 46.449 1.00 0.00 C ATOM 0 H ALA A 104 31.477 27.400 48.533 1.00 0.00 H new ATOM 0 HA ALA A 104 32.990 28.126 46.107 1.00 0.00 H new ATOM 0 HB1 ALA A 104 32.079 25.913 45.427 1.00 0.00 H new ATOM 0 HB2 ALA A 104 32.689 25.824 47.096 1.00 0.00 H new ATOM 0 HB3 ALA A 104 30.940 25.951 46.793 1.00 0.00 H new ATOM 1640 N LEU A 105 29.732 28.445 46.168 1.00 0.00 N ATOM 1641 CA LEU A 105 28.597 29.065 45.429 1.00 0.00 C ATOM 1642 C LEU A 105 28.825 30.576 45.302 1.00 0.00 C ATOM 1643 O LEU A 105 28.863 31.126 44.202 1.00 0.00 O ATOM 1644 CB LEU A 105 27.362 28.778 46.288 1.00 0.00 C ATOM 1645 CG LEU A 105 26.611 27.561 45.734 1.00 0.00 C ATOM 1646 CD1 LEU A 105 26.275 26.605 46.882 1.00 0.00 C ATOM 1647 CD2 LEU A 105 25.312 28.018 45.059 1.00 0.00 C ATOM 0 H LEU A 105 29.491 28.056 47.079 1.00 0.00 H new ATOM 0 HA LEU A 105 28.489 28.669 44.419 1.00 0.00 H new ATOM 0 HB2 LEU A 105 27.661 28.593 47.320 1.00 0.00 H new ATOM 0 HB3 LEU A 105 26.705 29.648 46.298 1.00 0.00 H new ATOM 0 HG LEU A 105 27.239 27.052 45.003 1.00 0.00 H new ATOM 0 HD11 LEU A 105 25.741 25.739 46.490 1.00 0.00 H new ATOM 0 HD12 LEU A 105 27.196 26.276 47.363 1.00 0.00 H new ATOM 0 HD13 LEU A 105 25.648 27.118 47.611 1.00 0.00 H new ATOM 0 HD21 LEU A 105 24.781 27.151 44.667 1.00 0.00 H new ATOM 0 HD22 LEU A 105 24.683 28.529 45.788 1.00 0.00 H new ATOM 0 HD23 LEU A 105 25.547 28.700 44.242 1.00 0.00 H new ATOM 1659 N ALA A 106 28.980 31.253 46.410 1.00 0.00 N ATOM 1660 CA ALA A 106 29.210 32.727 46.375 1.00 0.00 C ATOM 1661 C ALA A 106 30.407 33.064 45.481 1.00 0.00 C ATOM 1662 O ALA A 106 30.383 34.040 44.733 1.00 0.00 O ATOM 1663 CB ALA A 106 29.500 33.121 47.824 1.00 0.00 C ATOM 0 H ALA A 106 28.957 30.844 47.344 1.00 0.00 H new ATOM 0 HA ALA A 106 28.352 33.263 45.968 1.00 0.00 H new ATOM 0 HB1 ALA A 106 29.680 34.195 47.880 1.00 0.00 H new ATOM 0 HB2 ALA A 106 28.645 32.864 48.449 1.00 0.00 H new ATOM 0 HB3 ALA A 106 30.382 32.586 48.177 1.00 0.00 H new ATOM 1669 N ASP A 107 31.452 32.276 45.543 1.00 0.00 N ATOM 1670 CA ASP A 107 32.646 32.539 44.700 1.00 0.00 C ATOM 1671 C ASP A 107 32.292 32.391 43.215 1.00 0.00 C ATOM 1672 O ASP A 107 32.755 33.157 42.371 1.00 0.00 O ATOM 1673 CB ASP A 107 33.635 31.463 45.133 1.00 0.00 C ATOM 1674 CG ASP A 107 34.493 31.985 46.285 1.00 0.00 C ATOM 1675 OD1 ASP A 107 33.941 32.241 47.341 1.00 0.00 O ATOM 1676 OD2 ASP A 107 35.691 32.122 46.091 1.00 0.00 O ATOM 0 H ASP A 107 31.524 31.458 46.148 1.00 0.00 H new ATOM 0 HA ASP A 107 33.043 33.547 44.820 1.00 0.00 H new ATOM 0 HB2 ASP A 107 33.099 30.566 45.444 1.00 0.00 H new ATOM 0 HB3 ASP A 107 34.270 31.180 44.293 1.00 0.00 H new ATOM 1681 N GLN A 108 31.483 31.420 42.880 1.00 0.00 N ATOM 1682 CA GLN A 108 31.099 31.217 41.452 1.00 0.00 C ATOM 1683 C GLN A 108 30.258 32.397 40.943 1.00 0.00 C ATOM 1684 O GLN A 108 30.438 32.866 39.822 1.00 0.00 O ATOM 1685 CB GLN A 108 30.280 29.920 41.441 1.00 0.00 C ATOM 1686 CG GLN A 108 29.688 29.683 40.048 1.00 0.00 C ATOM 1687 CD GLN A 108 30.816 29.472 39.036 1.00 0.00 C ATOM 1688 OE1 GLN A 108 31.820 28.835 39.341 1.00 0.00 O ATOM 1689 NE2 GLN A 108 30.700 29.975 37.837 1.00 0.00 N ATOM 0 H GLN A 108 31.071 30.757 43.536 1.00 0.00 H new ATOM 0 HA GLN A 108 31.970 31.155 40.799 1.00 0.00 H new ATOM 0 HB2 GLN A 108 30.913 29.079 41.724 1.00 0.00 H new ATOM 0 HB3 GLN A 108 29.480 29.979 42.179 1.00 0.00 H new ATOM 0 HG2 GLN A 108 29.034 28.812 40.064 1.00 0.00 H new ATOM 0 HG3 GLN A 108 29.076 30.536 39.753 1.00 0.00 H new ATOM 0 HE21 GLN A 108 29.865 30.504 37.584 1.00 0.00 H new ATOM 0 HE22 GLN A 108 31.444 29.839 37.153 1.00 0.00 H new ATOM 1698 N VAL A 109 29.338 32.880 41.736 1.00 0.00 N ATOM 1699 CA VAL A 109 28.482 34.024 41.286 1.00 0.00 C ATOM 1700 C VAL A 109 29.150 35.368 41.607 1.00 0.00 C ATOM 1701 O VAL A 109 28.830 36.394 41.011 1.00 0.00 O ATOM 1702 CB VAL A 109 27.179 33.892 42.075 1.00 0.00 C ATOM 1703 CG1 VAL A 109 26.088 34.731 41.405 1.00 0.00 C ATOM 1704 CG2 VAL A 109 26.738 32.428 42.119 1.00 0.00 C ATOM 0 H VAL A 109 29.140 32.534 42.675 1.00 0.00 H new ATOM 0 HA VAL A 109 28.320 33.997 40.208 1.00 0.00 H new ATOM 0 HB VAL A 109 27.343 34.247 43.093 1.00 0.00 H new ATOM 0 HG11 VAL A 109 25.159 34.637 41.968 