USER MOD reduce.3.24.130724 H: found=0, std=0, add=1220, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1224 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 147 ASN :FLIP amide:sc= -1.42! C(o=-9.2!,f=-1.9!) USER MOD Set 1.2: A 165 ASN : amide:sc= -0.485 K(o=-1.9,f=-2.6) USER MOD Set 1.3: A 166 SER OG : rot 180:sc= 0.0257 USER MOD Set 2.1: A 122 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: A 132 MET CE :methyl 176:sc= -3.35! (180deg=-3.39!) USER MOD Set 3.1: A 94 MET CE :methyl -176:sc= -2.91! (180deg=-3.1!) USER MOD Set 3.2: A 98 ASN : amide:sc= -1.11! C(o=-4!,f=-10!) USER MOD Set 4.1: A 32 LYS NZ :NH3+ -156:sc= 2.13 (180deg=1.17) USER MOD Set 4.2: A 76 GLN : amide:sc= -2.67! C(o=-0.55!,f=-13!) USER MOD Set 5.1: A 57 SER OG : rot 66:sc= 1.24 USER MOD Set 5.2: A 73 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 39 ASN : amide:sc= -2.07! C(o=-4!,f=-10!) USER MOD Set 6.2: A 43 LYS NZ :NH3+ 162:sc= -1.95 (180deg=-3.2) USER MOD Single : A 13 SER OG : rot -57:sc= 0.512 USER MOD Single : A 15 SER OG : rot -16:sc= 0.471 USER MOD Single : A 20 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.085) USER MOD Single : A 21 THR OG1 : rot 83:sc= 1.22 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot -60:sc= -2.78! USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0453 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -1.13 X(o=-1.1,f=-1.4) USER MOD Single : A 50 THR OG1 : rot 100:sc= 1.25 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -93:sc= -2.47! USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.166 USER MOD Single : A 63 HIS :FLIP no HD1:sc= -1.61 F(o=-3.5!,f=-1.6) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS :FLIP no HE2:sc= -0.0372 F(o=-0.79,f=-0.037) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -1.72! C(o=-1.7!,f=-3.8!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -36:sc= 0.204 USER MOD Single : A 92 TYR OH : rot 50:sc= -0.704 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 140:sc= -0.461 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot -24:sc= 0.361 USER MOD Single : A 115 ASN : amide:sc= -0.873 K(o=-0.87,f=-4.2!) USER MOD Single : A 118 ASN : amide:sc= -0.658 K(o=-0.66,f=-2.1!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.155) USER MOD Single : A 130 GLN : amide:sc= -0.0598 X(o=-0.06,f=-0.41) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 40:sc= 0.367 USER MOD Single : A 150 HIS :FLIP no HD1:sc= -0.544 F(o=-1.1,f=-0.54) USER MOD Single : A 151 THR OG1 : rot 180:sc= -2.38! USER MOD Single : A 153 ASN :FLIP amide:sc= -0.168 F(o=-1.2,f=-0.17) USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ -124:sc= -0.549 (180deg=-2.98!) USER MOD Single : A 160 SER OG : rot 160:sc= -2.97! USER MOD Single : A 164 MET CE :methyl 174:sc= 0 (180deg=-0.0818) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 169 HIS : no HD1:sc= -0.0343 X(o=-0.034,f=-0.00078) USER MOD Single : A 175 HIS : no HD1:sc= -0.463 X(o=-0.46,f=-0.14) USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 79 N VAL A 8 10.078 14.207 -3.554 1.00 0.00 N ATOM 80 CA VAL A 8 10.772 12.928 -3.411 1.00 0.00 C ATOM 81 C VAL A 8 12.214 13.157 -2.968 1.00 0.00 C ATOM 82 O VAL A 8 12.870 14.091 -3.431 1.00 0.00 O ATOM 83 CB VAL A 8 10.758 12.082 -4.718 1.00 0.00 C ATOM 84 CG1 VAL A 8 9.362 11.543 -4.996 1.00 0.00 C ATOM 85 CG2 VAL A 8 11.258 12.888 -5.914 1.00 0.00 C ATOM 0 HA VAL A 8 10.231 12.363 -2.652 1.00 0.00 H new ATOM 0 HB VAL A 8 11.437 11.243 -4.570 1.00 0.00 H new ATOM 0 HG11 VAL A 8 9.375 10.955 -5.914 1.00 0.00 H new ATOM 0 HG12 VAL A 8 9.043 10.913 -4.166 1.00 0.00 H new ATOM 0 HG13 VAL A 8 8.666 12.375 -5.108 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.234 12.265 -6.808 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.617 13.758 -6.060 1.00 0.00 H new ATOM 0 HG23 VAL A 8 12.280 13.218 -5.729 1.00 0.00 H new ATOM 95 N ILE A 9 12.686 12.315 -2.056 1.00 0.00 N ATOM 96 CA ILE A 9 14.043 12.425 -1.525 1.00 0.00 C ATOM 97 C ILE A 9 14.644 11.044 -1.277 1.00 0.00 C ATOM 98 O ILE A 9 13.917 10.052 -1.173 1.00 0.00 O ATOM 99 CB ILE A 9 14.121 13.249 -0.196 1.00 0.00 C ATOM 100 CG1 ILE A 9 13.229 12.652 0.925 1.00 0.00 C ATOM 101 CG2 ILE A 9 13.777 14.712 -0.446 1.00 0.00 C ATOM 102 CD1 ILE A 9 11.731 12.857 0.745 1.00 0.00 C ATOM 0 H ILE A 9 12.146 11.543 -1.665 1.00 0.00 H new ATOM 0 HA ILE A 9 14.613 12.958 -2.286 1.00 0.00 H new ATOM 0 HB ILE A 9 15.151 13.189 0.156 1.00 0.00 H new ATOM 0 HG12 ILE A 9 13.427 11.582 0.993 1.00 0.00 H new ATOM 0 HG13 ILE A 9 13.527 13.092 1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 9 13.838 15.265 0.491 1.00 0.00 H new ATOM 0 HG22 ILE A 9 14.481 15.134 -1.163 1.00 0.00 H new ATOM 0 HG23 ILE A 9 12.765 14.785 -0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 9 11.199 12.403 1.581 1.00 0.00 H new ATOM 0 HD12 ILE A 9 11.511 13.924 0.711 1.00 0.00 H new ATOM 0 HD13 ILE A 9 11.409 12.391 -0.186 1.00 0.00 H new ATOM 114 N ASP A 10 15.972 10.994 -1.180 1.00 0.00 N ATOM 115 CA ASP A 10 16.693 9.744 -0.933 1.00 0.00 C ATOM 116 C ASP A 10 16.350 9.166 0.430 1.00 0.00 C ATOM 117 O ASP A 10 15.828 9.873 1.293 1.00 0.00 O ATOM 118 CB ASP A 10 18.204 9.966 -1.043 1.00 0.00 C ATOM 119 CG ASP A 10 18.704 9.874 -2.469 1.00 0.00 C ATOM 120 OD1 ASP A 10 18.198 10.619 -3.331 1.00 0.00 O ATOM 121 OD2 ASP A 10 19.608 9.052 -2.728 1.00 0.00 O ATOM 0 H ASP A 10 16.575 11.812 -1.269 1.00 0.00 H new ATOM 0 HA ASP A 10 16.382 9.028 -1.693 1.00 0.00 H new ATOM 0 HB2 ASP A 10 18.454 10.946 -0.637 1.00 0.00 H new ATOM 0 HB3 ASP A 10 18.722 9.226 -0.432 1.00 0.00 H new ATOM 126 N GLY A 11 16.642 7.873 0.609 1.00 0.00 N ATOM 127 CA GLY A 11 16.357 7.187 1.869 1.00 0.00 C ATOM 128 C GLY A 11 17.265 7.617 3.012 1.00 0.00 C ATOM 129 O GLY A 11 17.813 6.776 3.735 1.00 0.00 O ATOM 0 H GLY A 11 17.075 7.284 -0.102 1.00 0.00 H new ATOM 0 HA2 GLY A 11 15.320 7.374 2.149 1.00 0.00 H new ATOM 0 HA3 GLY A 11 16.458 6.112 1.719 1.00 0.00 H new ATOM 133 N ALA A 12 17.422 8.931 3.170 1.00 0.00 N ATOM 134 CA ALA A 12 18.264 9.496 4.224 1.00 0.00 C ATOM 135 C ALA A 12 17.549 10.613 4.990 1.00 0.00 C ATOM 136 O ALA A 12 17.579 10.649 6.222 1.00 0.00 O ATOM 137 CB ALA A 12 19.561 10.031 3.635 1.00 0.00 C ATOM 0 H ALA A 12 16.973 9.629 2.576 1.00 0.00 H new ATOM 0 HA ALA A 12 18.484 8.692 4.927 1.00 0.00 H new ATOM 0 HB1 ALA A 12 20.177 10.448 4.431 1.00 0.00 H new ATOM 0 HB2 ALA A 12 20.100 9.220 3.146 1.00 0.00 H new ATOM 0 HB3 ALA A 12 19.336 10.809 2.905 1.00 0.00 H new ATOM 143 N SER A 13 16.921 11.529 4.252 1.00 0.00 N ATOM 144 CA SER A 13 16.213 12.664 4.849 1.00 0.00 C ATOM 145 C SER A 13 14.788 12.287 5.292 1.00 0.00 C ATOM 146 O SER A 13 13.834 13.030 5.050 1.00 0.00 O ATOM 147 CB SER A 13 16.164 13.823 3.847 1.00 0.00 C ATOM 148 OG SER A 13 15.621 14.994 4.438 1.00 0.00 O ATOM 0 H SER A 13 16.888 11.507 3.233 1.00 0.00 H new ATOM 0 HA SER A 13 16.760 12.968 5.741 1.00 0.00 H new ATOM 0 HB2 SER A 13 17.169 14.031 3.479 1.00 0.00 H new ATOM 0 HB3 SER A 13 15.562 13.536 2.985 1.00 0.00 H new ATOM 0 HG SER A 13 14.727 14.799 4.789 1.00 0.00 H new ATOM 154 N LEU A 14 14.646 11.135 5.942 1.00 0.00 N ATOM 155 CA LEU A 14 13.342 10.680 6.412 1.00 0.00 C ATOM 156 C LEU A 14 13.128 11.016 7.880 1.00 0.00 C ATOM 157 O LEU A 14 14.060 10.956 8.689 1.00 0.00 O ATOM 158 CB LEU A 14 13.169 9.180 6.189 1.00 0.00 C ATOM 159 CG LEU A 14 12.655 8.777 4.799 1.00 0.00 C ATOM 160 CD1 LEU A 14 11.331 9.465 4.482 1.00 0.00 C ATOM 161 CD2 LEU A 14 13.694 9.079 3.724 1.00 0.00 C ATOM 0 H LEU A 14 15.416 10.501 6.155 1.00 0.00 H new ATOM 0 HA LEU A 14 12.589 11.209 5.828 1.00 0.00 H new ATOM 0 HB2 LEU A 14 14.128 8.691 6.359 1.00 0.00 H new ATOM 0 HB3 LEU A 14 12.478 8.795 6.939 1.00 0.00 H new ATOM 0 HG LEU A 14 12.480 7.701 4.808 1.00 0.00 H new ATOM 0 HD11 LEU A 14 10.991 9.161 3.492 1.00 0.00 H new ATOM 0 HD12 LEU A 14 10.586 9.180 5.225 1.00 0.00 H new ATOM 0 HD13 LEU A 14 11.469 10.546 4.502 1.00 0.00 H new ATOM 0 HD21 LEU A 14 13.305 8.784 2.749 1.00 0.00 H new ATOM 0 HD22 LEU A 14 13.913 10.147 3.720 1.00 0.00 H new ATOM 0 HD23 LEU A 14 14.607 8.522 3.934 1.00 0.00 H new ATOM 173 N SER A 15 11.887 11.370 8.205 1.00 0.00 N ATOM 174 CA SER A 15 11.485 11.732 9.570 1.00 0.00 C ATOM 175 C SER A 15 9.962 11.737 9.682 1.00 0.00 C ATOM 176 O SER A 15 9.265 11.886 8.674 1.00 0.00 O ATOM 177 CB SER A 15 12.012 13.123 9.958 1.00 0.00 C ATOM 178 OG SER A 15 13.409 13.236 9.751 1.00 0.00 O ATOM 0 H SER A 15 11.125 11.415 7.528 1.00 0.00 H new ATOM 0 HA SER A 15 11.911 10.991 10.246 1.00 0.00 H new ATOM 0 HB2 SER A 15 11.496 13.883 9.372 1.00 0.00 H new ATOM 0 HB3 SER A 15 11.783 13.318 11.006 1.00 0.00 H new ATOM 0 HG SER A 15 13.797 12.343 9.642 1.00 0.00 H new ATOM 184 N PHE A 16 9.458 11.588 10.908 1.00 0.00 N ATOM 185 CA PHE A 16 8.015 11.583 11.166 1.00 0.00 C ATOM 186 C PHE A 16 7.374 12.891 10.707 1.00 0.00 C ATOM 187 O PHE A 16 6.233 12.902 10.257 1.00 0.00 O ATOM 188 CB PHE A 16 7.704 11.389 12.657 1.00 0.00 C ATOM 189 CG PHE A 16 8.304 10.156 13.286 1.00 0.00 C ATOM 190 CD1 PHE A 16 9.677 10.032 13.457 1.00 0.00 C ATOM 191 CD2 PHE A 16 7.486 9.132 13.735 1.00 0.00 C ATOM 192 CE1 PHE A 16 10.218 8.910 14.055 1.00 0.00 C ATOM 193 CE2 PHE A 16 8.022 8.010 14.337 1.00 0.00 C ATOM 194 CZ PHE A 16 9.389 7.900 14.495 1.00 0.00 C ATOM 0 H PHE A 16 10.031 11.468 11.743 1.00 0.00 H new ATOM 0 HA PHE A 16 7.602 10.747 10.602 1.00 0.00 H new ATOM 0 HB2 PHE A 16 8.059 12.264 13.202 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.622 11.351 12.784 1.00 0.00 H new ATOM 0 HD1 PHE A 16 10.330 10.823 13.118 1.00 0.00 H new ATOM 0 HD2 PHE A 16 6.416 9.212 13.613 1.00 0.00 H new ATOM 0 HE1 PHE A 16 11.288 8.824 14.177 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.372 7.220 14.684 1.00 0.00 H new ATOM 0 HZ PHE A 16 9.809 7.022 14.964 1.00 0.00 H new ATOM 204 N ASP A 17 8.114 13.993 10.847 1.00 0.00 N ATOM 205 CA ASP A 17 7.622 15.321 10.465 1.00 0.00 C ATOM 206 C ASP A 17 7.252 15.364 8.983 1.00 0.00 C ATOM 207 O ASP A 17 6.204 15.899 8.617 1.00 0.00 O ATOM 208 CB ASP A 17 8.670 16.397 10.799 1.00 0.00 C ATOM 209 CG ASP A 17 8.153 17.818 10.632 1.00 0.00 C ATOM 210 OD1 ASP A 17 7.884 18.229 9.485 1.00 0.00 O ATOM 211 OD2 ASP A 17 8.021 18.532 11.651 1.00 0.00 O ATOM 0 H ASP A 17 9.062 13.993 11.224 1.00 0.00 H new ATOM 0 HA ASP A 17 6.719 15.528 11.039 1.00 0.00 H new ATOM 0 HB2 ASP A 17 9.006 16.259 11.827 1.00 0.00 H new ATOM 0 HB3 ASP A 17 9.540 16.257 10.158 1.00 0.00 H new ATOM 216 N ILE A 18 8.091 14.766 8.135 1.00 0.00 N ATOM 217 CA ILE A 18 7.813 14.714 6.700 1.00 0.00 C ATOM 218 C ILE A 18 6.542 13.903 6.469 1.00 0.00 C ATOM 219 O ILE A 18 5.692 14.284 5.672 1.00 0.00 O ATOM 220 CB ILE A 18 8.993 14.104 5.883 1.00 0.00 C ATOM 221 CG1 ILE A 18 10.227 15.020 5.912 1.00 0.00 C ATOM 222 CG2 ILE A 18 8.578 13.846 4.439 1.00 0.00 C ATOM 223 CD1 ILE A 18 10.990 14.998 7.219 1.00 0.00 C ATOM 0 H ILE A 18 8.962 14.314 8.415 1.00 0.00 H new ATOM 0 HA ILE A 18 7.682 15.737 6.347 1.00 0.00 H new ATOM 0 HB ILE A 18 9.255 13.156 6.352 1.00 0.00 H new ATOM 0 HG12 ILE A 18 10.901 14.727 5.107 1.00 0.00 H new ATOM 0 HG13 ILE A 18 9.910 16.043 5.707 1.00 0.00 H new ATOM 0 HG21 ILE A 18 9.418 13.421 3.890 1.00 0.00 H new ATOM 0 HG22 ILE A 18 7.741 13.148 4.420 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.278 14.785 3.973 1.00 0.00 H new ATOM 0 HD11 ILE A 18 11.844 15.672 7.153 1.00 0.00 H new ATOM 0 HD12 ILE A 18 10.335 15.321 