1.00 0.00 H new ATOM 0 HG12 VAL A 109 26.395 35.777 41.384 1.00 0.00 H new ATOM 0 HG13 VAL A 109 25.932 34.378 40.386 1.00 0.00 H new ATOM 0 HG21 VAL A 109 25.809 32.345 42.683 1.00 0.00 H new ATOM 0 HG22 VAL A 109 26.580 32.065 41.103 1.00 0.00 H new ATOM 0 HG23 VAL A 109 27.511 31.830 42.602 1.00 0.00 H new ATOM 1714 N ALA A 110 30.057 35.376 42.554 1.00 0.00 N ATOM 1715 CA ALA A 110 30.762 36.635 42.962 1.00 0.00 C ATOM 1716 C ALA A 110 29.873 37.466 43.895 1.00 0.00 C ATOM 1717 O ALA A 110 29.828 38.690 43.797 1.00 0.00 O ATOM 1718 CB ALA A 110 31.067 37.404 41.670 1.00 0.00 C ATOM 0 H ALA A 110 30.345 34.546 43.073 1.00 0.00 H new ATOM 0 HA ALA A 110 31.680 36.415 43.507 1.00 0.00 H new ATOM 0 HB1 ALA A 110 31.583 38.333 41.913 1.00 0.00 H new ATOM 0 HB2 ALA A 110 31.701 36.795 41.025 1.00 0.00 H new ATOM 0 HB3 ALA A 110 30.135 37.631 41.153 1.00 0.00 H new ATOM 1724 N MET A 111 29.154 36.832 44.796 1.00 0.00 N ATOM 1725 CA MET A 111 28.268 37.620 45.717 1.00 0.00 C ATOM 1726 C MET A 111 28.364 37.140 47.182 1.00 0.00 C ATOM 1727 O MET A 111 28.919 36.086 47.485 1.00 0.00 O ATOM 1728 CB MET A 111 26.847 37.435 45.171 1.00 0.00 C ATOM 1729 CG MET A 111 26.585 35.960 44.849 1.00 0.00 C ATOM 1730 SD MET A 111 24.880 35.543 45.284 1.00 0.00 S ATOM 1731 CE MET A 111 24.567 34.352 43.961 1.00 0.00 C ATOM 0 H MET A 111 29.141 35.821 44.932 1.00 0.00 H new ATOM 0 HA MET A 111 28.569 38.667 45.740 1.00 0.00 H new ATOM 0 HB2 MET A 111 26.121 37.788 45.903 1.00 0.00 H new ATOM 0 HB3 MET A 111 26.714 38.039 44.273 1.00 0.00 H new ATOM 0 HG2 MET A 111 26.758 35.772 43.789 1.00 0.00 H new ATOM 0 HG3 MET A 111 27.278 35.327 45.403 1.00 0.00 H new ATOM 0 HE1 MET A 111 23.932 33.549 44.337 1.00 0.00 H new ATOM 0 HE2 MET A 111 24.067 34.852 43.132 1.00 0.00 H new ATOM 0 HE3 MET A 111 25.513 33.935 43.615 1.00 0.00 H new ATOM 1741 N SER A 112 27.835 37.933 48.090 1.00 0.00 N ATOM 1742 CA SER A 112 27.871 37.609 49.560 1.00 0.00 C ATOM 1743 C SER A 112 26.895 36.471 49.925 1.00 0.00 C ATOM 1744 O SER A 112 26.096 36.045 49.094 1.00 0.00 O ATOM 1745 CB SER A 112 27.464 38.916 50.251 1.00 0.00 C ATOM 1746 OG SER A 112 26.087 38.865 50.605 1.00 0.00 O ATOM 0 H SER A 112 27.368 38.813 47.869 1.00 0.00 H new ATOM 0 HA SER A 112 28.855 37.257 49.869 1.00 0.00 H new ATOM 0 HB2 SER A 112 28.072 39.072 51.142 1.00 0.00 H new ATOM 0 HB3 SER A 112 27.647 39.761 49.588 1.00 0.00 H new ATOM 0 HG SER A 112 25.832 39.701 51.047 1.00 0.00 H new ATOM 1752 N PRO A 113 26.997 36.000 51.156 1.00 0.00 N ATOM 1753 CA PRO A 113 26.122 34.886 51.632 1.00 0.00 C ATOM 1754 C PRO A 113 24.639 35.274 51.592 1.00 0.00 C ATOM 1755 O PRO A 113 23.786 34.443 51.276 1.00 0.00 O ATOM 1756 CB PRO A 113 26.607 34.631 53.059 1.00 0.00 C ATOM 1757 CG PRO A 113 27.255 35.912 53.466 1.00 0.00 C ATOM 1758 CD PRO A 113 27.901 36.456 52.220 1.00 0.00 C ATOM 0 HA PRO A 113 26.191 33.998 51.003 1.00 0.00 H new ATOM 0 HB2 PRO A 113 25.779 34.377 53.721 1.00 0.00 H new ATOM 0 HB3 PRO A 113 27.311 33.800 53.097 1.00 0.00 H new ATOM 0 HG2 PRO A 113 26.521 36.613 53.864 1.00 0.00 H new ATOM 0 HG3 PRO A 113 27.994 35.745 54.249 1.00 0.00 H new ATOM 0 HD2 PRO A 113 27.978 37.543 52.246 1.00 0.00 H new ATOM 0 HD3 PRO A 113 28.911 36.068 52.086 1.00 0.00 H new ATOM 1766 N PHE A 114 24.298 36.513 51.853 1.00 0.00 N ATOM 1767 CA PHE A 114 22.857 36.885 51.764 1.00 0.00 C ATOM 1768 C PHE A 114 22.422 36.854 50.312 1.00 0.00 C ATOM 1769 O PHE A 114 21.330 36.380 49.999 1.00 0.00 O ATOM 1770 CB PHE A 114 22.690 38.300 52.330 1.00 0.00 C ATOM 1771 CG PHE A 114 22.856 38.320 53.835 1.00 0.00 C ATOM 1772 CD1 PHE A 114 23.171 37.156 54.541 1.00 0.00 C ATOM 1773 CD2 PHE A 114 22.667 39.521 54.522 1.00 0.00 C ATOM 1774 CE1 PHE A 114 23.303 37.195 55.934 1.00 0.00 C ATOM 1775 CE2 PHE A 114 22.799 39.563 55.915 1.00 0.00 C ATOM 1776 CZ PHE A 114 23.118 38.399 56.621 1.00 0.00 C ATOM 0 H PHE A 114 24.938 37.263 52.117 1.00 0.00 H new ATOM 0 HA PHE A 114 22.245 36.184 52.332 1.00 0.00 H new ATOM 0 HB2 PHE A 114 23.424 38.964 51.873 1.00 0.00 H new ATOM 0 HB3 PHE A 114 21.705 38.684 52.067 1.00 0.00 H new ATOM 0 HD1 PHE A 114 23.313 36.225 54.011 1.00 0.00 H new ATOM 0 HD2 PHE A 114 22.418 40.420 53.977 1.00 0.00 H new ATOM 0 HE1 PHE A 114 23.548 36.295 56.478 1.00 0.00 H new ATOM 0 HE2 PHE A 114 22.655 40.494 56.444 1.00 0.00 H new ATOM 0 HZ PHE A 114 23.221 38.430 57.696 1.00 0.00 H new ATOM 1786 N HIS A 115 23.231 37.333 49.406 1.00 0.00 N ATOM 1787 CA HIS A 115 22.785 37.284 48.001 1.00 0.00 C ATOM 1788 C HIS A 115 22.780 35.829 47.487 1.00 0.00 C ATOM 1789 O HIS A 115 21.953 35.460 46.656 1.00 0.00 O ATOM 1790 CB HIS A 115 23.675 38.189 47.171 1.00 0.00 C ATOM 1791 CG HIS A 115 22.794 38.679 46.064 1.00 0.00 C ATOM 1792 ND1 HIS A 115 22.315 37.819 45.092 1.00 0.00 N ATOM 1793 CD2 HIS A 115 22.162 39.876 45.855 1.00 0.00 C ATOM 1794 CE1 HIS A 115 21.420 38.497 44.358 1.00 0.00 C ATOM 1795 NE2 HIS A 115 21.283 39.759 44.779 1.00 0.00 N ATOM 0 H HIS A 115 24.150 37.742 49.576 1.00 0.00 H new ATOM 0 HA HIS A 115 21.760 37.646 47.917 1.00 0.00 H new ATOM 0 HB2 HIS A 115 24.062 39.017 47.765 1.00 0.00 H new ATOM 0 HB3 HIS A 115 24.537 37.647 46.781 1.00 0.00 H new ATOM 0 HD1 HIS A 115 22.592 36.847 44.958 1.00 0.00 H new ATOM 0 HD2 HIS A 115 22.320 40.773 46.435 1.00 0.00 H new ATOM 0 HE1 HIS A 115 20.875 38.074 43.527 1.00 0.00 H new ATOM 1803 N LEU A 116 23.645 34.981 47.995 1.00 0.00 N ATOM 1804 CA LEU A 116 23.622 33.552 47.559 1.00 0.00 C ATOM 1805 C LEU A 116 22.271 32.978 47.967 1.00 0.00 C ATOM 1806 O LEU A 116 21.595 32.311 47.187 1.00 0.00 O ATOM 1807 CB LEU A 116 24.769 32.859 48.306 1.00 0.00 C ATOM 1808 CG LEU A 116 24.914 31.399 47.835 1.00 0.00 C ATOM 1809 CD1 LEU A 116 23.758 30.555 48.379 1.00 0.00 C ATOM 1810 CD2 LEU A 116 24.905 31.333 46.303 1.00 0.00 C ATOM 0 H LEU A 116 24.358 35.216 48.686 1.00 0.00 H new ATOM 0 HA LEU A 116 23.749 33.421 46.484 1.00 0.00 H new ATOM 0 HB2 LEU A 116 25.701 33.397 48.134 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.580 32.884 49.379 1.00 0.00 H new ATOM 0 HG LEU A 116 25.860 31.008 48.209 1.00 0.00 H new ATOM 0 HD11 LEU A 116 23.869 29.525 48.041 1.00 0.00 H new ATOM 0 HD12 LEU A 116 23.769 30.582 49.469 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.812 30.956 48.015 1.00 0.00 H new ATOM 0 HD21 LEU A 116 25.008 30.296 45.983 1.00 0.00 H new ATOM 0 HD22 LEU A 116 23.965 31.737 45.927 1.00 0.00 H new ATOM 0 HD23 LEU A 116 25.735 31.919 45.909 1.00 0.00 H new ATOM 1822 N HIS A 117 21.836 33.279 49.165 1.00 0.00 N ATOM 1823 CA HIS A 117 20.495 32.809 49.608 1.00 0.00 C ATOM 1824 C HIS A 117 19.450 33.380 48.636 1.00 0.00 C ATOM 1825 O HIS A 117 18.591 32.664 48.116 1.00 0.00 O ATOM 1826 CB HIS A 117 20.318 33.378 51.015 1.00 0.00 C ATOM 1827 CG HIS A 117 21.402 32.839 51.908 1.00 0.00 C ATOM 1828 ND1 HIS A 117 21.990 33.603 52.900 1.00 0.00 N ATOM 1829 CD2 HIS A 117 22.019 31.614 51.963 1.00 0.00 C ATOM 1830 CE1 HIS A 117 22.917 32.839 53.506 1.00 0.00 C ATOM 1831 NE2 HIS A 117 22.975 31.616 52.972 1.00 0.00 N ATOM 0 H HIS A 117 22.353 33.829 49.851 1.00 0.00 H new ATOM 0 HA HIS A 117 20.387 31.724 49.617 1.00 0.00 H new ATOM 0 HB2 HIS A 117 20.361 34.467 50.988 1.00 0.00 H new ATOM 0 HB3 HIS A 117 19.338 33.108 51.409 1.00 0.00 H new ATOM 0 HD2 HIS A 117 21.796 30.776 51.320 1.00 0.00 H new ATOM 0 HE1 HIS A 117 23.538 33.174 54.324 1.00 0.00 H new ATOM 0 HE2 HIS A 117 23.589 30.849 53.246 1.00 0.00 H new ATOM 1839 N ARG A 118 19.553 34.656 48.334 1.00 0.00 N ATOM 1840 CA ARG A 118 18.618 35.306 47.354 1.00 0.00 C ATOM 1841 C ARG A 118 18.640 34.541 46.014 1.00 0.00 C ATOM 1842 O ARG A 118 17.608 34.362 45.371 1.00 0.00 O ATOM 1843 CB ARG A 118 19.151 36.727 47.175 1.00 0.00 C ATOM 1844 CG ARG A 118 18.923 37.520 48.465 1.00 0.00 C ATOM 1845 CD ARG A 118 17.433 37.841 48.615 1.00 0.00 C ATOM 1846 NE ARG A 118 17.082 38.617 47.389 1.00 0.00 N ATOM 1847 CZ ARG A 118 16.298 38.112 46.464 1.00 0.00 C ATOM 1848 NH1 ARG A 118 15.798 36.908 46.581 1.00 0.00 N ATOM 1849 NH2 ARG A 118 16.017 38.822 45.408 1.00 0.00 N ATOM 0 H ARG A 118 20.254 35.282 48.730 1.00 0.00 H new ATOM 0 HA ARG A 118 17.585 35.304 47.703 1.00 0.00 H new ATOM 0 HB2 ARG A 118 20.214 36.701 46.934 1.00 0.00 H new ATOM 0 HB3 ARG A 118 18.646 37.215 46.341 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.269 36.945 49.323 1.00 0.00 H new ATOM 0 HG3 ARG A 118 19.504 38.442 48.444 1.00 0.00 H new