8.028 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.341 13.985 7.419 1.00 0.00 H new ATOM 235 N LEU A 19 6.409 12.802 7.212 1.00 0.00 N ATOM 236 CA LEU A 19 5.228 11.949 7.124 1.00 0.00 C ATOM 237 C LEU A 19 3.984 12.698 7.602 1.00 0.00 C ATOM 238 O LEU A 19 2.923 12.589 6.986 1.00 0.00 O ATOM 239 CB LEU A 19 5.433 10.658 7.917 1.00 0.00 C ATOM 240 CG LEU A 19 6.215 9.573 7.170 1.00 0.00 C ATOM 241 CD1 LEU A 19 6.669 8.478 8.126 1.00 0.00 C ATOM 242 CD2 LEU A 19 5.368 8.976 6.051 1.00 0.00 C ATOM 0 H LEU A 19 7.108 12.482 7.882 1.00 0.00 H new ATOM 0 HA LEU A 19 5.076 11.679 6.079 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.958 10.894 8.843 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.458 10.259 8.196 1.00 0.00 H new ATOM 0 HG LEU A 19 7.099 10.036 6.731 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.222 7.719 7.573 1.00 0.00 H new ATOM 0 HD12 LEU A 19 7.312 8.909 8.893 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.798 8.022 8.597 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.940 8.207 5.532 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.466 8.533 6.474 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.091 9.760 5.346 1.00 0.00 H new ATOM 254 N LYS A 20 4.126 13.487 8.676 1.00 0.00 N ATOM 255 CA LYS A 20 3.014 14.281 9.192 1.00 0.00 C ATOM 256 C LYS A 20 2.629 15.335 8.156 1.00 0.00 C ATOM 257 O LYS A 20 1.448 15.637 7.968 1.00 0.00 O ATOM 258 CB LYS A 20 3.386 14.944 10.524 1.00 0.00 C ATOM 259 CG LYS A 20 2.281 15.811 11.108 1.00 0.00 C ATOM 260 CD LYS A 20 2.684 16.400 12.451 1.00 0.00 C ATOM 261 CE LYS A 20 1.606 17.310 13.026 1.00 0.00 C ATOM 262 NZ LYS A 20 1.405 18.539 12.207 1.00 0.00 N ATOM 0 H LYS A 20 4.996 13.589 9.198 1.00 0.00 H new ATOM 0 HA LYS A 20 2.163 13.626 9.377 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.646 14.169 11.245 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.276 15.556 10.379 1.00 0.00 H new ATOM 0 HG2 LYS A 20 2.044 16.616 10.413 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.376 15.216 11.228 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.888 15.592 13.154 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.610 16.964 12.336 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.666 16.761 13.089 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.878 17.594 14.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.777 19.195 12.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.323 18.998 12.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.975 18.282 11.296 1.00 0.00 H new ATOM 276 N THR A 21 3.639 15.867 7.471 1.00 0.00 N ATOM 277 CA THR A 21 3.421 16.864 6.432 1.00 0.00 C ATOM 278 C THR A 21 2.727 16.224 5.226 1.00 0.00 C ATOM 279 O THR A 21 1.835 16.820 4.623 1.00 0.00 O ATOM 280 CB THR A 21 4.744 17.532 5.997 1.00 0.00 C ATOM 281 OG1 THR A 21 5.436 18.022 7.153 1.00 0.00 O ATOM 282 CG2 THR A 21 4.471 18.691 5.044 1.00 0.00 C ATOM 0 H THR A 21 4.618 15.622 7.619 1.00 0.00 H new ATOM 0 HA THR A 21 2.779 17.642 6.845 1.00 0.00 H new ATOM 0 HB THR A 21 5.356 16.791 5.484 1.00 0.00 H new ATOM 0 HG1 THR A 21 5.941 17.291 7.567 1.00 0.00 H new ATOM 0 HG21 THR A 21 5.415 19.149 4.749 1.00 0.00 H new ATOM 0 HG22 THR A 21 3.955 18.320 4.159 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.848 19.433 5.543 1.00 0.00 H new ATOM 290 N VAL A 22 3.122 14.987 4.912 1.00 0.00 N ATOM 291 CA VAL A 22 2.523 14.234 3.810 1.00 0.00 C ATOM 292 C VAL A 22 1.045 13.979 4.107 1.00 0.00 C ATOM 293 O VAL A 22 0.195 14.092 3.228 1.00 0.00 O ATOM 294 CB VAL A 22 3.265 12.892 3.564 1.00 0.00 C ATOM 295 CG1 VAL A 22 2.487 11.993 2.609 1.00 0.00 C ATOM 296 CG2 VAL A 22 4.652 13.157 3.005 1.00 0.00 C ATOM 0 H VAL A 22 3.858 14.485 5.409 1.00 0.00 H new ATOM 0 HA VAL A 22 2.615 14.829 2.901 1.00 0.00 H new ATOM 0 HB VAL A 22 3.350 12.378 4.521 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.034 11.062 2.458 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.507 11.773 3.033 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.363 12.500 1.652 1.00 0.00 H new ATOM 0 HG21 VAL A 22 5.163 12.209 2.836 1.00 0.00 H new ATOM 0 HG22 VAL A 22 4.567 13.697 2.062 1.00 0.00 H new ATOM 0 HG23 VAL A 22 5.222 13.756 3.715 1.00 0.00 H new ATOM 306 N LEU A 23 0.760 13.659 5.365 1.00 0.00 N ATOM 307 CA LEU A 23 -0.600 13.407 5.816 1.00 0.00 C ATOM 308 C LEU A 23 -1.446 14.677 5.675 1.00 0.00 C ATOM 309 O LEU A 23 -2.601 14.625 5.240 1.00 0.00 O ATOM 310 CB LEU A 23 -0.564 12.933 7.281 1.00 0.00 C ATOM 311 CG LEU A 23 -1.707 12.016 7.743 1.00 0.00 C ATOM 312 CD1 LEU A 23 -3.055 12.711 7.657 1.00 0.00 C ATOM 313 CD2 LEU A 23 -1.713 10.726 6.940 1.00 0.00 C ATOM 0 H LEU A 23 1.464 13.568 6.097 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.055 12.630 5.201 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.378 12.410 7.445 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.555 13.814 7.923 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.533 11.773 8.791 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.837 12.030 7.992 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.049 13.597 8.292 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -3.248 13.005 6.625 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.529 10.089 7.281 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.849 10.956 5.883 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.765 10.207 7.079 1.00 0.00 H new ATOM 325 N GLU A 24 -0.852 15.812 6.037 1.00 0.00 N ATOM 326 CA GLU A 24 -1.516 17.110 5.954 1.00 0.00 C ATOM 327 C GLU A 24 -1.731 17.524 4.494 1.00 0.00 C ATOM 328 O GLU A 24 -2.686 18.234 4.176 1.00 0.00 O ATOM 329 CB GLU A 24 -0.670 18.158 6.684 1.00 0.00 C ATOM 330 CG GLU A 24 -1.388 19.475 6.938 1.00 0.00 C ATOM 331 CD GLU A 24 -0.538 20.456 7.714 1.00 0.00 C ATOM 332 OE1 GLU A 24 -0.011 20.071 8.781 1.00 0.00 O ATOM 333 OE2 GLU A 24 -0.412 21.619 7.274 1.00 0.00 O ATOM 0 H GLU A 24 0.102 15.857 6.396 1.00 0.00 H new ATOM 0 HA GLU A 24 -2.495 17.036 6.428 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -0.345 17.745 7.639 1.00 0.00 H new ATOM 0 HB3 GLU A 24 0.229 18.354 6.099 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -1.672 19.920 5.985 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -2.309 19.283 7.488 1.00 0.00 H new ATOM 340 N ALA A 25 -0.823 17.078 3.622 1.00 0.00 N ATOM 341 CA ALA A 25 -0.872 17.395 2.192 1.00 0.00 C ATOM 342 C ALA A 25 -2.183 16.955 1.543 1.00 0.00 C ATOM 343 O ALA A 25 -2.723 17.675 0.698 1.00 0.00 O ATOM 344 CB ALA A 25 0.304 16.757 1.468 1.00 0.00 C ATOM 0 H ALA A 25 -0.034 16.488 3.887 1.00 0.00 H new ATOM 0 HA ALA A 25 -0.811 18.480 2.104 1.00 0.00 H new ATOM 0 HB1 ALA A 25 0.254 17.001 0.407 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.237 17.137 1.884 1.00 0.00 H new ATOM 0 HB3 ALA A 25 0.265 15.675 1.593 1.00 0.00 H new ATOM 350 N LEU A 26 -2.690 15.775 1.924 1.00 0.00 N ATOM 351 CA LEU A 26 -3.943 15.260 1.356 1.00 0.00 C ATOM 352 C LEU A 26 -5.121 16.181 1.689 1.00 0.00 C ATOM 353 O LEU A 26 -5.812 16.656 0.789 1.00 0.00 O ATOM 354 CB LEU A 26 -4.238 13.833 1.848 1.00 0.00 C ATOM 355 CG LEU A 26 -3.477 12.692 1.143 1.00 0.00 C ATOM 356 CD1 LEU A 26 -3.726 12.719 -0.360 1.00 0.00 C ATOM 357 CD2 LEU A 26 -1.984 12.754 1.439 1.00 0.00 C ATOM 0 H LEU A 26 -2.257 15.164 2.616 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.817 15.232 0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -4.013 13.786 2.914 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.307 13.649 1.739 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.858 11.750 1.538 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.178 11.905 -0.834 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.792 12.601 -0.554 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.386 13.671 -0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.477 11.936 0.927 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.583 13.705 1.089 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.822 12.665 2.513 1.00 0.00 H new ATOM 369 N GLY A 27 -5.318 16.438 2.988 1.00 0.00 N ATOM 370 CA GLY A 27 -6.386 17.321 3.454 1.00 0.00 C ATOM 371 C GLY A 27 -7.768 17.007 2.897 1.00 0.00 C ATOM 372 O GLY A 27 -8.580 17.913 2.715 1.00 0.00 O ATOM 0 H GLY A 27 -4.747 16.043 3.735 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -6.429 17.272 4.542 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -6.129 18.347 3.191 1.00 0.00 H new ATOM 376 N ASN A 28 -8.048 15.735 2.637 1.00 0.00 N ATOM 377 CA ASN A 28 -9.360 15.347 2.115 1.00 0.00 C ATOM 378 C ASN A 28 -10.233 14.795 3.244 1.00 0.00 C ATOM 379 O ASN A 28 -10.892 15.558 3.951 1.00 0.00 O ATOM 380 CB ASN A 28 -9.228 14.335 0.968 1.00 0.00 C ATOM 381 CG ASN A 28 -10.556 14.075 0.281 1.00 0.00 C ATOM 382 OD1 ASN A 28 -11.287 15.007 -0.045 1.00 0.00 O ATOM 383 ND2 ASN A 28 -10.864 12.813 0.033 1.00 0.00 N ATOM 0 H ASN A 28 -7.397 14.962 2.775 1.00 0.00 H new ATOM 0 HA ASN A 28 -9.844 16.234 1.707 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -8.509 14.707 0.238 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -8.831 13.397 1.356 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -11.736 12.585 -0.445 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -10.230 12.067 0.320 1.00 0.00 H new ATOM 390 N VAL A 29 -10.221 13.476 3.424 1.00 0.00 N ATOM 391 CA VAL A 29 -11.005 12.843 4.487 1.00 0.00 C ATOM 392 C VAL A 29 -10.274 12.981 5.833 1.00 0.00 C ATOM 393 O VAL A 29 -9.223 13.624 5.910 1.00 0.00 O ATOM 394 CB VAL A 29 -11.299 11.350 4.142 1.00 0.00 C ATOM 395 CG1 VAL A 29 -10.048 10.494 4.231 1.00 0.00 C ATOM 396 CG2 VAL A 29 -12.420 10.769 5.000 1.00 0.00 C ATOM 0 H VAL A 29 -9.681 12.826 2.852 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.966 13.351 4.571 1.00 0.00 H new ATOM 0 HB VAL A 29 -11.641 11.335 3.107 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -10.295 9.462 3.984 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -9.302 10.867 3.529 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -9.648 10.539 5.244 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -12.588 9.728 4.723 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -12.139 10.824 6.052 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.335 11.340 4.839 1.00 0.00 H new ATOM 406 N LYS A 30 -10.830 12.391 6.881 1.00 0.00 N ATOM 407 CA LYS A 30 -10.235 12.459 8.220 1.00 0.00 C ATOM 408 C LYS A 30 -9.151 11.383 8.426 1.00 0.00 C ATOM 409 O LYS A 30 -7.976 11.702 8.642 1.00 0.00 O ATOM 410 CB LYS A 30 -11.319 12.323 9.305 1.00 0.00 C ATOM 411 CG LYS A 30 -12.144 13.589 9.553 1.00 0.00 C ATOM 412 CD LYS A 30 -13.216 13.817 8.491 1.00 0.00 C ATOM 413 CE LYS A 30 -14.072 15.033 8.826 1.00 0.00 C ATOM 414 NZ LYS A 30 -15.128 15.296 7.809 1.00 0.00 N ATOM 0 H LYS A 30 -11.697 11.856 6.835 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.759 13.435 8.307 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -11.995 11.515 9.024 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.842 12.028 10.240 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.618 13.521 10.532 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -11.478 14.451 9.580 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.744 13.957 7.518 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -13.849 12.933 8.414 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -14.541 14.884 9.799 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -13.431 15.910 8.