ATOM 0 HD2 ARG A 118 16.838 36.931 48.690 1.00 0.00 H new ATOM 0 HD3 ARG A 118 17.243 38.421 49.518 1.00 0.00 H new ATOM 0 HE ARG A 118 17.458 39.557 47.267 1.00 0.00 H new ATOM 0 HH11 ARG A 118 16.015 36.343 47.402 1.00 0.00 H new ATOM 0 HH12 ARG A 118 15.191 36.535 45.851 1.00 0.00 H new ATOM 0 HH21 ARG A 118 16.405 39.760 45.306 1.00 0.00 H new ATOM 0 HH22 ARG A 118 15.409 38.440 44.683 1.00 0.00 H new ATOM 1863 N LEU A 119 19.791 34.047 45.599 1.00 0.00 N ATOM 1864 CA LEU A 119 19.873 33.249 44.327 1.00 0.00 C ATOM 1865 C LEU A 119 19.135 31.904 44.527 1.00 0.00 C ATOM 1866 O LEU A 119 18.338 31.486 43.690 1.00 0.00 O ATOM 1867 CB LEU A 119 21.373 33.020 44.088 1.00 0.00 C ATOM 1868 CG LEU A 119 21.602 32.172 42.824 1.00 0.00 C ATOM 1869 CD1 LEU A 119 21.398 30.690 43.151 1.00 0.00 C ATOM 1870 CD2 LEU A 119 20.624 32.590 41.719 1.00 0.00 C ATOM 0 H LEU A 119 20.678 34.164 46.089 1.00 0.00 H new ATOM 0 HA LEU A 119 19.412 33.754 43.478 1.00 0.00 H new ATOM 0 HB2 LEU A 119 21.880 33.979 43.984 1.00 0.00 H new ATOM 0 HB3 LEU A 119 21.811 32.519 44.951 1.00 0.00 H new ATOM 0 HG LEU A 119 22.622 32.332 42.475 1.00 0.00 H new ATOM 0 HD11 LEU A 119 21.561 30.094 42.253 1.00 0.00 H new ATOM 0 HD12 LEU A 119 22.106 30.387 43.922 1.00 0.00 H new ATOM 0 HD13 LEU A 119 20.381 30.533 43.511 1.00 0.00 H new ATOM 0 HD21 LEU A 119 20.797 31.982 40.831 1.00 0.00 H new ATOM 0 HD22 LEU A 119 19.601 32.444 42.065 1.00 0.00 H new ATOM 0 HD23 LEU A 119 20.778 33.641 41.475 1.00 0.00 H new ATOM 1882 N PHE A 120 19.366 31.238 45.648 1.00 0.00 N ATOM 1883 CA PHE A 120 18.660 29.936 45.948 1.00 0.00 C ATOM 1884 C PHE A 120 17.133 30.153 45.729 1.00 0.00 C ATOM 1885 O PHE A 120 16.465 29.314 45.132 1.00 0.00 O ATOM 1886 CB PHE A 120 19.014 29.656 47.452 1.00 0.00 C ATOM 1887 CG PHE A 120 19.062 28.153 47.825 1.00 0.00 C ATOM 1888 CD1 PHE A 120 18.421 27.195 47.023 1.00 0.00 C ATOM 1889 CD2 PHE A 120 19.715 27.716 49.022 1.00 0.00 C ATOM 1890 CE1 PHE A 120 18.429 25.842 47.389 1.00 0.00 C ATOM 1891 CE2 PHE A 120 19.704 26.361 49.382 1.00 0.00 C ATOM 1892 CZ PHE A 120 19.061 25.426 48.565 1.00 0.00 C ATOM 0 H PHE A 120 20.017 31.544 46.371 1.00 0.00 H new ATOM 0 HA PHE A 120 18.953 29.097 45.317 1.00 0.00 H new ATOM 0 HB2 PHE A 120 19.982 30.105 47.675 1.00 0.00 H new ATOM 0 HB3 PHE A 120 18.279 30.152 48.085 1.00 0.00 H new ATOM 0 HD1 PHE A 120 17.918 27.503 46.118 1.00 0.00 H new ATOM 0 HD2 PHE A 120 20.219 28.434 49.651 1.00 0.00 H new ATOM 0 HE1 PHE A 120 17.942 25.114 46.757 1.00 0.00 H new ATOM 0 HE2 PHE A 120 20.192 26.039 50.290 1.00 0.00 H new ATOM 0 HZ PHE A 120 19.052 24.382 48.842 1.00 0.00 H new ATOM 1902 N LYS A 121 16.587 31.294 46.141 1.00 0.00 N ATOM 1903 CA LYS A 121 15.119 31.575 45.889 1.00 0.00 C ATOM 1904 C LYS A 121 14.907 31.911 44.411 1.00 0.00 C ATOM 1905 O LYS A 121 13.941 31.481 43.791 1.00 0.00 O ATOM 1906 CB LYS A 121 14.734 32.800 46.734 1.00 0.00 C ATOM 1907 CG LYS A 121 13.608 33.593 46.024 1.00 0.00 C ATOM 1908 CD LYS A 121 12.554 34.083 47.024 1.00 0.00 C ATOM 1909 CE LYS A 121 12.963 35.454 47.577 1.00 0.00 C ATOM 1910 NZ LYS A 121 11.945 36.405 47.049 1.00 0.00 N ATOM 0 H LYS A 121 17.089 32.032 46.634 1.00 0.00 H new ATOM 0 HA LYS A 121 14.514 30.707 46.150 1.00 0.00 H new ATOM 0 HB2 LYS A 121 14.400 32.482 47.722 1.00 0.00 H new ATOM 0 HB3 LYS A 121 15.604 33.439 46.882 1.00 0.00 H new ATOM 0 HG2 LYS A 121 14.037 34.446 45.498 1.00 0.00 H new ATOM 0 HG3 LYS A 121 13.134 32.961 45.273 1.00 0.00 H new ATOM 0 HD2 LYS A 121 11.581 34.152 46.537 1.00 0.00 H new ATOM 0 HD3 LYS A 121 12.452 33.367 47.840 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.973 35.452 48.667 1.00 0.00 H new ATOM 0 HE3 LYS A 121 13.966 35.728 47.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.159 37.365 47.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.963 36.391 46.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.001 36.124 47.383 1.00 0.00 H new ATOM 1924 N ALA A 122 15.796 32.680 43.844 1.00 0.00 N ATOM 1925 CA ALA A 122 15.661 33.052 42.409 1.00 0.00 C ATOM 1926 C ALA A 122 15.493 31.784 41.581 1.00 0.00 C ATOM 1927 O ALA A 122 14.477 31.589 40.915 1.00 0.00 O ATOM 1928 CB ALA A 122 16.968 33.763 42.050 1.00 0.00 C ATOM 0 H ALA A 122 16.613 33.068 44.316 1.00 0.00 H new ATOM 0 HA ALA A 122 14.799 33.690 42.217 1.00 0.00 H new ATOM 0 HB1 ALA A 122 16.941 34.067 41.004 1.00 0.00 H new ATOM 0 HB2 ALA A 122 17.088 34.644 42.681 1.00 0.00 H new ATOM 0 HB3 ALA A 122 17.807 33.085 42.209 1.00 0.00 H new ATOM 1934 N THR A 123 16.474 30.925 41.593 1.00 0.00 N ATOM 1935 CA THR A 123 16.349 29.679 40.774 1.00 0.00 C ATOM 1936 C THR A 123 15.271 28.721 41.359 1.00 0.00 C ATOM 1937 O THR A 123 14.277 28.437 40.695 1.00 0.00 O ATOM 1938 CB THR A 123 17.727 29.031 40.771 1.00 0.00 C ATOM 1939 OG1 THR A 123 18.726 30.043 40.773 1.00 0.00 O ATOM 1940 CG2 THR A 123 17.857 28.205 39.491 1.00 0.00 C ATOM 0 H THR A 123 17.341 31.024 42.121 1.00 0.00 H new ATOM 0 HA THR A 123 16.023 29.908 39.759 1.00 0.00 H new ATOM 0 HB THR A 123 17.851 28.401 41.652 1.00 0.00 H new ATOM 0 HG1 THR A 123 19.613 29.627 40.773 1.00 0.00 H new ATOM 0 HG21 THR A 123 18.837 27.729 39.463 1.00 0.00 H new ATOM 0 HG22 THR A 123 17.081 27.440 39.471 1.00 0.00 H new ATOM 0 HG23 THR A 123 17.746 28.857 38.624 1.00 0.00 H new ATOM 1948 N THR A 124 15.409 28.257 42.592 1.00 0.00 N ATOM 1949 CA THR A 124 14.342 27.370 43.208 1.00 0.00 C ATOM 1950 C THR A 124 12.978 28.047 42.999 1.00 0.00 C ATOM 1951 O THR A 124 11.948 27.403 42.810 1.00 0.00 O ATOM 1952 CB THR A 124 14.701 27.237 44.698 1.00 0.00 C ATOM 1953 OG1 THR A 124 14.240 25.980 45.174 1.00 0.00 O ATOM 1954 CG2 THR A 124 14.050 28.354 45.517 1.00 0.00 C ATOM 0 H THR A 124 16.208 28.451 43.196 1.00 0.00 H new ATOM 0 HA THR A 124 14.290 26.379 42.757 1.00 0.00 H new ATOM 0 HB THR A 124 15.783 27.312 44.806 1.00 0.00 H new ATOM 0 HG1 THR A 124 14.602 25.817 46.070 1.00 0.00 H new ATOM 0 HG21 THR A 124 14.318 28.239 46.567 1.00 0.00 H new ATOM 0 HG22 THR A 124 14.401 29.321 45.157 1.00 0.00 H new ATOM 0 HG23 THR A 124 12.967 28.299 45.411 1.00 0.00 H new ATOM 1962 N GLY A 125 12.991 29.361 43.006 1.00 0.00 N ATOM 1963 CA GLY A 125 11.749 30.159 42.787 1.00 0.00 C ATOM 1964 C GLY A 125 11.229 30.936 44.023 1.00 0.00 C ATOM 1965 O GLY A 125 10.752 32.053 43.834 1.00 0.00 O ATOM 0 H GLY A 125 13.830 29.921 43.158 1.00 0.00 H new ATOM 0 HA2 GLY A 125 11.933 30.871 41.983 1.00 0.00 H new ATOM 0 HA3 GLY A 125 10.962 29.487 42.444 1.00 0.00 H new ATOM 1969 N MET A 126 11.274 30.467 45.258 1.00 0.00 N ATOM 1970 CA MET A 126 10.701 31.376 46.334 1.00 0.00 C ATOM 1971 C MET A 126 11.201 31.135 47.781 1.00 0.00 C ATOM 1972 O MET A 126 10.385 31.088 48.702 1.00 0.00 O ATOM 1973 CB MET A 126 9.187 31.096 46.296 1.00 0.00 C ATOM 1974 CG MET A 126 8.484 31.949 45.230 1.00 0.00 C ATOM 1975 SD MET A 126 8.735 33.709 45.575 1.00 0.00 S ATOM 1976 CE MET A 126 7.202 33.979 46.497 1.00 0.00 C ATOM 0 H MET A 126 11.650 29.568 45.559 1.00 0.00 H new ATOM 0 HA MET A 126 11.011 32.398 46.114 1.00 0.00 H new ATOM 0 HB2 MET A 126 9.016 30.040 46.089 1.00 0.00 H new ATOM 0 HB3 MET A 126 8.753 31.303 47.274 1.00 0.00 H new ATOM 0 HG2 MET A 126 8.875 31.705 44.242 1.00 0.00 H new ATOM 0 HG3 MET A 126 7.418 31.722 45.216 1.00 0.00 H new ATOM 0 HE1 MET A 126 7.147 35.020 46.814 1.00 0.00 H new ATOM 0 HE2 MET A 126 6.349 33.748 45.860 1.00 0.00 H new ATOM 0 HE3 MET A 126 7.186 33.332 47.374 1.00 0.00 H new ATOM 1986 N THR A 127 12.486 31.039 48.045 1.00 0.00 N ATOM 1987 CA THR A 127 12.927 30.862 49.468 1.00 0.00 C ATOM 1988 C THR A 127 14.457 30.999 49.633 1.00 0.00 C ATOM 1989 O THR A 127 15.148 29.985 49.699 1.00 0.00 O ATOM 1990 CB THR A 127 12.515 29.441 49.837 1.00 0.00 C ATOM 1991 OG1 THR A 127 11.295 29.084 49.203 1.00 0.00 O ATOM 1992 CG2 THR A 127 12.339 29.376 51.339 1.00 0.00 C ATOM 0 H THR A 127 13.234 31.075 47.352 1.00 0.00 H new ATOM 0 HA THR A 127 12.477 31.627 50.101 1.00 0.00 H new ATOM 0 HB THR A 127 13.285 28.745 49.505 1.00 0.00 H new ATOM 0 HG1 THR A 127 10.616 29.765 49.393 1.00 0.00 H new ATOM 0 HG21 THR A 127 12.044 28.367 51.627 1.00 0.00 H new ATOM 0 HG22 THR A 127 13.279 29.632 51.827 1.00 0.00 H new ATOM 0 HG23 THR A 127 11.567 30.082 51.646 1.00 0.00 H new ATOM 2000 N PRO A 128 14.977 32.206 49.731 1.00 0.00 N ATOM 2001 CA PRO A 128 16.447 32.329 49.880 1.00 0.00 C ATOM 2002 C PRO A 128 16.938 31.935 51.279 1.00 0.00 C ATOM 2003 O PRO