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -15.678 16.133 8.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.684 15.466 6.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -15.760 14.472 7.744 1.00 0.00 H new ATOM 428 N ARG A 31 -9.555 10.115 8.361 1.00 0.00 N ATOM 429 CA ARG A 31 -8.635 8.987 8.541 1.00 0.00 C ATOM 430 C ARG A 31 -7.936 8.628 7.237 1.00 0.00 C ATOM 431 O ARG A 31 -8.547 8.677 6.171 1.00 0.00 O ATOM 432 CB ARG A 31 -9.388 7.768 9.081 1.00 0.00 C ATOM 433 CG ARG A 31 -10.028 8.002 10.440 1.00 0.00 C ATOM 434 CD ARG A 31 -8.984 8.210 11.527 1.00 0.00 C ATOM 435 NE ARG A 31 -8.294 6.961 11.867 1.00 0.00 N ATOM 436 CZ ARG A 31 -8.845 5.949 12.548 1.00 0.00 C ATOM 437 NH1 ARG A 31 -10.073 6.058 13.043 1.00 0.00 N ATOM 438 NH2 ARG A 31 -8.152 4.839 12.758 1.00 0.00 N ATOM 0 H ARG A 31 -10.521 9.839 8.184 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.876 9.289 9.262 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.162 7.484 8.368 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -8.698 6.928 9.153 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -10.679 8.874 10.390 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -10.656 7.149 10.698 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -8.255 8.949 11.194 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -9.463 8.615 12.418 1.00 0.00 H new ATOM 0 HE ARG A 31 -7.326 6.856 11.563 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -10.604 6.918 12.905 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -10.485 5.282 13.561 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -7.200 4.757 12.401 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -8.571 4.067 13.277 1.00 0.00 H new ATOM 452 N LYS A 32 -6.656 8.271 7.331 1.00 0.00 N ATOM 453 CA LYS A 32 -5.864 7.898 6.154 1.00 0.00 C ATOM 454 C LYS A 32 -4.508 7.311 6.555 1.00 0.00 C ATOM 455 O LYS A 32 -4.082 7.423 7.716 1.00 0.00 O ATOM 456 CB LYS A 32 -5.669 9.104 5.227 1.00 0.00 C ATOM 457 CG LYS A 32 -4.935 10.264 5.870 1.00 0.00 C ATOM 458 CD LYS A 32 -5.200 11.564 5.136 1.00 0.00 C ATOM 459 CE LYS A 32 -6.614 12.052 5.385 1.00 0.00 C ATOM 460 NZ LYS A 32 -6.929 13.270 4.597 1.00 0.00 N ATOM 0 H LYS A 32 -6.142 8.231 8.211 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.418 7.129 5.616 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -5.118 8.784 4.343 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -6.645 9.449 4.887 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -5.247 10.362 6.910 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -3.864 10.060 5.876 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.488 12.322 5.463 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -5.044 11.420 4.067 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -7.320 11.262 5.129 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.743 12.264 6.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.695 13.797 5.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.083 13.872 4.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.230 12.996 3.640 1.00 0.00 H new ATOM 474 N ILE A 33 -3.845 6.673 5.591 1.00 0.00 N ATOM 475 CA ILE A 33 -2.545 6.047 5.828 1.00 0.00 C ATOM 476 C ILE A 33 -1.401 6.773 5.126 1.00 0.00 C ATOM 477 O ILE A 33 -1.522 7.171 3.966 1.00 0.00 O ATOM 478 CB ILE A 33 -2.537 4.553 5.398 1.00 0.00 C ATOM 479 CG1 ILE A 33 -3.000 4.388 3.938 1.00 0.00 C ATOM 480 CG2 ILE A 33 -3.409 3.738 6.340 1.00 0.00 C ATOM 481 CD1 ILE A 33 -2.936 2.964 3.417 1.00 0.00 C ATOM 0 H ILE A 33 -4.188 6.576 4.635 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.384 6.115 6.904 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.513 4.183 5.458 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -4.025 4.748 3.852 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.385 5.023 3.301 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -3.398 2.692 6.032 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -3.023 3.821 7.356 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.431 4.115 6.308 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -3.279 2.939 2.383 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.908 2.604 3.467 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -3.574 2.324 4.027 1.00 0.00 H new ATOM 493 N ALA A 34 -0.284 6.902 5.837 1.00 0.00 N ATOM 494 CA ALA A 34 0.925 7.524 5.308 1.00 0.00 C ATOM 495 C ALA A 34 2.082 6.543 5.491 1.00 0.00 C ATOM 496 O ALA A 34 2.433 6.179 6.616 1.00 0.00 O ATOM 497 CB ALA A 34 1.216 8.858 5.990 1.00 0.00 C ATOM 0 H ALA A 34 -0.192 6.577 6.799 1.00 0.00 H new ATOM 0 HA ALA A 34 0.789 7.745 4.249 1.00 0.00 H new ATOM 0 HB1 ALA A 34 2.124 9.291 5.570 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.380 9.539 5.829 1.00 0.00 H new ATOM 0 HB3 ALA A 34 1.352 8.698 7.060 1.00 0.00 H new ATOM 503 N VAL A 35 2.624 6.068 4.382 1.00 0.00 N ATOM 504 CA VAL A 35 3.693 5.069 4.405 1.00 0.00 C ATOM 505 C VAL A 35 5.030 5.648 3.929 1.00 0.00 C ATOM 506 O VAL A 35 5.075 6.478 3.022 1.00 0.00 O ATOM 507 CB VAL A 35 3.299 3.855 3.524 1.00 0.00 C ATOM 508 CG1 VAL A 35 4.311 2.724 3.631 1.00 0.00 C ATOM 509 CG2 VAL A 35 1.907 3.353 3.884 1.00 0.00 C ATOM 0 H VAL A 35 2.342 6.357 3.445 1.00 0.00 H new ATOM 0 HA VAL A 35 3.823 4.748 5.439 1.00 0.00 H new ATOM 0 HB VAL A 35 3.293 4.198 2.489 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.997 1.894 2.998 1.00 0.00 H new ATOM 0 HG12 VAL A 35 5.289 3.079 3.305 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.373 2.388 4.666 1.00 0.00 H new ATOM 0 HG21 VAL A 35 1.653 2.501 3.253 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.890 3.047 4.930 1.00 0.00 H new ATOM 0 HG23 VAL A 35 1.181 4.150 3.727 1.00 0.00 H new ATOM 519 N GLY A 36 6.115 5.187 4.548 1.00 0.00 N ATOM 520 CA GLY A 36 7.449 5.639 4.192 1.00 0.00 C ATOM 521 C GLY A 36 8.483 4.556 4.446 1.00 0.00 C ATOM 522 O GLY A 36 9.151 4.551 5.483 1.00 0.00 O ATOM 0 H GLY A 36 6.091 4.499 5.300 1.00 0.00 H new ATOM 0 HA2 GLY A 36 7.470 5.926 3.141 1.00 0.00 H new ATOM 0 HA3 GLY A 36 7.701 6.528 4.770 1.00 0.00 H new ATOM 526 N VAL A 37 8.584 3.616 3.511 1.00 0.00 N ATOM 527 CA VAL A 37 9.514 2.494 3.633 1.00 0.00 C ATOM 528 C VAL A 37 10.876 2.803 3.013 1.00 0.00 C ATOM 529 O VAL A 37 10.991 2.979 1.801 1.00 0.00 O ATOM 530 CB VAL A 37 8.935 1.219 2.967 1.00 0.00 C ATOM 531 CG1 VAL A 37 9.865 0.026 3.145 1.00 0.00 C ATOM 532 CG2 VAL A 37 7.553 0.899 3.519 1.00 0.00 C ATOM 0 H VAL A 37 8.030 3.608 2.655 1.00 0.00 H new ATOM 0 HA VAL A 37 9.651 2.323 4.701 1.00 0.00 H new ATOM 0 HB VAL A 37 8.846 1.420 1.899 1.00 0.00 H new ATOM 0 HG11 VAL A 37 9.428 -0.850 2.666 1.00 0.00 H new ATOM 0 HG12 VAL A 37 10.830 0.246 2.689 1.00 0.00 H new ATOM 0 HG13 VAL A 37 10.003 -0.172 4.208 1.00 0.00 H new ATOM 0 HG21 VAL A 37 7.168 0.001 3.037 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.620 0.733 4.594 1.00 0.00 H new ATOM 0 HG23 VAL A 37 6.880 1.734 3.322 1.00 0.00 H new ATOM 542 N ASP A 38 11.903 2.834 3.857 1.00 0.00 N ATOM 543 CA ASP A 38 13.268 3.084 3.410 1.00 0.00 C ATOM 544 C ASP A 38 13.883 1.809 2.852 1.00 0.00 C ATOM 545 O ASP A 38 14.485 1.025 3.586 1.00 0.00 O ATOM 546 CB ASP A 38 14.132 3.624 4.554 1.00 0.00 C ATOM 547 CG ASP A 38 13.900 5.102 4.823 1.00 0.00 C ATOM 548 OD1 ASP A 38 14.346 5.932 4.009 1.00 0.00 O ATOM 549 OD2 ASP A 38 13.262 5.419 5.842 1.00 0.00 O ATOM 0 H ASP A 38 11.813 2.688 4.862 1.00 0.00 H new ATOM 0 HA ASP A 38 13.231 3.837 2.623 1.00 0.00 H new ATOM 0 HB2 ASP A 38 13.921 3.057 5.461 1.00 0.00 H new ATOM 0 HB3 ASP A 38 15.183 3.464 4.315 1.00 0.00 H new ATOM 554 N ASN A 39 13.709 1.597 1.558 1.00 0.00 N ATOM 555 CA ASN A 39 14.237 0.408 0.890 1.00 0.00 C ATOM 556 C ASN A 39 15.758 0.498 0.746 1.00 0.00 C ATOM 557 O ASN A 39 16.281 0.956 -0.278 1.00 0.00 O ATOM 558 CB ASN A 39 13.577 0.232 -0.493 1.00 0.00 C ATOM 559 CG ASN A 39 13.891 -1.106 -1.176 1.00 0.00 C ATOM 560 OD1 ASN A 39 14.746 -1.879 -0.725 1.00 0.00 O ATOM 561 ND2 ASN A 39 13.182 -1.392 -2.267 1.00 0.00 N ATOM 0 H ASN A 39 13.204 2.234 0.942 1.00 0.00 H new ATOM 0 HA ASN A 39 14.002 -0.462 1.503 1.00 0.00 H new ATOM 0 HB2 ASN A 39 12.497 0.325 -0.382 1.00 0.00 H new ATOM 0 HB3 ASN A 39 13.902 1.044 -1.144 1.00 0.00 H new ATOM 0 HD21 ASN A 39 13.336 -2.272 -2.759 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.485 -0.731 -2.610 1.00 0.00 H new ATOM 568 N GLU A 40 16.452 0.035 1.779 1.00 0.00 N ATOM 569 CA GLU A 40 17.907 0.006 1.805 1.00 0.00 C ATOM 570 C GLU A 40 18.336 -1.465 1.848 1.00 0.00 C ATOM 571 O GLU A 40 19.256 -1.862 2.562 1.00 0.00 O ATOM 572 CB GLU A 40 18.449 0.793 3.013 1.00 0.00 C ATOM 573 CG GLU A 40 19.962 0.982 3.005 1.00 0.00 C ATOM 574 CD GLU A 40 20.460 1.723 1.780 1.00 0.00 C ATOM 575 OE1 GLU A 40 20.137 2.917 1.637 1.00 0.00 O ATOM 576 OE2 GLU A 40 21.177 1.110 0.959 1.00 0.00 O ATOM 0 H GLU A 40 16.018 -0.332 2.626 1.00 0.00 H new ATOM 0 HA GLU A 40 18.318 0.485 0.917 1.00 0.00 H new ATOM 0 HB2 GLU A 40 17.971 1.772 3.039 1.00 0.00 H new ATOM 0 HB3 GLU A 40 18.163 0.275 3.928 1.00 0.00 H new ATOM 0 HG2 GLU A 40 20.259 1.529 3.900 1.00 0.00 H new ATOM 0 HG3 GLU A 40 20.445 0.006 3.054 1.00 0.00 H new ATOM 583 N SER A 41 17.616 -2.270 1.076 1.00 0.00 N ATOM 584 CA SER A 41 17.860 -3.703 1.005 1.00 0.00 C ATOM 585 C SER A 41 18.464 -4.086 -0.343 1.00 0.00 C ATOM 586 O SER A 41 18.722 -5.262 -0.603 1.00 0.00 O ATOM 587 CB SER A 41 16.542 -4.451 1.224 1.00 0.00 C ATOM 588 OG SER A 41 16.727 -5.853 1.216 1.00 0.00 O ATOM 0 H SER A 41 16.850 -1.948 0.484 1.00 0.00 H new ATOM 0 HA SER A 41 18.572 -3.979 1.783 1.00 0.00 H new ATOM 0 HB2 SER A 41 16.105 -4.147 2.175 1.00 0.00 H new ATOM 0 HB3 SER A 41 15.832 -4.173 0.445 1.00 0.00 H new ATOM 0 HG SER A 41 17.096 -6.129 0.351 1.00 0.00 H new ATOM 594 N GLY A 42 18.688 -3.085 -1.193 1.00 0.00 N ATOM 595 CA GLY A 42 19.260 -3.334 -2.506 1.00 0.00 C ATOM 596 C GLY A 42 18.381 -4.214 -3.376 1.00 0.00 C ATOM 597 O GLY A 42 18.852 -5.202 -3.938 1.00 0.00 O ATOM 0 H GLY A 42 18.483 -2.106 -0.995 1.00 0.00 H new ATOM 0 HA2 GLY A 42 19.426 -2.382 -3.011 1.00 0.00 H new ATOM 0 HA3 GLY A 42 20.235 -3.806 -2.388 1.00 0.00 H new ATOM 601 N LYS A 43 17.101 -3.860 -3.484 1.00 0.00 N ATOM 602 CA LYS A 43 16.163 -4.636 -4.286 1.00 0.00 C ATOM 603 C LYS A 43 15.172 -3.730 -5.024 1.00 0.00 C ATOM 604 O LYS A 43 14.475 -2.920 -4.406 1.00 0.00 O ATOM 605 CB LYS A 43 15.423 -5.647 -3.396 1.00 0.00 C ATOM 606 CG LYS A 43 14.639 -5.017 -2.256 1.00 0.00 C ATOM 607 CD LYS A 43 14.143 -6.068 -1.282 1.00 0.00 C ATOM 608 CE LYS A 43 13.033 -5.541 -0.385 1.00 0.00 C ATOM 609 NZ LYS A 43 13.468 -4.388 0.451 1.00 0.00 N ATOM 0 H LYS A 43 16.693 -3.044 -3.027 1.00 0.00 H new ATOM 0 HA LYS A 43 16.729 -5.180 -5.042 1.00 0.00 H new ATOM 0 HB2 LYS A 43 14.739 -6.227 -4.016 1.00 0.00 H new ATOM 0 HB3 LYS A 43 16.148 -6.347 -2.980 1.00 0.00 H new ATOM 0 HG2 LYS A 43 15.270 -4.300 -1.731 1.00 0.00 H new ATOM 0 HG3 LYS A 43 13.792 -4.462 -2.658 1.00 0.00 H new ATOM 0 HD2 LYS A 43 13.780 -6.933 -1.837 1.00 0.00 H new ATOM 0 HD3 LYS A 43 14.974 -6.411 -0.666 1.00 0.00 H new ATOM 0 HE2 LYS A 43 12.186 -5.239 -1.001 1.00 0.00 H new ATOM 0 HE3 LYS A 43 12.684 -6.344 0.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 12.632 -3.880 0.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 14.028 -4.735 1.