A 128 16.982 30.755 51.619 1.00 0.00 O ATOM 2004 CB PRO A 128 16.689 33.808 49.581 1.00 0.00 C ATOM 2005 CG PRO A 128 15.404 34.502 49.915 1.00 0.00 C ATOM 2006 CD PRO A 128 14.292 33.499 49.754 1.00 0.00 C ATOM 0 HA PRO A 128 16.996 31.657 49.221 1.00 0.00 H new ATOM 0 HB2 PRO A 128 17.512 34.199 50.179 1.00 0.00 H new ATOM 0 HB3 PRO A 128 16.955 33.958 48.535 1.00 0.00 H new ATOM 0 HG2 PRO A 128 15.429 34.886 50.935 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.248 35.357 49.257 1.00 0.00 H new ATOM 0 HD2 PRO A 128 13.580 33.558 50.577 1.00 0.00 H new ATOM 0 HD3 PRO A 128 13.732 33.669 48.835 1.00 0.00 H new ATOM 2014 N LYS A 129 17.347 32.887 52.089 1.00 0.00 N ATOM 2015 CA LYS A 129 17.868 32.529 53.433 1.00 0.00 C ATOM 2016 C LYS A 129 16.796 31.801 54.260 1.00 0.00 C ATOM 2017 O LYS A 129 17.105 31.066 55.201 1.00 0.00 O ATOM 2018 CB LYS A 129 18.297 33.826 54.094 1.00 0.00 C ATOM 2019 CG LYS A 129 19.458 33.535 55.044 1.00 0.00 C ATOM 2020 CD LYS A 129 19.874 34.821 55.758 1.00 0.00 C ATOM 2021 CE LYS A 129 20.460 35.808 54.750 1.00 0.00 C ATOM 2022 NZ LYS A 129 20.292 37.144 55.382 1.00 0.00 N ATOM 0 H LYS A 129 17.340 33.884 51.873 1.00 0.00 H new ATOM 0 HA LYS A 129 18.712 31.843 53.357 1.00 0.00 H new ATOM 0 HB2 LYS A 129 18.600 34.552 53.339 1.00 0.00 H new ATOM 0 HB3 LYS A 129 17.463 34.265 54.641 1.00 0.00 H new ATOM 0 HG2 LYS A 129 19.163 32.781 55.774 1.00 0.00 H new ATOM 0 HG3 LYS A 129 20.302 33.127 54.488 1.00 0.00 H new ATOM 0 HD2 LYS A 129 19.013 35.265 56.257 1.00 0.00 H new ATOM 0 HD3 LYS A 129 20.609 34.597 56.531 1.00 0.00 H new ATOM 0 HE2 LYS A 129 21.510 35.594 54.552 1.00 0.00 H new ATOM 0 HE3 LYS A 129 19.938 35.754 53.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 19.659 37.727 54.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 19.881 37.030 56.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 21.218 37.610 55.460 1.00 0.00 H new ATOM 2036 N ALA A 130 15.547 31.956 53.916 1.00 0.00 N ATOM 2037 CA ALA A 130 14.480 31.233 54.674 1.00 0.00 C ATOM 2038 C ALA A 130 14.608 29.735 54.372 1.00 0.00 C ATOM 2039 O ALA A 130 14.395 28.899 55.248 1.00 0.00 O ATOM 2040 CB ALA A 130 13.156 31.787 54.142 1.00 0.00 C ATOM 0 H ALA A 130 15.219 32.545 53.151 1.00 0.00 H new ATOM 0 HA ALA A 130 14.550 31.368 55.753 1.00 0.00 H new ATOM 0 HB1 ALA A 130 12.326 31.301 54.654 1.00 0.00 H new ATOM 0 HB2 ALA A 130 13.113 32.861 54.321 1.00 0.00 H new ATOM 0 HB3 ALA A 130 13.085 31.594 53.072 1.00 0.00 H new ATOM 2046 N TRP A 131 15.013 29.368 53.161 1.00 0.00 N ATOM 2047 CA TRP A 131 15.204 27.917 52.883 1.00 0.00 C ATOM 2048 C TRP A 131 16.337 27.451 53.786 1.00 0.00 C ATOM 2049 O TRP A 131 16.250 26.411 54.430 1.00 0.00 O ATOM 2050 CB TRP A 131 15.624 27.821 51.415 1.00 0.00 C ATOM 2051 CG TRP A 131 14.600 27.096 50.583 1.00 0.00 C ATOM 2052 CD1 TRP A 131 14.774 26.805 49.272 1.00 0.00 C ATOM 2053 CD2 TRP A 131 13.273 26.568 50.940 1.00 0.00 C ATOM 2054 NE1 TRP A 131 13.662 26.136 48.803 1.00 0.00 N ATOM 2055 CE2 TRP A 131 12.709 25.967 49.784 1.00 0.00 C ATOM 2056 CE3 TRP A 131 12.505 26.545 52.126 1.00 0.00 C ATOM 2057 CZ2 TRP A 131 11.448 25.370 49.805 1.00 0.00 C ATOM 2058 CZ3 TRP A 131 11.235 25.946 52.145 1.00 0.00 C ATOM 2059 CH2 TRP A 131 10.708 25.361 50.988 1.00 0.00 C ATOM 0 H TRP A 131 15.210 30.000 52.385 1.00 0.00 H new ATOM 0 HA TRP A 131 14.315 27.313 53.062 1.00 0.00 H new ATOM 0 HB2 TRP A 131 15.773 28.824 51.014 1.00 0.00 H new ATOM 0 HB3 TRP A 131 16.581 27.304 51.344 1.00 0.00 H new ATOM 0 HD1 TRP A 131 15.646 27.057 48.686 1.00 0.00 H new ATOM 0 HE1 TRP A 131 13.558 25.806 47.844 1.00 0.00 H new ATOM 0 HE3 TRP A 131 12.899 26.992 53.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 11.047 24.917 48.910 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 10.661 25.937 53.060 1.00 0.00 H new ATOM 0 HH2 TRP A 131 9.730 24.903 51.011 1.00 0.00 H new ATOM 2070 N GLN A 132 17.378 28.242 53.898 1.00 0.00 N ATOM 2071 CA GLN A 132 18.501 27.879 54.818 1.00 0.00 C ATOM 2072 C GLN A 132 17.921 27.623 56.214 1.00 0.00 C ATOM 2073 O GLN A 132 18.359 26.731 56.935 1.00 0.00 O ATOM 2074 CB GLN A 132 19.435 29.101 54.812 1.00 0.00 C ATOM 2075 CG GLN A 132 20.271 29.142 56.096 1.00 0.00 C ATOM 2076 CD GLN A 132 21.283 30.286 56.012 1.00 0.00 C ATOM 2077 OE1 GLN A 132 21.982 30.429 55.012 1.00 0.00 O ATOM 2078 NE2 GLN A 132 21.400 31.114 57.013 1.00 0.00 N ATOM 0 H GLN A 132 17.498 29.120 53.393 1.00 0.00 H new ATOM 0 HA GLN A 132 19.040 26.980 54.517 1.00 0.00 H new ATOM 0 HB2 GLN A 132 20.093 29.060 53.944 1.00 0.00 H new ATOM 0 HB3 GLN A 132 18.848 30.015 54.724 1.00 0.00 H new ATOM 0 HG2 GLN A 132 19.622 29.280 56.961 1.00 0.00 H new ATOM 0 HG3 GLN A 132 20.790 28.193 56.235 1.00 0.00 H new ATOM 0 HE21 GLN A 132 20.820 30.995 57.843 1.00 0.00 H new ATOM 0 HE22 GLN A 132 22.072 31.880 56.965 1.00 0.00 H new ATOM 2087 N GLN A 133 16.928 28.382 56.598 1.00 0.00 N ATOM 2088 CA GLN A 133 16.301 28.169 57.938 1.00 0.00 C ATOM 2089 C GLN A 133 15.575 26.817 57.955 1.00 0.00 C ATOM 2090 O GLN A 133 15.825 25.961 58.813 1.00 0.00 O ATOM 2091 CB GLN A 133 15.302 29.316 58.097 1.00 0.00 C ATOM 2092 CG GLN A 133 14.940 29.477 59.574 1.00 0.00 C ATOM 2093 CD GLN A 133 14.745 30.961 59.891 1.00 0.00 C ATOM 2094 OE1 GLN A 133 15.617 31.595 60.481 1.00 0.00 O ATOM 2095 NE2 GLN A 133 13.641 31.553 59.526 1.00 0.00 N ATOM 0 H GLN A 133 16.525 29.138 56.045 1.00 0.00 H new ATOM 0 HA GLN A 133 17.032 28.157 58.746 1.00 0.00 H new ATOM 0 HB2 GLN A 133 15.731 30.242 57.714 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.405 29.115 57.512 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.029 28.923 59.799 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.729 29.061 60.201 1.00 0.00 H new ATOM 0 HE21 GLN A 133 12.918 31.026 59.036 1.00 0.00 H new ATOM 0 HE22 GLN A 133 13.501 32.543 59.730 1.00 0.00 H new ATOM 2104 N ALA A 134 14.689 26.597 57.014 1.00 0.00 N ATOM 2105 CA ALA A 134 13.959 25.294 56.969 1.00 0.00 C ATOM 2106 C ALA A 134 14.968 24.150 56.989 1.00 0.00 C ATOM 2107 O ALA A 134 14.799 23.153 57.689 1.00 0.00 O ATOM 2108 CB ALA A 134 13.172 25.311 55.658 1.00 0.00 C ATOM 0 H ALA A 134 14.442 27.260 56.280 1.00 0.00 H new ATOM 0 HA ALA A 134 13.294 25.155 57.821 1.00 0.00 H new ATOM 0 HB1 ALA A 134 12.611 24.382 55.559 1.00 0.00 H new ATOM 0 HB2 ALA A 134 12.481 26.154 55.659 1.00 0.00 H new ATOM 0 HB3 ALA A 134 13.863 25.409 54.820 1.00 0.00 H new ATOM 2114 N TRP A 135 16.039 24.307 56.270 1.00 0.00 N ATOM 2115 CA TRP A 135 17.113 23.271 56.267 1.00 0.00 C ATOM 2116 C TRP A 135 17.554 23.037 57.707 1.00 0.00 C ATOM 2117 O TRP A 135 17.601 21.919 58.212 1.00 0.00 O ATOM 2118 CB TRP A 135 18.244 23.934 55.492 1.00 0.00 C ATOM 2119 CG TRP A 135 17.777 24.323 54.126 1.00 0.00 C ATOM 2120 CD1 TRP A 135 18.476 25.104 53.290 1.00 0.00 C ATOM 2121 CD2 TRP A 135 16.557 23.940 53.413 1.00 0.00 C ATOM 2122 NE1 TRP A 135 17.770 25.249 52.110 1.00 0.00 N ATOM 2123 CE2 TRP A 135 16.583 24.545 52.135 1.00 0.00 C ATOM 2124 CE3 TRP A 135 15.443 23.141 53.743 1.00 0.00 C ATOM 2125 CZ2 TRP A 135 15.548 24.365 51.220 1.00 0.00 C ATOM 2126 CZ3 TRP A 135 14.400 22.959 52.821 1.00 0.00 C ATOM 2127 CH2 TRP A 135 14.453 23.569 51.563 1.00 0.00 C ATOM 0 H TRP A 135 16.222 25.116 55.677 1.00 0.00 H new ATOM 0 HA TRP A 135 16.808 22.316 55.839 1.00 0.00 H new ATOM 0 HB2 TRP A 135 18.594 24.816 56.029 1.00 0.00 H new ATOM 0 HB3 TRP A 135 19.090 23.251 55.414 1.00 0.00 H new ATOM 0 HD1 TRP A 135 19.437 25.549 53.504 1.00 0.00 H new ATOM 0 HE1 TRP A 135 18.088 25.808 51.318 1.00 0.00 H new ATOM 0 HE3 TRP A 135 15.392 22.666 54.712 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 15.592 24.839 50.250 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 13.552 22.345 53.084 1.00 0.00 H new ATOM 0 HH2 TRP A 135 13.648 23.424 50.858 1.00 0.00 H new ATOM 2138 N ARG A 136 17.862 24.113 58.370 1.00 0.00 N ATOM 2139 CA ARG A 136 18.300 24.040 59.797 1.00 0.00 C ATOM 2140 C ARG A 136 17.158 23.549 60.694 1.00 0.00 C ATOM 2141 O ARG A 136 17.358 23.237 61.866 1.00 0.00 O ATOM 2142 CB ARG A 136 18.686 25.477 60.159 1.00 0.00 C ATOM 2143 CG ARG A 136 19.546 25.475 61.426 1.00 0.00 C ATOM 2144 CD ARG A 136 19.837 26.917 61.853 1.00 0.00 C ATOM 2145 NE ARG A 136 21.323 27.054 61.789 1.00 0.00 N ATOM 2146 CZ ARG A 136 21.927 28.066 62.366 1.00 0.00 C ATOM 2147 NH1 ARG A 136 21.240 28.977 63.007 1.00 0.00 N ATOM 2148 NH2 ARG A 136 23.226 