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 14.048 -3.743 -0.122 1.00 0.00 H new ATOM 623 N THR A 44 15.127 -3.875 -6.348 1.00 0.00 N ATOM 624 CA THR A 44 14.235 -3.089 -7.202 1.00 0.00 C ATOM 625 C THR A 44 12.818 -3.661 -7.219 1.00 0.00 C ATOM 626 O THR A 44 12.635 -4.879 -7.218 1.00 0.00 O ATOM 627 CB THR A 44 14.770 -3.027 -8.640 1.00 0.00 C ATOM 628 OG1 THR A 44 15.332 -4.293 -9.009 1.00 0.00 O ATOM 629 CG2 THR A 44 15.821 -1.940 -8.778 1.00 0.00 C ATOM 0 H THR A 44 15.707 -4.540 -6.859 1.00 0.00 H new ATOM 0 HA THR A 44 14.200 -2.084 -6.782 1.00 0.00 H new ATOM 0 HB THR A 44 13.939 -2.792 -9.305 1.00 0.00 H new ATOM 0 HG1 THR A 44 15.669 -4.246 -9.928 1.00 0.00 H new ATOM 0 HG21 THR A 44 16.186 -1.915 -9.805 1.00 0.00 H new ATOM 0 HG22 THR A 44 15.382 -0.975 -8.525 1.00 0.00 H new ATOM 0 HG23 THR A 44 16.651 -2.149 -8.103 1.00 0.00 H new ATOM 637 N TRP A 45 11.820 -2.776 -7.220 1.00 0.00 N ATOM 638 CA TRP A 45 10.421 -3.192 -7.222 1.00 0.00 C ATOM 639 C TRP A 45 9.721 -2.734 -8.491 1.00 0.00 C ATOM 640 O TRP A 45 9.881 -1.599 -8.909 1.00 0.00 O ATOM 641 CB TRP A 45 9.684 -2.613 -6.005 1.00 0.00 C ATOM 642 CG TRP A 45 10.131 -3.179 -4.690 1.00 0.00 C ATOM 643 CD1 TRP A 45 11.274 -3.873 -4.458 1.00 0.00 C ATOM 644 CD2 TRP A 45 9.459 -3.080 -3.426 1.00 0.00 C ATOM 645 NE1 TRP A 45 11.347 -4.249 -3.142 1.00 0.00 N ATOM 646 CE2 TRP A 45 10.246 -3.767 -2.484 1.00 0.00 C ATOM 647 CE3 TRP A 45 8.265 -2.488 -3.003 1.00 0.00 C ATOM 648 CZ2 TRP A 45 9.879 -3.876 -1.147 1.00 0.00 C ATOM 649 CZ3 TRP A 45 7.904 -2.597 -1.674 1.00 0.00 C ATOM 650 CH2 TRP A 45 8.708 -3.288 -0.760 1.00 0.00 C ATOM 0 H TRP A 45 11.957 -1.765 -7.219 1.00 0.00 H new ATOM 0 HA TRP A 45 10.400 -4.281 -7.175 1.00 0.00 H new ATOM 0 HB2 TRP A 45 9.825 -1.532 -5.989 1.00 0.00 H new ATOM 0 HB3 TRP A 45 8.615 -2.794 -6.121 1.00 0.00 H new ATOM 0 HD1 TRP A 45 12.021 -4.097 -5.205 1.00 0.00 H new ATOM 0 HE1 TRP A 45 12.097 -4.797 -2.722 1.00 0.00 H new ATOM 0 HE3 TRP A 45 7.637 -1.956 -3.702 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 10.498 -4.407 -0.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 6.986 -2.141 -1.334 1.00 0.00 H new ATOM 0 HH2 TRP A 45 8.396 -3.358 0.272 1.00 0.00 H new ATOM 661 N THR A 46 8.939 -3.614 -9.085 1.00 0.00 N ATOM 662 CA THR A 46 8.193 -3.291 -10.288 1.00 0.00 C ATOM 663 C THR A 46 6.718 -3.598 -10.045 1.00 0.00 C ATOM 664 O THR A 46 6.393 -4.557 -9.352 1.00 0.00 O ATOM 665 CB THR A 46 8.705 -4.095 -11.505 1.00 0.00 C ATOM 666 OG1 THR A 46 10.137 -4.034 -11.561 1.00 0.00 O ATOM 667 CG2 THR A 46 8.125 -3.554 -12.810 1.00 0.00 C ATOM 0 H THR A 46 8.802 -4.568 -8.751 1.00 0.00 H new ATOM 0 HA THR A 46 8.329 -2.233 -10.513 1.00 0.00 H new ATOM 0 HB THR A 46 8.381 -5.129 -11.385 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.456 -4.546 -12.333 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.504 -4.140 -13.647 1.00 0.00 H new ATOM 0 HG22 THR A 46 7.038 -3.623 -12.781 1.00 0.00 H new ATOM 0 HG23 THR A 46 8.419 -2.512 -12.934 1.00 0.00 H new ATOM 675 N ALA A 47 5.832 -2.771 -10.578 1.00 0.00 N ATOM 676 CA ALA A 47 4.397 -2.959 -10.378 1.00 0.00 C ATOM 677 C ALA A 47 3.894 -4.295 -10.919 1.00 0.00 C ATOM 678 O ALA A 47 4.053 -4.602 -12.103 1.00 0.00 O ATOM 679 CB ALA A 47 3.622 -1.823 -11.026 1.00 0.00 C ATOM 0 H ALA A 47 6.077 -1.964 -11.152 1.00 0.00 H new ATOM 0 HA ALA A 47 4.229 -2.960 -9.301 1.00 0.00 H new ATOM 0 HB1 ALA A 47 2.554 -1.975 -10.870 1.00 0.00 H new ATOM 0 HB2 ALA A 47 3.923 -0.876 -10.579 1.00 0.00 H new ATOM 0 HB3 ALA A 47 3.833 -1.802 -12.095 1.00 0.00 H new ATOM 685 N LEU A 48 3.280 -5.081 -10.035 1.00 0.00 N ATOM 686 CA LEU A 48 2.733 -6.376 -10.413 1.00 0.00 C ATOM 687 C LEU A 48 1.231 -6.458 -10.117 1.00 0.00 C ATOM 688 O LEU A 48 0.449 -6.850 -10.984 1.00 0.00 O ATOM 689 CB LEU A 48 3.460 -7.517 -9.691 1.00 0.00 C ATOM 690 CG LEU A 48 3.004 -8.922 -10.100 1.00 0.00 C ATOM 691 CD1 LEU A 48 3.421 -9.228 -11.530 1.00 0.00 C ATOM 692 CD2 LEU A 48 3.555 -9.966 -9.147 1.00 0.00 C ATOM 0 H LEU A 48 3.151 -4.840 -9.052 1.00 0.00 H new ATOM 0 HA LEU A 48 2.884 -6.483 -11.487 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.530 -7.427 -9.881 1.00 0.00 H new ATOM 0 HB3 LEU A 48 3.316 -7.400 -8.617 1.00 0.00 H new ATOM 0 HG LEU A 48 1.916 -8.954 -10.047 1.00 0.00 H new ATOM 0 HD11 LEU A 48 3.087 -10.230 -11.800 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.969 -8.501 -12.204 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.506 -9.173 -11.612 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.218 -10.955 -9.457 1.00 0.00 H new ATOM 0 HD22 LEU A 48 4.644 -9.933 -9.161 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.199 -9.761 -8.137 1.00 0.00 H new ATOM 704 N ASN A 49 0.827 -6.103 -8.894 1.00 0.00 N ATOM 705 CA ASN A 49 -0.582 -6.167 -8.511 1.00 0.00 C ATOM 706 C ASN A 49 -0.871 -5.279 -7.302 1.00 0.00 C ATOM 707 O ASN A 49 -0.056 -5.175 -6.387 1.00 0.00 O ATOM 708 CB ASN A 49 -0.980 -7.616 -8.198 1.00 0.00 C ATOM 709 CG ASN A 49 -2.476 -7.789 -7.984 1.00 0.00 C ATOM 710 OD1 ASN A 49 -3.278 -7.496 -8.868 1.00 0.00 O ATOM 711 ND2 ASN A 49 -2.859 -8.270 -6.811 1.00 0.00 N ATOM 0 H ASN A 49 1.452 -5.771 -8.159 1.00 0.00 H new ATOM 0 HA ASN A 49 -1.173 -5.802 -9.351 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -0.659 -8.260 -9.017 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.450 -7.948 -7.305 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.850 -8.409 -6.616 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -2.163 -8.501 -6.103 1.00 0.00 H new ATOM 718 N THR A 50 -2.039 -4.651 -7.314 1.00 0.00 N ATOM 719 CA THR A 50 -2.476 -3.773 -6.234 1.00 0.00 C ATOM 720 C THR A 50 -3.984 -3.884 -6.044 1.00 0.00 C ATOM 721 O THR A 50 -4.744 -3.774 -7.007 1.00 0.00 O ATOM 722 CB THR A 50 -2.114 -2.301 -6.519 1.00 0.00 C ATOM 723 OG1 THR A 50 -2.355 -1.994 -7.901 1.00 0.00 O ATOM 724 CG2 THR A 50 -0.661 -2.014 -6.170 1.00 0.00 C ATOM 0 H THR A 50 -2.713 -4.736 -8.075 1.00 0.00 H new ATOM 0 HA THR A 50 -1.960 -4.090 -5.327 1.00 0.00 H new ATOM 0 HB THR A 50 -2.745 -1.670 -5.893 1.00 0.00 H new ATOM 0 HG1 THR A 50 -3.210 -1.523 -7.987 1.00 0.00 H new ATOM 0 HG21 THR A 50 -0.436 -0.969 -6.382 1.00 0.00 H new ATOM 0 HG22 THR A 50 -0.495 -2.214 -5.111 1.00 0.00 H new ATOM 0 HG23 THR A 50 -0.010 -2.653 -6.767 1.00 0.00 H new ATOM 732 N TYR A 51 -4.414 -4.119 -4.807 1.00 0.00 N ATOM 733 CA TYR A 51 -5.839 -4.266 -4.502 1.00 0.00 C ATOM 734 C TYR A 51 -6.137 -3.865 -3.058 1.00 0.00 C ATOM 735 O TYR A 51 -5.371 -4.178 -2.144 1.00 0.00 O ATOM 736 CB TYR A 51 -6.280 -5.718 -4.726 1.00 0.00 C ATOM 737 CG TYR A 51 -7.376 -5.891 -5.756 1.00 0.00 C ATOM 738 CD1 TYR A 51 -7.160 -5.588 -7.095 1.00 0.00 C ATOM 739 CD2 TYR A 51 -8.622 -6.380 -5.389 1.00 0.00 C ATOM 740 CE1 TYR A 51 -8.156 -5.761 -8.036 1.00 0.00 C ATOM 741 CE2 TYR A 51 -9.623 -6.560 -6.323 1.00 0.00 C ATOM 742 CZ TYR A 51 -9.386 -6.248 -7.645 1.00 0.00 C ATOM 743 OH TYR A 51 -10.381 -6.433 -8.580 1.00 0.00 O ATOM 0 H TYR A 51 -3.799 -4.212 -3.999 1.00 0.00 H new ATOM 0 HA TYR A 51 -6.393 -3.606 -5.170 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -5.414 -6.304 -5.034 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.623 -6.131 -3.777 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -6.197 -5.211 -7.405 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.812 -6.624 -4.354 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -7.973 -5.516 -9.072 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -10.586 -6.943 -6.020 1.00 0.00 H new ATOM 0 HH TYR A 51 -11.183 -6.783 -8.139 1.00 0.00 H new ATOM 753 N PHE A 52 -7.261 -3.184 -2.853 1.00 0.00 N ATOM 754 CA PHE A 52 -7.667 -2.759 -1.517 1.00 0.00 C ATOM 755 C PHE A 52 -9.003 -3.390 -1.140 1.00 0.00 C ATOM 756 O PHE A 52 -9.926 -3.440 -1.949 1.00 0.00 O ATOM 757 CB PHE A 52 -7.756 -1.231 -1.420 1.00 0.00 C ATOM 758 CG PHE A 52 -6.418 -0.537 -1.440 1.00 0.00 C ATOM 759 CD1 PHE A 52 -5.617 -0.565 -2.572 1.00 0.00 C ATOM 760 CD2 PHE A 52 -5.964 0.147 -0.322 1.00 0.00 C ATOM 761 CE1 PHE A 52 -4.390 0.069 -2.588 1.00 0.00 C ATOM 762 CE2 PHE A 52 -4.737 0.783 -0.333 1.00 0.00 C ATOM 763 CZ PHE A 52 -3.950 0.744 -1.466 1.00 0.00 C ATOM 0 H PHE A 52 -7.907 -2.915 -3.595 1.00 0.00 H new ATOM 0 HA PHE A 52 -6.905 -3.097 -0.815 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -8.359 -0.859 -2.248 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -8.278 -0.965 -0.501 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.957 -1.090 -3.453 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -6.576 0.183 0.567 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -3.776 0.037 -3.476 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.394 1.310 0.545 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.991 1.241 -1.475 1.00 0.00 H new ATOM 773 N ARG A 53 -9.081 -3.891 0.088 1.00 0.00 N ATOM 774 CA ARG A 53 -10.287 -4.550 0.591 1.00 0.00 C ATOM 775 C ARG A 53 -11.337 -3.540 1.071 1.00 0.00 C ATOM 776 O ARG A 53 -12.538 -3.812 1.014 1.00 0.00 O ATOM 777 CB ARG A 53 -9.920 -5.500 1.738 1.00 0.00 C ATOM 778 CG ARG A 53 -11.018 -6.490 2.106 1.00 0.00 C ATOM 779 CD ARG A 53 -10.620 -7.334 3.307 1.00 0.00 C ATOM 780 NE ARG A 53 -11.630 -8.341 3.644 1.00 0.00 N ATOM 781 CZ ARG A 53 -11.579 -9.108 4.733 1.00 0.00 C ATOM 782 NH1 ARG A 53 -10.583 -8.977 5.594 1.00 0.00 N ATOM 783 NH2 ARG A 53 -12.518 -10.012 4.957 1.00 0.00 N ATOM 0 H ARG A 53 -8.316 -3.854 0.762 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.723 -5.113 -0.234 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.024 -6.055 1.462 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -9.670 -4.908 2.619 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -11.939 -5.950 2.327 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.226 -7.139 1.255 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.672 -7.830 3.100 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.459 -6.684 4.167 1.00 0.00 H new ATOM 0 HE ARG A 53 -12.418 -8.462 3.008 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -9.851 -8.287 5.426 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -10.547 -9.566 6.426 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -13.286 -10.125 4.295 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -12.474 -10.596 5.792 1.00 0.00 H new ATOM 797 N SER A 54 -10.887 -2.391 1.575 1.00 0.00 N ATOM 798 CA SER A 54 -11.816 -1.391 2.090 1.00 0.00 C ATOM 799 C SER A 54 -11.680 -0.045 1.360 1.00 0.00 C ATOM 800 O SER A 54 -12.517 0.295 0.523 1.00 0.00 O ATOM 801 CB SER A 54 -11.592 -1.225 3.598 1.00 0.00 C ATOM 802 OG SER A 54 -12.503 -0.307 4.171 1.00 0.00 O ATOM 0 H SER A 54 -9.902 -2.134 1.637 1.00 0.00 H new ATOM 0 HA SER A 54 -12.833 -1.739 1.909 1.00 0.00 H new ATOM 0 HB2 SER A 54 -11.696 -2.193 4.089 1.00 0.00 H new ATOM 0 HB3 SER A 54 -10.572 -0.884 3.778 1.00 0.00 H new ATOM 0 HG SER A 54 -12.102 0.587 4.185 1.00 0.00 H new ATOM 808 N GLY A 55 -10.637 0.718 1.689 1.00 0.00 N ATOM 809 CA GLY A 55 -10.430 2.016 1.065 1.00 0.00 C ATOM 810 C GLY A 55 -9.732 1.924 -0.280 1.00 0.00 C ATOM 811 O GLY A 55 -9.970 0.991 -1.046 1.00 0.00 O ATOM 0 H GLY A 55 -9.931 0.459 2.378 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.394 2.508 0.935 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -9.839 2.644 1.732 1.00 0.00 H new ATOM 815 N THR A 56 -8.870 2.896 -0.572 1.00 0.00 N ATOM 816 CA THR A 56 -8.147 2.918 -1.837 1.00 0.00 C ATOM 817 C THR A 56 -7.013 3.938 -1.815 1.00 0.00 C ATOM 818 O THR A 56 -7.028 4.896 -1.039 1.00 0.00 O ATOM 819 CB THR A 56 -9.085 3.230 -3.032 1.00 0.00 C ATOM 820 OG1 THR A 56 -8.335 3.394 -4.246 1.00 0.00 O ATOM 821 CG2 THR A 56 -9.918 4.481 -2.770 1.00 0.00 C ATOM 0 H THR A 56 -8.657 3.676 0.050 1.00 0.00 H new ATOM 0 HA THR A 56 -7.729 1.920 -1.968 1.00 0.00 H new ATOM 0 HB THR A 56 -9.758 2.380 -3.145 1.00 0.00 H new ATOM 0 HG1 THR A 56 -8.948 3.588 -4.986 1.00 0.00 H new ATOM 0 HG21 THR A 56 -10.565 4.673 -3.626 1.00 0.00 H new ATOM 0 HG22 THR A 56 -10.529 4.332 -1.880 1.00 0.00 H new ATOM 0 HG23 THR A 56 -9.256 5.333 -2.617 1.00 0.00 H new ATOM 829 N SER A 57 -6.046 3.728 -2.691 1.00 0.00 N ATOM 830 CA SER A 57 -4.906 4.628 -2.811 1.00 0.00 C ATOM 831 C SER A 57 -5.004 5.398 -4.127 1.00 0.00 C ATOM 832 O SER A 57 -5.250 6.606 -4.130 1.00 0.00 O ATOM 833 CB SER A 57 -3.591 3.842 -2.721 1.00 0.00 C ATOM 834 OG SER A 57 -2.466 4.700 -2.811 1.00 0.00 O ATOM 0 H SER A 57 -6.026 2.937 -3.335 1.00 0.00 H new ATOM 0 HA SER A 57 -4.918 5.343 -1.988 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.557 3.294 -1.780 1.00 0.00 H new ATOM 0 HB3 SER A 57 -3.552 3.103 -3.522 1.00 0.00 H new ATOM 0 HG SER A 57 -2.441 5.289 -2.028 1.00 0.00 H new ATOM 840 N ASP A 58 -4.857 4.680 -5.243 1.00 0.00 N ATOM 841 CA ASP A 58 -4.964 5.274 -6.579 1.00 0.00 C ATOM 842 C ASP A 58 -4.934 4.166 -7.634 1.00 0.00 C ATOM 843 O ASP A 58 -4.367 4.332 -8.715 1.00 0.00 O ATOM 844 CB ASP A 58 -3.812 6.262 -6.829 1.00 0.00 C ATOM 845 CG ASP A 58 -4.192 7.381 -7.783 1.00 0.00 C ATOM 846 OD1 ASP A 58 -4.526 7.093 -8.951 1.00 0.00 O ATOM 847 OD2 ASP A 58 -4.153 8.559 -7.363 1.00 0.00 O ATOM 0 H ASP A 58 -4.662 3.679 -5.248 1.00 0.00 H new ATOM 0 HA ASP A 58 -5.906 5.819 -6.645 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -3.496 6.693 -5.879 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.957 5.721 -7.234 1.00 0.00 H new ATOM 852 N ILE A 59 -5.571 3.031 -7.297 1.00 0.00 N ATOM 853 CA ILE A 59 -5.666 1.845 -8.171 1.00 0.00 C ATOM 854 C ILE A 59 -4.298 1.190 -8.438 1.00 0.00 C ATOM 855 O ILE A 59 -4.107 0.007 -8.154 1.00 0.00 O ATOM 856 CB ILE A 59 -6.360 2.163 -9.519 1.00 0.00 C ATOM 857 CG1 ILE A 59 -7.697 2.881 -9.281 1.00 0.00 C ATOM 858 CG2 ILE A 59 -6.577 0.880 -10.322 1.00 0.00 C ATOM 859 CD1 ILE A 59 -8.368 3.367 -10.552 1.00 0.00 C ATOM 0 H ILE A 59 -6.040 2.908 -6.400 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.281 1.134 -7.620 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.712 2.825 -10.093 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -8.374 2.204 -8.760 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.529 3.733 -8.622 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.066 1.120 -11.266 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.615 0.408 -10.521 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.206 0.196 -9.752 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -9.306 3.863 -10.302 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -7.711 4.070 -11.064 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -8.570 2.518 -11.205 1.00 0.00 H new ATOM 871 N VAL A 60 -3.359 1.955 -8.979 1.00 0.00 N ATOM 872 CA VAL A 60 -2.023 1.450 -9.288 1.00 0.00 C ATOM 873 C VAL A 60 -0.956 2.085 -8.398 1.00 0.00 C ATOM 874 O VAL A 60 -1.095 3.224 -7.950 1.00 0.00 O ATOM 875 CB VAL A 60 -1.645 1.670 -10.776 1.00 0.00 C ATOM 876 CG1 VAL A 60 -2.527 0.831 -11.694 1.00 0.00 C ATOM 877 CG2 VAL A 60 -1.728 3.146 -11.152 1.00 0.00 C ATOM 0 H VAL A 60 -3.498 2.937 -9.216 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.056 0.378 -9.092 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.613 1.346 -10.907 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.241 1.004 -12.731 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.401 -0.225 -11.454 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.570 1.113 -11.554 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.458 3.270 -12.201 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.745 3.505 -10.994 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.041 3.719 -10.530 1.00 0.00 H new ATOM 887 N LEU A 61 0.110 1.330 -8.157 1.00 0.00 N ATOM 888 CA LEU A 61 1.226 1.789 -7.332 1.00 0.00 C ATOM 889 C LEU A 61 2.105 2.804 -8.091 1.00 0.00 C ATOM 890 O LEU A 61 1.923 2.994 -9.296 1.00 0.00 O ATOM 891 CB LEU A 61 2.051 0.575 -6.865 1.00 0.00 C ATOM 892 CG LEU A 61 2.665 -0.293 -7.970 1.00 0.00 C ATOM 893 CD1 LEU A 61 4.053 0.208 -8.352 1.00 0.00 C ATOM 894 CD2 LEU A 61 2.725 -1.747 -7.528 1.00 0.00 C ATOM 0 H LEU A 61 0.227 0.386 -8.525 1.00 0.00 H new ATOM 0 HA LEU A 61 0.829 2.305 -6.458 1.00 0.00 H new ATOM 0 HB2 LEU A 61 2.856 0.934 -6.225 1.00 0.00 H new ATOM 0 HB3 LEU A 61 1.412 -0.057 -6.249 1.00 0.00 H new ATOM 0 HG LEU A 61 2.028 -0.222 -8.852 1.00 0.00 H new ATOM 0 HD11 LEU A 61 4.465 -0.426 -9.137 1.00 0.00 H new ATOM 0 HD12 LEU A 61 3.983 1.234 -8.713 1.00 0.00 H new ATOM 0 HD13 LEU A 61 4.705 0.174 -7.479 1.00 0.00 H new ATOM 0 HD21 LEU A 61 3.163 -2.351 -8.323 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.337 -1.829 -6.630 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.718 -2.104 -7.314 1.00 0.00 H new ATOM 906 N PRO A 62 3.059 3.482 -7.394 1.00 0.00 N ATOM 907 CA PRO A 62 3.951 4.489 -8.006 1.00 0.00 C ATOM 908 C PRO A 62 4.619 4.036 -9.317 1.00 0.00 C ATOM 909 O PRO A 62 4.191 4.447 -10.394 1.00 0.00 O ATOM 910 CB PRO A 62 5.008 4.716 -6.926 1.00 0.00 C ATOM 911 CG PRO A 62 4.296 4.454 -5.650 1.00 0.00 C ATOM 912 CD PRO A 62 3.321 3.345 -5.943 1.00 0.00 C ATOM 0 HA PRO A 62 3.390 5.378 -8.295 1.00 0.00 H new ATOM 0 HB2 PRO A 62 5.856 4.043 -7.053 1.00 0.00 H new ATOM 0 HB3 PRO A 62 5.399 5.733 -6.961 1.00 0.00 H new ATOM 0 HG2 PRO A 62 4.994 4.163 -4.865 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.778 5.347 -5.301 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.741 2.368 -5.702 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.407 3.451 -5.359 1.00 0.00 H new ATOM 920 N HIS A 63 5.672 3.206 -9.228 1.00 0.00 N ATOM 921 CA HIS A 63 6.377 2.729 -10.431 1.00 0.00 C ATOM 922 C HIS A 63 7.471 1.698 -10.113 1.00 0.00 C ATOM 923 O HIS A 63 7.433 0.575 -10.620 1.00 0.00 O ATOM 924 CB HIS A 63 6.986 3.909 -11.237 1.00 0.00 C ATOM 925 CG HIS A 63 7.803 4.888 -10.429 1.00 0.00 C ATOM 926 ND1 HIS A 63 9.144 5.022 -10.294 1.00 0.00 N flip ATOM 927 CD2 HIS A 63 7.246 5.847 -9.611 1.00 0.00 C flip ATOM 928 CE1 HIS A 63 9.371 6.040 -9.400 1.00 0.00 C flip ATOM 929 NE2 HIS A 63 8.208 6.522 -9.008 1.00 0.00 N flip ATOM 0 H HIS A 63 6.050 2.855 -8.348 1.00 0.00 H new ATOM 0 HA HIS A 63 5.622 2.231 -11.040 1.00 0.00 H new ATOM 0 HB2 HIS A 63 7.616 3.501 -12.027 1.00 0.00 H new ATOM 0 HB3 HIS A 63 6.176 4.452 -11.723 1.00 0.00 H new ATOM 0 HD2 HIS A 63 6.188 6.020 -9.483 1.00 0.00 H new ATOM 0 HE1 HIS A 63 10.340 6.387 -9.073 1.00 0.00 H new ATOM 0 HE2 HIS A 63 8.074 7.289 -8.349 1.00 0.00 H new ATOM 938 N LYS A 64 8.448 2.083 -9.291 1.00 0.00 N ATOM 939 CA LYS A 64 9.554 1.193 -8.932 1.00 0.00 C ATOM 940 C LYS A 64 10.249 1.681 -7.662 1.00 0.00 C ATOM 941 O LYS A 64 10.416 2.889 -7.465 1.00 0.00 O ATOM 942 CB LYS A 64 10.570 1.080 -10.089 1.00 0.00 C ATOM 943 CG LYS A 64 11.235 2.389 -10.504 1.00 0.00 C ATOM 944 CD LYS A 64 12.388 2.143 -11.469 1.00 0.00 C ATOM 945 CE LYS A 64 13.074 3.439 -11.885 1.00 0.00 C ATOM 946 NZ LYS A 64 12.285 4.203 -12.892 1.00 0.00 N ATOM 0 H LYS A 64 8.496 3.006 -8.860 1.00 0.00 H new ATOM 0 HA LYS A 64 9.139 0.203 -8.743 1.00 0.00 H new ATOM 0 HB2 LYS A 64 11.347 0.373 -9.800 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.062 0.659 -10.957 1.00 0.00 H new ATOM 0 HG2 LYS A 64 10.498 3.041 -10.973 1.00 0.00 H new ATOM 0 HG3 LYS A 64 11.603 2.909 -9.619 1.00 0.00 H new ATOM 0 HD2 LYS A 64 13.117 1.482 -11.001 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.015 1.630 -12.355 1.00 0.00 H new ATOM 0 HE2 LYS A 64 13.233 4.061 -11.004 1.00 0.00 H new ATOM 0 HE3 LYS A 64 14.057 3.210 -12.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 12.793 5.075 -13.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.154 3.622 -13.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 11.356 4.446 -12.493 1.00 0.00 H new ATOM 960 N VAL A 65 10.650 0.744 -6.802 1.00 0.00 N ATOM 961 CA VAL A 65 11.324 1.092 -5.556 1.00 0.00 C ATOM 962 C VAL A 65 12.760 0.572 -5.570 1.00 0.00 C ATOM 963 O VAL A 65 13.004 -0.609 -5.319 1.00 0.00 O ATOM 964 CB VAL A 65 10.574 0.527 -4.328 1.00 0.00 C ATOM 965 CG1 VAL A 65 11.135 1.105 -3.036 1.00 0.00 C ATOM 966 CG2 VAL A 65 9.080 0.803 -4.436 1.00 0.00 C ATOM 0 H VAL A 65 10.519 -0.257 -6.947 1.00 0.00 H new ATOM 0 HA VAL A 65 11.332 2.179 -5.477 1.00 0.00 H new ATOM 0 HB VAL A 65 10.722 -0.553 -4.309 1.00 0.00 H new ATOM 0 HG11 VAL A 65 10.591 0.692 -2.186 1.00 0.00 H new ATOM 0 HG12 VAL A 65 12.191 0.848 -2.951 1.00 0.00 H new ATOM 0 HG13 VAL A 65 11.025 2.189 -3.045 1.00 0.00 H new ATOM 0 HG21 VAL A 65 8.571 0.397 -3.562 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.911 1.879 -4.487 1.00 0.00 H new ATOM 0 HG23 VAL A 65 8.687 0.331 -5.336 1.00 0.00 H new ATOM 976 N PRO A 66 13.728 1.445 -5.895 1.00 0.00 N ATOM 977 CA PRO A 66 15.143 1.089 -5.974 1.00 0.00 C ATOM 978 C PRO A 66 15.869 1.174 -4.627 1.00 0.00 C ATOM 979 O PRO A 66 15.327 1.686 -3.645 1.00 0.00 O ATOM 980 CB PRO A 66 15.718 2.126 -6.952 1.00 0.00 C ATOM 981 CG PRO A 66 14.593 3.060 -7.289 1.00 0.00 C ATOM 982 CD PRO A 66 13.534 2.850 -6.246 1.00 0.00 C ATOM 0 HA PRO A 66 15.271 0.054 -6.289 1.00 0.00 H new ATOM 0 HB2 PRO A 66 16.550 2.667 -6.500 1.00 0.00 H new ATOM 0 HB3 PRO A 66 16.103 1.642 -7.850 1.00 0.00 H new ATOM 0 HG2 PRO A 66 14.936 4.095 -7.290 1.00 0.00 H new ATOM 0 HG3 PRO A 66 14.202 2.852 -8.285 1.00 0.00 H new ATOM 0 HD2 PRO A 66 13.671 3.508 -5.388 1.00 0.00 H new ATOM 0 HD3 PRO A 66 12.534 3.039 -6.636 1.00 0.00 H new ATOM 990 N HIS A 67 17.098 0.661 -4.602 1.00 0.00 N ATOM 991 CA HIS A 67 17.933 0.657 -3.396 1.00 0.00 C ATOM 992 C HIS A 67 18.307 2.072 -2.933 1.00 0.00 C ATOM 993 O HIS A 67 18.630 2.941 -3.746 1.00 0.00 O ATOM 994 CB HIS A 67 19.212 -0.177 -3.618 1.00 0.00 C ATOM 995 CG HIS A 67 20.053 0.215 -4.811 1.00 0.00 C ATOM 996 ND1 HIS A 67 19.918 1.219 -5.716 1.00 0.00 N flip ATOM 997 CD2 HIS A 67 21.188 -0.472 -5.186 1.00 0.00 C flip ATOM 998 CE1 HIS A 67 20.959 1.116 -6.605 1.00 0.00 C flip ATOM 999 NE2 HIS A 67 21.710 0.090 -6.261 1.00 0.00 N flip ATOM 0 H HIS A 67 17.545 0.236 -5.415 1.00 0.00 H new ATOM 0 HA HIS A 67 17.335 0.201 -2.607 1.00 0.00 H new ATOM 0 HB2 HIS A 67 19.830 -0.106 -2.723 1.00 0.00 H new ATOM 0 HB3 HIS A 67 18.927 -1.223 -3.726 1.00 0.00 H new ATOM 0 HD1 HIS A 67 19.178 1.921 -5.732 1.00 0.00 H new ATOM 0 HD2 HIS A 67 21.589 -1.337 -4.678 1.00 0.00 H new ATOM 0 HE1 HIS A 67 21.133 1.769 -7.448 1.00 0.00 H new ATOM 1008 N GLY A 68 18.263 2.279 -1.619 1.00 0.00 N ATOM 1009 CA GLY A 68 18.598 3.566 -1.038 1.00 0.00 C ATOM 1010 C GLY A 68 17.532 4.614 -1.283 1.00 0.00 C ATOM 1011 O GLY A 68 17.847 5.780 -1.522 1.00 0.00 O ATOM 0 H GLY A 68 17.997 1.567 -0.939 1.00 0.00 H new ATOM 0 HA2 GLY A 68 18.746 3.448 0.035 1.00 0.00 H new ATOM 0 HA3 GLY A 68 19.544 3.912 -1.454 1.00 0.00 H new ATOM 1015 N LYS A 69 16.266 4.207 -1.221 1.00 0.00 N ATOM 1016 CA LYS A 69 15.162 5.140 -1.445 1.00 0.00 C ATOM 1017 C LYS A 69 13.920 4.746 -0.660 1.00 0.00 C ATOM 1018 O LYS A 69 13.536 3.574 -0.625 1.00 0.00 O ATOM 1019 CB LYS A 69 14.813 5.232 -2.937 1.00 0.00 C ATOM 1020 CG LYS A 69 15.633 6.263 -3.707 1.00 0.00 C ATOM 1021 CD LYS A 69 15.179 6.357 -5.158 1.00 0.00 C ATOM 1022 CE LYS A 69 15.845 7.513 -5.892 1.00 0.00 C ATOM 1023 NZ LYS A 69 15.296 7.684 -7.268 1.00 0.00 N ATOM 0 H LYS A 69 15.980 3.249 -1.020 1.00 0.00 H new ATOM 0 HA LYS A 69 15.499 6.115 -1.092 1.00 0.00 H new ATOM 0 HB2 LYS A 69 14.959 4.253 -3.394 1.00 0.00 H new ATOM 0 HB3 LYS A 69 13.756 5.477 -3.037 1.00 0.00 H new ATOM 0 HG2 LYS A 69 15.537 7.238 -3.229 1.00 0.00 H new ATOM 0 HG3 LYS A 69 16.688 5.993 -3.670 1.00 0.00 H new ATOM 0 HD2 LYS A 69 15.408 5.423 -5.670 1.00 0.00 H new ATOM 0 HD3 LYS A 69 14.097 6.482 -5.192 1.00 0.00 H new ATOM 0 HE2 LYS A 69 15.702 8.434 -5.326 1.00 0.00 H new ATOM 0 HE3 LYS A 69 16.919 7.337 -5.