28.166 62.298 1.00 0.00 N ATOM 0 H ARG A 136 17.830 25.056 57.982 1.00 0.00 H new ATOM 0 HA ARG A 136 19.124 23.341 59.937 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.234 25.935 59.336 1.00 0.00 H new ATOM 0 HB3 ARG A 136 17.789 26.076 60.317 1.00 0.00 H new ATOM 0 HG2 ARG A 136 19.030 24.945 62.227 1.00 0.00 H new ATOM 0 HG3 ARG A 136 20.480 24.944 61.243 1.00 0.00 H new ATOM 0 HD2 ARG A 136 19.347 27.630 61.190 1.00 0.00 H new ATOM 0 HD3 ARG A 136 19.467 27.112 62.860 1.00 0.00 H new ATOM 0 HE ARG A 136 21.874 26.354 61.292 1.00 0.00 H new ATOM 0 HH11 ARG A 136 20.224 28.905 63.062 1.00 0.00 H new ATOM 0 HH12 ARG A 136 21.721 29.759 63.452 1.00 0.00 H new ATOM 0 HH21 ARG A 136 23.766 27.460 61.798 1.00 0.00 H new ATOM 0 HH22 ARG A 136 23.701 28.950 62.744 1.00 0.00 H new ATOM 2162 N ALA A 137 15.969 23.474 60.171 1.00 0.00 N ATOM 2163 CA ALA A 137 14.827 23.003 60.994 1.00 0.00 C ATOM 2164 C ALA A 137 14.650 21.493 60.830 1.00 0.00 C ATOM 2165 O ALA A 137 14.383 20.776 61.793 1.00 0.00 O ATOM 2166 CB ALA A 137 13.608 23.750 60.451 1.00 0.00 C ATOM 0 H ALA A 137 15.739 23.719 59.208 1.00 0.00 H new ATOM 0 HA ALA A 137 14.977 23.193 62.057 1.00 0.00 H new ATOM 0 HB1 ALA A 137 12.721 23.454 61.011 1.00 0.00 H new ATOM 0 HB2 ALA A 137 13.762 24.824 60.557 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.471 23.505 59.398 1.00 0.00 H new ATOM 2172 N ARG A 138 14.784 20.993 59.628 1.00 0.00 N ATOM 2173 CA ARG A 138 14.610 19.530 59.417 1.00 0.00 C ATOM 2174 C ARG A 138 15.955 18.816 59.316 1.00 0.00 C ATOM 2175 O ARG A 138 16.175 17.795 59.965 1.00 0.00 O ATOM 2176 CB ARG A 138 13.847 19.412 58.100 1.00 0.00 C ATOM 2177 CG ARG A 138 13.193 18.032 58.010 1.00 0.00 C ATOM 2178 CD ARG A 138 13.012 17.646 56.540 1.00 0.00 C ATOM 2179 NE ARG A 138 12.167 18.731 55.962 1.00 0.00 N ATOM 2180 CZ ARG A 138 10.883 18.790 56.217 1.00 0.00 C ATOM 2181 NH1 ARG A 138 10.311 17.897 56.986 1.00 0.00 N ATOM 2182 NH2 ARG A 138 10.167 19.749 55.699 1.00 0.00 N ATOM 0 H ARG A 138 15.005 21.532 58.791 1.00 0.00 H new ATOM 0 HA ARG A 138 14.082 19.066 60.250 1.00 0.00 H new ATOM 0 HB2 ARG A 138 13.087 20.191 58.037 1.00 0.00 H new ATOM 0 HB3 ARG A 138 14.526 19.560 57.260 1.00 0.00 H new ATOM 0 HG2 ARG A 138 13.811 17.291 58.518 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.227 18.042 58.516 1.00 0.00 H new ATOM 0 HD2 ARG A 138 13.972 17.577 56.028 1.00 0.00 H new ATOM 0 HD3 ARG A 138 12.528 16.674 56.443 1.00 0.00 H new ATOM 0 HE ARG A 138 12.594 19.436 55.361 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.866 17.145 57.394 1.00 0.00 H new ATOM 0 HH12 ARG A 138 9.311 17.954 57.177 1.00 0.00 H new ATOM 0 HH21 ARG A 138 10.607 20.447 55.099 1.00 0.00 H new ATOM 0 HH22 ARG A 138 9.167 19.801 55.893 1.00 0.00 H new ATOM 2196 N ARG A 139 16.850 19.297 58.493 1.00 0.00 N ATOM 2197 CA ARG A 139 18.157 18.581 58.352 1.00 0.00 C ATOM 2198 C ARG A 139 19.293 19.540 57.996 1.00 0.00 C ATOM 2199 O ARG A 139 19.071 20.423 57.186 1.00 0.00 O ATOM 2200 CB ARG A 139 17.928 17.580 57.219 1.00 0.00 C ATOM 2201 CG ARG A 139 18.806 16.346 57.440 1.00 0.00 C ATOM 2202 CD ARG A 139 18.114 15.116 56.848 1.00 0.00 C ATOM 2203 NE ARG A 139 18.480 13.989 57.756 1.00 0.00 N ATOM 2204 CZ ARG A 139 17.839 12.848 57.695 1.00 0.00 C ATOM 2205 NH1 ARG A 139 16.865 12.674 56.838 1.00 0.00 N ATOM 2206 NH2 ARG A 139 18.173 11.875 58.497 1.00 0.00 N ATOM 2207 OXT ARG A 139 20.377 19.357 58.526 1.00 0.00 O ATOM 0 H ARG A 139 16.739 20.136 57.923 1.00 0.00 H new ATOM 0 HA ARG A 139 18.454 18.102 59.285 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.878 17.290 57.183 1.00 0.00 H new ATOM 0 HB3 ARG A 139 18.165 18.040 56.260 1.00 0.00 H new ATOM 0 HG2 ARG A 139 19.779 16.490 56.971 1.00 0.00 H new ATOM 0 HG3 ARG A 139 18.984 16.199 58.505 1.00 0.00 H new ATOM 0 HD2 ARG A 139 17.034 15.254 56.806 1.00 0.00 H new ATOM 0 HD3 ARG A 139 18.451 14.926 55.829 1.00 0.00 H new ATOM 0 HE ARG A 139 19.236 14.108 58.430 1.00 0.00 H new ATOM 0 HH11 ARG A 139 16.598 13.431 56.209 1.00 0.00 H new ATOM 0 HH12 ARG A 139 16.373 11.781 56.799 1.00 0.00 H new ATOM 0 HH21 ARG A 139 18.930 12.004 59.168 1.00 0.00 H new ATOM 0 HH22 ARG A 139 17.677 10.985 58.453 1.00 0.00 H new