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 15.774 8.480 -7.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 15.455 6.814 -7.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 14.275 7.877 -7.213 1.00 0.00 H new ATOM 1037 N ALA A 70 13.294 5.740 -0.036 1.00 0.00 N ATOM 1038 CA ALA A 70 12.087 5.522 0.746 1.00 0.00 C ATOM 1039 C ALA A 70 10.846 5.646 -0.124 1.00 0.00 C ATOM 1040 O ALA A 70 10.704 6.606 -0.886 1.00 0.00 O ATOM 1041 CB ALA A 70 12.002 6.512 1.895 1.00 0.00 C ATOM 0 H ALA A 70 13.608 6.710 -0.059 1.00 0.00 H new ATOM 0 HA ALA A 70 12.135 4.511 1.150 1.00 0.00 H new ATOM 0 HB1 ALA A 70 11.091 6.330 2.466 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.868 6.390 2.545 1.00 0.00 H new ATOM 0 HB3 ALA A 70 11.985 7.528 1.500 1.00 0.00 H new ATOM 1047 N LEU A 71 9.952 4.676 -0.002 1.00 0.00 N ATOM 1048 CA LEU A 71 8.711 4.670 -0.764 1.00 0.00 C ATOM 1049 C LEU A 71 7.596 5.354 0.020 1.00 0.00 C ATOM 1050 O LEU A 71 7.142 4.840 1.045 1.00 0.00 O ATOM 1051 CB LEU A 71 8.294 3.232 -1.107 1.00 0.00 C ATOM 1052 CG LEU A 71 6.962 3.101 -1.859 1.00 0.00 C ATOM 1053 CD1 LEU A 71 7.059 3.726 -3.240 1.00 0.00 C ATOM 1054 CD2 LEU A 71 6.536 1.643 -1.958 1.00 0.00 C ATOM 0 H LEU A 71 10.064 3.877 0.622 1.00 0.00 H new ATOM 0 HA LEU A 71 8.882 5.220 -1.690 1.00 0.00 H new ATOM 0 HB2 LEU A 71 9.080 2.777 -1.710 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.229 2.659 -0.182 1.00 0.00 H new ATOM 0 HG LEU A 71 6.201 3.639 -1.294 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.104 3.621 -3.755 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.306 4.783 -3.144 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.837 3.222 -3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 71 5.590 1.576 -2.495 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.298 1.077 -2.494 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.415 1.231 -0.956 1.00 0.00 H new ATOM 1066 N LEU A 72 7.144 6.496 -0.481 1.00 0.00 N ATOM 1067 CA LEU A 72 6.058 7.234 0.153 1.00 0.00 C ATOM 1068 C LEU A 72 4.729 6.725 -0.388 1.00 0.00 C ATOM 1069 O LEU A 72 4.572 6.563 -1.598 1.00 0.00 O ATOM 1070 CB LEU A 72 6.176 8.750 -0.091 1.00 0.00 C ATOM 1071 CG LEU A 72 7.328 9.481 0.626 1.00 0.00 C ATOM 1072 CD1 LEU A 72 7.306 9.208 2.125 1.00 0.00 C ATOM 1073 CD2 LEU A 72 8.677 9.109 0.025 1.00 0.00 C ATOM 0 H LEU A 72 7.513 6.933 -1.326 1.00 0.00 H new ATOM 0 HA LEU A 72 6.116 7.071 1.229 1.00 0.00 H new ATOM 0 HB2 LEU A 72 6.284 8.914 -1.163 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.238 9.217 0.210 1.00 0.00 H new ATOM 0 HG LEU A 72 7.180 10.551 0.478 1.00 0.00 H new ATOM 0 HD11 LEU A 72 8.130 9.737 2.603 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.361 9.554 2.544 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.411 8.137 2.301 1.00 0.00 H new ATOM 0 HD21 LEU A 72 9.469 9.641 0.552 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.835 8.035 0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.694 9.385 -1.029 1.00 0.00 H new ATOM 1085 N TYR A 73 3.786 6.460 0.502 1.00 0.00 N ATOM 1086 CA TYR A 73 2.481 5.951 0.095 1.00 0.00 C ATOM 1087 C TYR A 73 1.377 6.573 0.943 1.00 0.00 C ATOM 1088 O TYR A 73 1.618 7.014 2.064 1.00 0.00 O ATOM 1089 CB TYR A 73 2.441 4.424 0.226 1.00 0.00 C ATOM 1090 CG TYR A 73 1.517 3.735 -0.757 1.00 0.00 C ATOM 1091 CD1 TYR A 73 1.635 3.957 -2.123 1.00 0.00 C ATOM 1092 CD2 TYR A 73 0.542 2.846 -0.319 1.00 0.00 C ATOM 1093 CE1 TYR A 73 0.807 3.319 -3.024 1.00 0.00 C ATOM 1094 CE2 TYR A 73 -0.289 2.200 -1.215 1.00 0.00 C ATOM 1095 CZ TYR A 73 -0.153 2.441 -2.565 1.00 0.00 C ATOM 1096 OH TYR A 73 -0.976 1.799 -3.459 1.00 0.00 O ATOM 0 H TYR A 73 3.897 6.587 1.508 1.00 0.00 H new ATOM 0 HA TYR A 73 2.317 6.222 -0.948 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.450 4.034 0.092 1.00 0.00 H new ATOM 0 HB3 TYR A 73 2.131 4.166 1.239 1.00 0.00 H new ATOM 0 HD1 TYR A 73 2.388 4.641 -2.486 1.00 0.00 H new ATOM 0 HD2 TYR A 73 0.432 2.657 0.739 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.910 3.506 -4.083 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -1.040 1.511 -0.859 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.595 1.215 -2.973 1.00 0.00 H new ATOM 1106 N ASN A 74 0.168 6.606 0.397 1.00 0.00 N ATOM 1107 CA ASN A 74 -0.983 7.177 1.092 1.00 0.00 C ATOM 1108 C ASN A 74 -2.277 6.565 0.577 1.00 0.00 C ATOM 1109 O ASN A 74 -2.338 6.104 -0.564 1.00 0.00 O ATOM 1110 CB ASN A 74 -1.001 8.717 0.958 1.00 0.00 C ATOM 1111 CG ASN A 74 -0.963 9.253 -0.480 1.00 0.00 C ATOM 1112 OD1 ASN A 74 -0.792 10.453 -0.686 1.00 0.00 O ATOM 1113 ND2 ASN A 74 -1.138 8.389 -1.470 1.00 0.00 N ATOM 0 H ASN A 74 -0.044 6.242 -0.532 1.00 0.00 H new ATOM 0 HA ASN A 74 -0.896 6.938 2.152 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -1.899 9.097 1.446 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -0.147 9.122 1.501 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -1.133 8.714 -2.437 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.277 7.400 -1.265 1.00 0.00 H new ATOM 1120 N GLY A 75 -3.297 6.547 1.423 1.00 0.00 N ATOM 1121 CA GLY A 75 -4.574 5.975 1.040 1.00 0.00 C ATOM 1122 C GLY A 75 -5.724 6.531 1.857 1.00 0.00 C ATOM 1123 O GLY A 75 -5.570 6.787 3.053 1.00 0.00 O ATOM 0 H GLY A 75 -3.264 6.920 2.372 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.755 6.171 -0.017 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -4.535 4.892 1.162 1.00 0.00 H new ATOM 1127 N GLN A 76 -6.870 6.721 1.209 1.00 0.00 N ATOM 1128 CA GLN A 76 -8.064 7.255 1.862 1.00 0.00 C ATOM 1129 C GLN A 76 -9.281 6.425 1.461 1.00 0.00 C ATOM 1130 O GLN A 76 -9.226 5.673 0.488 1.00 0.00 O ATOM 1131 CB GLN A 76 -8.291 8.727 1.472 1.00 0.00 C ATOM 1132 CG GLN A 76 -7.067 9.618 1.656 1.00 0.00 C ATOM 1133 CD GLN A 76 -7.366 11.095 1.454 1.00 0.00 C ATOM 1134 OE1 GLN A 76 -7.845 11.778 2.365 1.00 0.00 O ATOM 1135 NE2 GLN A 76 -7.103 11.598 0.257 1.00 0.00 N ATOM 0 H GLN A 76 -6.998 6.510 0.219 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.921 7.202 2.941 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -8.605 8.771 0.429 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -9.111 9.127 2.069 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -6.664 9.469 2.658 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.293 9.311 0.953 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -6.707 11.003 -0.471 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -7.296 12.581 0.063 1.00 0.00 H new ATOM 1144 N LYS A 77 -10.378 6.555 2.207 1.00 0.00 N ATOM 1145 CA LYS A 77 -11.594 5.806 1.901 1.00 0.00 C ATOM 1146 C LYS A 77 -12.440 6.565 0.872 1.00 0.00 C ATOM 1147 O LYS A 77 -12.744 7.744 1.058 1.00 0.00 O ATOM 1148 CB LYS A 77 -12.391 5.519 3.190 1.00 0.00 C ATOM 1149 CG LYS A 77 -12.966 6.745 3.895 1.00 0.00 C ATOM 1150 CD LYS A 77 -14.422 6.971 3.509 1.00 0.00 C ATOM 1151 CE LYS A 77 -15.018 8.180 4.216 1.00 0.00 C ATOM 1152 NZ LYS A 77 -16.433 8.419 3.813 1.00 0.00 N ATOM 0 H LYS A 77 -10.449 7.167 3.020 1.00 0.00 H new ATOM 0 HA LYS A 77 -11.318 4.846 1.464 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -13.211 4.844 2.946 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -11.741 4.992 3.888 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -12.889 6.616 4.975 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -12.378 7.625 3.636 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -14.494 7.110 2.430 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -15.004 6.083 3.755 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -14.968 8.031 5.295 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -14.422 9.064 3.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -16.802 9.251 4.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -16.478 8.587 2.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -17.008 7.586 4.053 1.00 0.00 H new ATOM 1249 N THR A 84 -16.278 2.567 5.697 1.00 0.00 N ATOM 1250 CA THR A 84 -15.072 1.801 5.414 1.00 0.00 C ATOM 1251 C THR A 84 -13.826 2.643 5.644 1.00 0.00 C ATOM 1252 O THR A 84 -13.812 3.830 5.321 1.00 0.00 O ATOM 1253 CB THR A 84 -15.056 1.298 3.957 1.00 0.00 C ATOM 1254 OG1 THR A 84 -15.349 2.383 3.068 1.00 0.00 O ATOM 1255 CG2 THR A 84 -16.065 0.175 3.755 1.00 0.00 C ATOM 0 HA THR A 84 -15.074 0.948 6.093 1.00 0.00 H new ATOM 0 HB THR A 84 -14.063 0.906 3.739 1.00 0.00 H new ATOM 0 HG1 THR A 84 -16.005 2.980 3.485 1.00 0.00 H new ATOM 0 HG21 THR A 84 -16.033 -0.161 2.719 1.00 0.00 H new ATOM 0 HG22 THR A 84 -15.820 -0.658 4.414 1.00 0.00 H new ATOM 0 HG23 THR A 84 -17.066 0.539 3.987 1.00 0.00 H new ATOM 1263 N GLY A 85 -12.787 2.024 6.192 1.00 0.00 N ATOM 1264 CA GLY A 85 -11.543 2.730 6.439 1.00 0.00 C ATOM 1265 C GLY A 85 -10.564 2.547 5.296 1.00 0.00 C ATOM 1266 O GLY A 85 -10.886 2.849 4.149 1.00 0.00 O ATOM 0 H GLY A 85 -12.784 1.043 6.471 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -11.747 3.792 6.578 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -11.095 2.368 7.364 1.00 0.00 H new ATOM 1270 N ALA A 86 -9.376 2.039 5.597 1.00 0.00 N ATOM 1271 CA ALA A 86 -8.366 1.807 4.569 1.00 0.00 C ATOM 1272 C ALA A 86 -7.635 0.489 4.816 1.00 0.00 C ATOM 1273 O ALA A 86 -6.847 0.362 5.748 1.00 0.00 O ATOM 1274 CB ALA A 86 -7.380 2.968 4.511 1.00 0.00 C ATOM 0 H ALA A 86 -9.087 1.780 6.540 1.00 0.00 H new ATOM 0 HA ALA A 86 -8.871 1.740 3.605 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.636 2.775 3.738 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.915 3.888 4.277 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.883 3.072 5.476 1.00 0.00 H new ATOM 1280 N VAL A 87 -7.915 -0.487 3.960 1.00 0.00 N ATOM 1281 CA VAL A 87 -7.316 -1.821 4.038 1.00 0.00 C ATOM 1282 C VAL A 87 -6.936 -2.264 2.629 1.00 0.00 C ATOM 1283 O VAL A 87 -7.730 -2.104 1.700 1.00 0.00 O ATOM 1284 CB VAL A 87 -8.308 -2.855 4.646 1.00 0.00 C ATOM 1285 CG1 VAL A 87 -7.670 -4.228 4.777 1.00 0.00 C ATOM 1286 CG2 VAL A 87 -8.833 -2.388 6.001 1.00 0.00 C ATOM 0 H VAL A 87 -8.569 -0.377 3.185 1.00 0.00 H new ATOM 0 HA VAL A 87 -6.439 -1.773 4.683 1.00 0.00 H new ATOM 0 HB VAL A 87 -9.150 -2.934 3.958 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -8.391 -4.925 5.205 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -7.363 -4.582 3.793 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -6.798 -4.163 5.427 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -9.523 -3.131 6.400 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -7.998 -2.261 6.691 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -9.353 -1.437 5.882 1.00 0.00 H new ATOM 1296 N GLY A 88 -5.735 -2.796 2.458 1.00 0.00 N ATOM 1297 CA GLY A 88 -5.301 -3.219 1.141 1.00 0.00 C ATOM 1298 C GLY A 88 -3.921 -3.837 1.146 1.00 0.00 C ATOM 1299 O GLY A 88 -3.153 -3.656 2.096 1.00 0.00 O ATOM 0 H GLY A 88 -5.055 -2.942 3.204 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -6.015 -3.940 0.743 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -5.307 -2.361 0.469 1.00 0.00 H new ATOM 1303 N VAL A 89 -3.616 -4.569 0.084 1.00 0.00 N ATOM 1304 CA VAL A 89 -2.324 -5.238 -0.069 1.00 0.00 C ATOM 1305 C VAL A 89 -1.635 -4.793 -1.361 1.00 0.00 C ATOM 1306 O VAL A 89 -2.250 -4.767 -2.431 1.00 0.00 O ATOM 1307 CB VAL A 89 -2.474 -6.784 -0.091 1.00 0.00 C ATOM 1308 CG1 VAL A 89 -1.122 -7.474 -0.194 1.00 0.00 C ATOM 1309 CG2 VAL A 89 -3.217 -7.272 1.141 1.00 0.00 C ATOM 0 H VAL A 89 -4.254 -4.718 -0.698 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.719 -4.956 0.792 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.054 -7.042 -0.977 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.265 -8.555 -0.207 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -0.624 -7.163 -1.112 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.507 -7.200 0.663 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -3.310 -8.357 1.104 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -2.665 -6.986 2.036 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.210 -6.823 1.168 1.00 0.00 H new ATOM 1319 N LEU A 90 -0.352 -4.466 -1.253 1.00 0.00 N ATOM 1320 CA LEU A 90 0.439 -4.048 -2.403 1.00 0.00 C ATOM 1321 C LEU A 90 1.390 -5.172 -2.802 1.00 0.00 C ATOM 1322 O LEU A 90 1.979 -5.822 -1.937 1.00 0.00 O ATOM 1323 CB LEU A 90 1.217 -2.747 -2.110 1.00 0.00 C ATOM 1324 CG LEU A 90 2.041 -2.719 -0.811 1.00 0.00 C ATOM 1325 CD1 LEU A 90 3.189 -1.728 -0.932 1.00 0.00 C ATOM 1326 CD2 LEU A 90 1.165 -2.342 0.377 1.00 0.00 C ATOM 0 H LEU A 90 0.165 -4.483 -0.374 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.237 -3.839 -3.232 1.00 0.00 H new ATOM 0 HB2 LEU A 90 1.890 -2.556 -2.946 1.00 0.00 H new ATOM 0 HB3 LEU A 90 0.505 -1.923 -2.080 1.00 0.00 H new ATOM 0 HG LEU A 90 2.445 -3.718 -0.648 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.762 -1.720 -0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.838 -2.022 -1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.791 -0.731 -1.121 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.769 -2.329 1.284 1.00 0.00 H new ATOM 0 HD22 LEU A 90 0.735 -1.354 0.213 1.00 0.00 H new ATOM 0 HD23 LEU A 90 0.364 -3.073 0.485 1.00 0.00 H new ATOM 1338 N ALA A 91 1.523 -5.414 -4.101 1.00 0.00 N ATOM 1339 CA ALA A 91 2.387 -6.470 -4.596 1.00 0.00 C ATOM 1340 C ALA A 91 3.302 -5.952 -5.702 1.00 0.00 C ATOM 1341 O ALA A 91 2.840 -5.538 -6.770 1.00 0.00 O ATOM 1342 CB ALA A 91 1.545 -7.638 -5.096 1.00 0.00 C ATOM 0 H ALA A 91 1.040 -4.889 -4.830 1.00 0.00 H new ATOM 0 HA ALA A 91 3.018 -6.816 -3.777 1.00 0.00 H new ATOM 0 HB1 ALA A 91 2.200 -8.427 -5.466 1.00 0.00 H new ATOM 0 HB2 ALA A 91 0.937 -8.025 -4.278 1.00 0.00 H new ATOM 0 HB3 ALA A 91 0.894 -7.299 -5.902 1.00 0.00 H new ATOM 1348 N TYR A 92 4.599 -5.983 -5.431 1.00 0.00 N ATOM 1349 CA TYR A 92 5.606 -5.525 -6.383 1.00 0.00 C ATOM 1350 C TYR A 92 6.513 -6.679 -6.794 1.00 0.00 C ATOM 1351 O TYR A 92 7.054 -7.384 -5.938 1.00 0.00 O ATOM 1352 CB TYR A 92 6.494 -4.426 -5.777 1.00 0.00 C ATOM 1353 CG TYR A 92 5.795 -3.135 -5.388 1.00 0.00 C ATOM 1354 CD1 TYR A 92 4.712 -3.130 -4.518 1.00 0.00 C ATOM 1355 CD2 TYR A 92 6.251 -1.914 -5.870 1.00 0.00 C ATOM 1356 CE1 TYR A 92 4.102 -1.949 -4.146 1.00 0.00 C ATOM 1357 CE2 TYR A 92 5.651 -0.728 -5.496 1.00 0.00 C ATOM 1358 CZ TYR A 92 4.575 -0.751 -4.634 1.00 0.00 C ATOM 1359 OH TYR A 92 3.974 0.426 -4.254 1.00 0.00 O ATOM 0 H TYR A 92 4.984 -6.324 -4.550 1.00 0.00 H new ATOM 0 HA TYR A 92 5.070 -5.130 -7.246 1.00 0.00 H new ATOM 0 HB2 TYR A 92 6.983 -4.831 -4.891 1.00 0.00 H new ATOM 0 HB3 TYR A 92 7.280 -4.187 -6.494 1.00 0.00 H new ATOM 0 HD1 TYR A 92 4.341 -4.066 -4.126 1.00 0.00 H new ATOM 0 HD2 TYR A 92 7.090 -1.892 -6.550 1.00 0.00 H new ATOM 0 HE1 TYR A 92 3.256 -1.964 -3.474 1.00 0.00 H new ATOM 0 HE2 TYR A 92 6.022 0.212 -5.876 1.00 0.00 H new ATOM 0 HH TYR A 92 3.890 0.450 -3.278 1.00 0.00 H new ATOM 1369 N LEU A 93 6.723 -6.827 -8.090 1.00 0.00 N ATOM 1370 CA LEU A 93 7.620 -7.857 -8.606 1.00 0.00 C ATOM 1371 C LEU A 93 9.048 -7.329 -8.456 1.00 0.00 C ATOM 1372 O LEU A 93 9.329 -6.202 -8.846 1.00 0.00 O ATOM 1373 CB LEU A 93 7.296 -8.157 -10.080 1.00 0.00 C ATOM 1374 CG LEU A 93 7.681 -9.557 -10.599 1.00 0.00 C ATOM 1375 CD1 LEU A 93 9.181 -9.790 -10.512 1.00 0.00 C ATOM 1376 CD2 LEU A 93 6.935 -10.641 -9.834 1.00 0.00 C ATOM 0 H LEU A 93 6.286 -6.249 -8.808 1.00 0.00 H new ATOM 0 HA LEU A 93 7.502 -8.789 -8.054 1.00 0.00 H new ATOM 0 HB2 LEU A 93 6.225 -8.021 -10.228 1.00 0.00 H new ATOM 0 HB3 LEU A 93 7.800 -7.414 -10.698 1.00 0.00 H new ATOM 0 HG LEU A 93 7.392 -9.607 -11.649 1.00 0.00 H new ATOM 0 HD11 LEU A 93 9.417 -10.786 -10.886 1.00 0.00 H new ATOM 0 HD12 LEU A 93 9.701 -9.044 -11.114 1.00 0.00 H new ATOM 0 HD13 LEU A 93 9.503 -9.707 -9.474 1.00 0.00 H new ATOM 0 HD21 LEU A 93 7.222 -11.620 -10.217 1.00 0.00 H new ATOM 0 HD22 LEU A 93 7.186 -10.578 -8.775 1.00 0.00 H new ATOM 0 HD23 LEU A 93 5.861 -10.503 -9.961 1.00 0.00 H new ATOM 1388 N MET A 94 9.934 -8.113 -7.857 1.00 0.00 N ATOM 1389 CA MET A 94 11.303 -7.655 -7.639 1.00 0.00 C ATOM 1390 C MET A 94 12.178 -7.861 -8.879 1.00 0.00 C ATOM 1391 O MET A 94 12.568 -6.889 -9.532 1.00 0.00 O ATOM 1392 CB MET A 94 11.890 -8.348 -6.404 1.00 0.00 C ATOM 1393 CG MET A 94 13.240 -7.809 -5.957 1.00 0.00 C ATOM 1394 SD MET A 94 13.789 -8.545 -4.401 1.00 0.00 S ATOM 1395 CE MET A 94 12.353 -8.257 -3.365 1.00 0.00 C ATOM 0 H MET A 94 9.736 -9.054 -7.518 1.00 0.00 H new ATOM 0 HA MET A 94 11.283 -6.581 -7.456 1.00 0.00 H new ATOM 0 HB2 MET A 94 11.184 -8.251 -5.579 1.00 0.00 H new ATOM 0 HB3 MET A 94 11.990 -9.413 -6.614 1.00 0.00 H new ATOM 0 HG2 MET A 94 13.982 -8.005 -6.731 1.00 0.00 H new ATOM 0 HG3 MET A 94 13.177 -6.727 -5.843 1.00 0.00 H new ATOM 0 HE1 MET A 94 12.564 -8.592 -2.349 1.00 0.00 H new ATOM 0 HE2 MET A 94 12.119 -7.192 -3.355 1.00 0.00 H new ATOM 0 HE3 MET A 94 11.502 -8.811 -3.761 1.00 0.00 H new ATOM 1405 N SER A 95 12.480 -9.114 -9.214 1.00 0.00 N ATOM 1406 CA SER A 95 13.307 -9.404 -10.382 1.00 0.00 C ATOM 1407 C SER A 95 13.300 -10.885 -10.731 1.00 0.00 C ATOM 1408 O SER A 95 13.104 -11.259 -11.885 1.00 0.00 O ATOM 1409 CB SER A 95 14.744 -8.926 -10.142 1.00 0.00 C ATOM 1410 OG SER A 95 15.226 -9.377 -8.887 1.00 0.00 O ATOM 0 H SER A 95 12.168 -9.937 -8.699 1.00 0.00 H new ATOM 0 HA SER A 95 12.881 -8.865 -11.228 1.00 0.00 H new ATOM 0 HB2 SER A 95 15.391 -9.294 -10.938 1.00 0.00 H new ATOM 0 HB3 SER A 95 14.780 -7.837 -10.180 1.00 0.00 H new ATOM 0 HG SER A 95 16.145 -9.061 -8.757 1.00 0.00 H new ATOM 1416 N ASP A 96 13.514 -11.723 -9.733 1.00 0.00 N ATOM 1417 CA ASP A 96 13.545 -13.170 -9.947 1.00 0.00 C ATOM 1418 C ASP A 96 12.158 -13.793 -9.800 1.00 0.00 C ATOM 1419 O ASP A 96 12.027 -14.943 -9.371 1.00 0.00 O ATOM 1420 CB ASP A 96 14.520 -13.844 -8.979 1.00 0.00 C ATOM 1421 CG ASP A 96 15.963 -13.482 -9.263 1.00 0.00 C ATOM 1422 OD1 ASP A 96 16.407 -13.662 -10.413 1.00 0.00 O ATOM 1423 OD2 ASP A 96 16.656 -13.028 -8.329 1.00 0.00 O ATOM 0 H ASP A 96 13.669 -11.434 -8.767 1.00 0.00 H new ATOM 0 HA ASP A 96 13.886 -13.334 -10.969 1.00 0.00 H new ATOM 0 HB2 ASP A 96 14.271 -13.556 -7.958 1.00 0.00 H new ATOM 0 HB3 ASP A 96 14.401 -14.926 -9.043 1.00 0.00 H new ATOM 1428 N GLY A 97 11.123 -13.037 -10.168 1.00 0.00 N ATOM 1429 CA GLY A 97 9.768 -13.546 -10.074 1.00 0.00 C ATOM 1430 C GLY A 97 9.324 -13.700 -8.636 1.00 0.00 C ATOM 1431 O GLY A 97 8.696 -14.695 -8.272 1.00 0.00 O ATOM 0 H GLY A 97 11.201 -12.086 -10.528 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.089 -12.870 -10.594 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.706 -14.510 -10.579 1.00 0.00 H new ATOM 1435 N ASN A 98 9.649 -12.707 -7.824 1.00 0.00 N ATOM 1436 CA ASN A 98 9.288 -12.713 -6.420 1.00 0.00 C ATOM 1437 C ASN A 98 8.484 -11.473 -6.103 1.00 0.00 C ATOM 1438 O ASN A 98 8.845 -10.364 -6.503 1.00 0.00 O ATOM 1439 CB ASN A 98 10.533 -12.818 -5.524 1.00 0.00 C ATOM 1440 CG ASN A 98 11.585 -11.759 -5.802 1.00 0.00 C ATOM 1441 OD1 ASN A 98 11.971 -11.521 -6.948 1.00 0.00 O ATOM 1442 ND2 ASN A 98 12.077 -11.134 -4.744 1.00 0.00 N ATOM 0 H ASN A 98 10.167 -11.880 -8.119 1.00 0.00 H new ATOM 0 HA ASN A 98 8.676 -13.591 -6.216 1.00 0.00 H new ATOM 0 HB2 ASN A 98 10.225 -12.744 -4.481 1.00 0.00 H new ATOM 0 HB3 ASN A 98 10.980 -13.803 -5.655 1.00 0.00 H new ATOM 0 HD21 ASN A 98 12.802 -10.427 -4.861 1.00 0.00 H new ATOM 0 HD22 ASN A 98 11.731 -11.360 -3.812 1.00 0.00 H new ATOM 1449 N THR A 99 7.375 -11.672 -5.423 1.00 0.00 N ATOM 1450 CA THR A 99 6.488 -10.577 -5.094 1.00 0.00 C ATOM 1451 C THR A 99 6.459 -10.297 -3.597 1.00 0.00 C ATOM 1452 O THR A 99 6.017 -11.131 -2.812 1.00 0.00 O ATOM 1453 CB THR A 99 5.056 -10.894 -5.564 1.00 0.00 C ATOM 1454 OG1 THR A 99 5.089 -11.506 -6.859 1.00 0.00 O ATOM 1455 CG2 THR A 99 4.211 -9.635 -5.625 1.00 0.00 C ATOM 0 H THR A 99 7.066 -12.584 -5.087 1.00 0.00 H new ATOM 0 HA THR A 99 6.869 -9.693 -5.605 1.00 0.00 H new ATOM 0 HB THR A 99 4.610 -11.580 -4.844 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.175 -11.706 -7.150 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.205 -9.888 -5.960 1.00 0.00 H new ATOM 0 HG22 THR A 99 4.161 -9.182 -4.635 1.00 0.00 H new ATOM 0 HG23 THR A 99 4.659 -8.929 -6.324 1.00 0.00 H new ATOM 1463 N LEU A 100 6.891 -9.104 -3.213 1.00 0.00 N ATOM 1464 CA LEU A 100 6.870 -8.708 -1.812 1.00 0.00 C ATOM 1465 C LEU A 100 5.517 -8.058 -1.511 1.00 0.00 C ATOM 1466 O LEU A 100 5.254 -6.928 -1.926 1.00 0.00 O ATOM 1467 CB LEU A 100 8.028 -7.741 -1.509 1.00 0.00 C ATOM 1468 CG LEU A 100 8.507 -7.706 -0.052 1.00 0.00 C ATOM 1469 CD1 LEU A 100 9.913 -7.141 0.018 1.00 0.00 C ATOM 1470 CD2 LEU A 100 7.578 -6.875 0.822 1.00 0.00 C ATOM 0 H LEU A 100 7.259 -8.396 -3.849 1.00 0.00 H new ATOM 0 HA LEU A 100 7.001 -9.583 -1.175 1.00 0.00 H new ATOM 0 HB2 LEU A 100 8.874 -8.007 -2.143 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.720 -6.735 -1.794 1.00 0.00 H new ATOM 0 HG LEU A 100 8.502 -8.729 0.324 1.00 0.00 H new ATOM 0 HD11 LEU A 100 10.245 -7.120 1.056 1.00 0.00 H new ATOM 0 HD12 LEU A 100 10.587 -7.768 -0.566 1.00 0.00 H new ATOM 0 HD13 LEU A 100 9.919 -6.129 -0.386 1.00 0.00 H new ATOM 0 HD21 LEU A 100 7.948 -6.873 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.543 -5.852 0.446 1.00 0.00 H new ATOM 0 HD23 LEU A 100 6.576 -7.304 0.799 1.00 0.00 H new ATOM 1482 N ALA A 101 4.659 -8.794 -0.817 1.00 0.00 N ATOM 1483 CA ALA A 101 3.323 -8.312 -0.476 1.00 0.00 C ATOM 1484 C ALA A 101 3.299 -7.694 0.913 1.00 0.00 C ATOM 1485 O ALA A 101 3.886 -8.232 1.856 1.00 0.00 O ATOM 1486 CB ALA A 101 2.318 -9.447 -0.573 1.00 0.00 C ATOM 0 H ALA A 101 4.864 -9.733 -0.476 1.00 0.00 H new ATOM 0 HA ALA A 101 3.048 -7.535 -1.190 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.325 -9.077 -0.317 1.00 0.00 H new ATOM 0 HB2 ALA A 101 2.308 -9.838 -1.590 1.00 0.00 H new ATOM 0 HB3 ALA A 101 2.599 -10.242 0.118 1.00 0.00 H new ATOM 1492 N VAL A 102 2.617 -6.564 1.024 1.00 0.00 N ATOM 1493 CA VAL A 102 2.495 -5.851 2.287 1.00 0.00 C ATOM 1494 C VAL A 102 1.023 -5.575 2.572 1.00 0.00 C ATOM 1495 O VAL A 102 0.313 -5.026 1.731 1.00 0.00 O ATOM 1496 CB VAL A 102 3.267 -4.510 2.267 1.00 0.00 C ATOM 1497 CG1 VAL A 102 3.331 -3.900 3.661 1.00 0.00 C ATOM 1498 CG2 VAL A 102 4.669 -4.683 1.699 1.00 0.00 C ATOM 0 H VAL A 102 2.134 -6.117 0.245 1.00 0.00 H new ATOM 0 HA VAL A 102 2.926 -6.478 3.067 1.00 0.00 H new ATOM 0 HB VAL A 102 2.722 -3.828 1.614 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.878 -2.958 3.621 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.320 -3.717 4.025 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.841 -4.588 4.336 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.183 -3.722 1.700 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.225 -5.392 2.312 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.604 -5.059 0.678 1.00 0.00 H new ATOM 1508 N LEU A 103 0.565 -5.970 3.749 1.00 0.00 N ATOM 1509 CA LEU A 103 -0.827 -5.772 4.133 1.00 0.00 C ATOM 1510 C LEU A 103 -0.984 -4.545 5.022 1.00 0.00 C ATOM 1511 O LEU A 103 -0.123 -4.258 5.853 1.00 0.00 O ATOM 1512 CB LEU A 103 -1.381 -7.003 4.863 1.00 0.00 C ATOM 1513 CG LEU A 103 -1.505 -8.291 4.032 1.00 0.00 C ATOM 1514 CD1 LEU A 103 -0.145 -8.937 3.803 1.00 0.00 C ATOM 1515 CD2 LEU A 103 -2.448 -9.271 4.714 1.00 0.00 C ATOM 0 H LEU A 103 1.136 -6.431 4.457 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.394 -5.619 3.215 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.740 -7.209 5.720 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.367 -6.753 5.255 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.916 -8.023 3.059 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.268 -9.845 3.213 1.00 0.00 H new ATOM 0 HD12 LEU A 103 0.503 -8.242 3.269 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.305 -9.187 4.764 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.526 -10.178 4.114 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.061 -9.521 5.702 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.434 -8.817 4.815 1.00 0.00 H new ATOM 1527 N PHE A 104 -2.107 -3.855 4.845 1.00 0.00 N ATOM 1528 CA PHE A 104 -2.455 -2.664 5.621 1.00 0.00 C ATOM 1529 C PHE A 104 -3.930 -2.714 5.979 1.00 0.00 C ATOM 1530 O PHE A 104 -4.748 -3.147 5.167 1.00 0.00 O ATOM 1531 CB PHE A 104 -2.192 -1.371 4.841 1.00 0.00 C ATOM 1532 CG PHE A 104 -0.748 -0.991 4.707 1.00 0.00 C ATOM 1533 CD1 PHE A 104 0.047 -1.552 3.724 1.00 0.00 C ATOM 1534 CD2 PHE A 104 -0.193 -0.046 5.555 1.00 0.00 C ATOM 1535 CE1 PHE A 104 1.370 -1.183 3.593 1.00 0.00 C ATOM 1536 CE2 PHE A 104 1.128 0.327 5.426 1.00 0.00 C ATOM 1537 CZ PHE A 104 1.911 -0.243 4.444 1.00 0.00 C ATOM 0 H PHE A 104 -2.810 -4.108 4.151 1.00 0.00 H new ATOM 0 HA PHE A 104 -1.830 -2.660 6.514 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -2.619 -1.474 3.843 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -2.722 -0.555 5.332 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -0.372 -2.286 3.052 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -0.802 0.403 6.326 1.00 0.00 H new ATOM 0 HE1 PHE A 104 1.982 -1.631 2.824 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.549 1.065 6.093 1.00 0.00 H new ATOM 0 HZ PHE A 104 2.946 0.047 4.342 1.00 0.00 H new ATOM 1547 N SER A 105 -4.263 -2.279 7.185 1.00 0.00 N ATOM 1548 CA SER A 105 -5.638 -2.280 7.648 1.00 0.00 C ATOM 1549 C SER A 105 -5.857 -1.142 8.640 1.00 0.00 C ATOM 1550 O SER A 105 -5.097 -0.992 9.595 1.00 0.00 O ATOM 1551 CB SER A 105 -5.953 -3.621 8.314 1.00 0.00 C ATOM 1552 OG SER A 105 -7.337 -3.752 8.605 1.00 0.00 O ATOM 0 H SER A 105 -3.592 -1.919 7.864 1.00 0.00 H new ATOM 0 HA SER A 105 -6.303 -2.136 6.796 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.640 -4.435 7.659 1.00 0.00 H new ATOM 0 HB3 SER A 105 -5.377 -3.714 9.235 1.00 0.00 H new ATOM 0 HG SER A 105 -7.627 -4.668 8.410 1.00 0.00 H new ATOM 1558 N VAL A 106 -6.894 -0.349 8.403 1.00 0.00 N ATOM 1559 CA VAL A 106 -7.235 0.783 9.267 1.00 0.00 C ATOM 1560 C VAL A 106 -8.754 0.923 9.361 1.00 0.00 C ATOM 1561 O VAL A 106 -9.435 1.038 8.339 1.00 0.00 O ATOM 1562 CB VAL A 106 -6.629 2.122 8.758 1.00 0.00 C ATOM 1563 CG1 VAL A 106 -7.168 3.314 9.545 1.00 0.00 C ATOM 1564 CG2 VAL A 106 -5.110 2.102 8.836 1.00 0.00 C ATOM 0 H VAL A 106 -7.524 -0.469 7.609 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.809 0.577 10.249 1.00 0.00 H new ATOM 0 HB VAL A 106 -6.927 2.231 7.715 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -6.724 4.233 9.163 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -8.251 3.362 9.436 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -6.914 3.199 10.599 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -4.715 3.051 8.474 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -4.801 1.951 9.870 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -4.725 1.289 8.220 1.00 0.00 H new ATOM 1574 N PRO A 107 -9.299 0.909 10.592 1.00 0.00 N ATOM 1575 CA PRO A 107 -10.736 1.027 10.843 1.00 0.00 C ATOM 1576 C PRO A 107 -11.232 2.470 10.805 1.00 0.00 C ATOM 1577 O PRO A 107 -10.548 3.388 11.263 1.00 0.00 O ATOM 1578 CB PRO A 107 -10.909 0.457 12.260 1.00 0.00 C ATOM 1579 CG PRO A 107 -9.542 0.048 12.721 1.00 0.00 C ATOM 1580 CD PRO A 107 -8.560 0.770 11.850 1.00 0.00 C ATOM 0 HA PRO A 107 -11.311 0.506 10.077 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -11.338 1.203 12.929 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -11.589 -0.395 12.256 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.393 0.307 13.769 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -9.412 -1.031 12.638 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -8.282 1.738 12.267 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -7.639 0.203 11.719 1.00 0.00 H new ATOM 1588 N TYR A 108 -12.433 2.659 10.273 1.00 0.00 N ATOM 1589 CA TYR A 108 -13.037 3.981 10.195 1.00 0.00 C ATOM 1590 C TYR A 108 -13.980 4.194 11.381 1.00 0.00 C ATOM 1591 O TYR A 108 -14.974 3.492 11.508 1.00 0.00 O ATOM 1592 CB TYR A 108 -13.797 4.141 8.871 1.00 0.00 C ATOM 1593 CG TYR A 108 -14.256 5.556 8.592 1.00 0.00 C ATOM 1594 CD1 TYR A 108 -13.371 6.626 8.676 1.00 0.00 C ATOM 1595 CD2 TYR A 108 -15.575 5.822 8.253 1.00 0.00 C ATOM 1596 CE1 TYR A 108 -13.789 7.921 8.435 1.00 0.00 C ATOM 1597 CE2 TYR A 108 -16.001 7.114 8.007 1.00 0.00 C ATOM 1598 CZ TYR A 108 -15.106 8.158 8.100 1.00 0.00 C ATOM 1599 OH TYR A 108 -15.533 9.445 7.864 1.00 0.00 O ATOM 0 H TYR A 108 -13.009 1.910 9.888 1.00 0.00 H new ATOM 0 HA TYR A 108 -12.249 4.733 10.233 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -13.156 3.810 8.054 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -14.666 3.483 8.881 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -12.339 6.441 8.934 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -16.280 5.007 8.180 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -13.090 8.741 8.508 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -17.031 7.304 7.743 1.00 0.00 H new ATOM 0 HH TYR A 108 -16.487 9.437 7.639 1.00 0.00 H new ATOM 1701 N SER A 114 -8.862 -2.862 14.927 1.00 0.00 N ATOM 1702 CA SER A 114 -7.510 -2.337 15.075 1.00 0.00 C ATOM 1703 C SER A 114 -6.742 -2.378 13.752 1.00 0.00 C ATOM 1704 O SER A 114 -7.133 -3.079 12.819 1.00 0.00 O ATOM 1705 CB SER A 114 -6.766 -3.118 16.163 1.00 0.00 C ATOM 1706 OG SER A 114 -6.998 -4.512 16.045 1.00 0.00 O ATOM 0 HA SER A 114 -7.580 -1.291 15.374 1.00 0.00 H new ATOM 0 HB2 SER A 114 -5.697 -2.918 16.091 1.00 0.00 H new ATOM 0 HB3 SER A 114 -7.089 -2.775 17.146 1.00 0.00 H new ATOM 0 HG SER A 114 -7.842 -4.664 15.571 1.00 0.00 H new ATOM 1712 N ASN A 115 -5.650 -1.613 13.683 1.00 0.00 N ATOM 1713 CA ASN A 115 -4.800 -1.548 12.488 1.00 0.00 C ATOM 1714 C ASN A 115 -3.995 -2.838 12.347 1.00 0.00 C ATOM 1715 O ASN A 115 -3.855 -3.578 13.315 1.00 0.00 O ATOM 1716 CB ASN A 115 -3.843 -0.355 12.595 1.00 0.00 C ATOM 1717 CG ASN A 115 -4.564 0.955 12.863 1.00 0.00 C ATOM 1718 OD1 ASN A 115 -5.305 1.464 12.024 1.00 0.00 O ATOM 1719 ND2 ASN A 115 -4.370 1.499 14.053 1.00 0.00 N ATOM 0 H ASN A 115 -5.329 -1.022 14.450 1.00 0.00 H new ATOM 0 HA ASN A 115 -5.435 -1.425 11.610 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -3.126 -0.540 13.395 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.273 -0.268 11.670 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -4.842 2.369 14.299 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -3.748 1.049 14.724 1.00 0.00 H new ATOM 1726 N TRP A 116 -3.479 -3.120 11.147 1.00 0.00 N ATOM 1727 CA TRP A 116 -2.696 -4.337 10.908 1.00 0.00 C ATOM 1728 C TRP A 116 -1.754 -4.151 9.715 1.00 0.00 C ATOM 1729 O TRP A 116 -2.162 -3.607 8.689 1.00 0.00 O ATOM 1730 CB TRP A 116 -3.625 -5.534 10.602 1.00 0.00 C ATOM 1731 CG TRP A 116 -4.423 -6.049 11.767 1.00 0.00 C ATOM 1732 CD1 TRP A 116 -3.936 -6.664 12.883 1.00 0.00 C ATOM 1733 CD2 TRP A 116 -5.852 -6.034 11.910 1.00 0.00 C ATOM 1734 NE1 TRP A 116 -4.966 -7.003 13.723 1.00 0.00 N ATOM 1735 CE2 TRP A 116 -6.151 -6.631 13.150 1.00 0.00 C ATOM 1736 CE3 TRP A 116 -6.909 -5.565 11.121 1.00 0.00 C ATOM 1737 CZ2 TRP A 116 -7.454 -6.773 13.615 1.00 0.00 C ATOM 1738 CZ3 TRP A 116 -8.204 -5.708 11.585 1.00 0.00 C ATOM 1739 CH2 TRP A 116 -8.465 -6.307 12.823 1.00 0.00 C ATOM 0 H TRP A 116 -3.589 -2.523 10.327 1.00 0.00 H new ATOM 0 HA TRP A 116 -2.119 -4.533 11.812 1.00 0.00 H new ATOM 0 HB2 TRP A 116 -4.316 -5.242 9.811 1.00 0.00 H new ATOM 0 HB3 TRP A 116 -3.019 -6.351 10.210 1.00 0.00 H new ATOM 0 HD1 TRP A 116 -2.891 -6.856 13.077 1.00 0.00 H new ATOM 0 HE1 TRP A 116 -4.865 -7.459 14.630 1.00 0.00 H new ATOM 0 HE3 TRP A 116 -6.716 -5.099 10.166 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 -7.660 -7.236 14.569 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 -9.027 -5.352 10.983 1.00 0.00 H new ATOM 0 HH2 TRP A 116 -9.487 -6.403 13.159 1.00 0.00 H new ATOM 1750 N TRP A 117 -0.510 -4.642 9.831 1.00 0.00 N ATOM 1751 CA TRP A 117 0.446 -4.555 8.719 1.00 0.00 C ATOM 1752 C TRP A 117 1.349 -5.788 8.725 1.00 0.00 C ATOM 1753 O TRP A 117 1.757 -6.253 9.790 1.00 0.00 O ATOM 1754 CB TRP A 117 1.271 -3.240 8.745 1.00 0.00 C ATOM 1755 CG TRP A 117 2.480 -3.229 9.648 1.00 0.00 C ATOM 1756 CD1 TRP A 117 2.566 -2.656 10.881 1.00 0.00 C ATOM 1757 CD2 TRP A 117 3.791 -3.750 9.365 1.00 0.00 C ATOM 1758 NE1 TRP A 117 3.822 -2.832 11.403 1.00 0.00 N ATOM 1759 CE2 TRP A 117 4.591 -3.494 10.490 1.00 0.00 C ATOM 1760 CE3 TRP A 117 4.363 -4.423 8.277 1.00 0.00 C ATOM 1761 CZ2 TRP A 117 5.921 -3.887 10.561 1.00 0.00 C ATOM 1762 CZ3 TRP A 117 5.685 -4.807 8.349 1.00 0.00 C ATOM 1763 CH2 TRP A 117 6.449 -4.539 9.483 1.00 0.00 C ATOM 0 H TRP A 117 -0.148 -5.096 10.670 1.00 0.00 H new ATOM 0 HA TRP A 117 -0.119 -4.532 7.787 1.00 0.00 H new ATOM 0 HB2 TRP A 117 1.600 -3.022 7.729 1.00 0.00 H new ATOM 0 HB3 TRP A 117 0.611 -2.427 9.047 1.00 0.00 H new ATOM 0 HD1 TRP A 117 1.759 -2.137 11.377 1.00 0.00 H new ATOM 0 HE1 TRP A 117 4.131 -2.519 12.323 1.00 0.00 H new ATOM 0 HE3 TRP A 117 3.777 -4.638 7.396 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 6.517 -3.684 11.438 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.135 -5.323 7.514 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.482 -4.854 9.510 1.00 0.00 H new ATOM 1774 N ASN A 118 1.637 -6.338 7.547 1.00 0.00 N ATOM 1775 CA ASN A 118 2.481 -7.534 7.456 1.00 0.00 C ATOM 1776 C ASN A 118 3.136 -7.657 6.080 1.00 0.00 C ATOM 1777 O ASN A 118 2.456 -7.644 5.053 1.00 0.00 O ATOM 1778 CB ASN A 118 1.654 -8.795 7.752 1.00 0.00 C ATOM 1779 CG ASN A 118 2.506 -10.048 7.881 1.00 0.00 C ATOM 1780 OD1 ASN A 118 3.229 -10.428 6.962 1.00 0.00 O ATOM 1781 ND2 ASN A 118 2.418 -10.702 9.026 1.00 0.00 N ATOM 0 H ASN A 118 1.305 -5.982 6.651 1.00 0.00 H new ATOM 0 HA ASN A 118 3.271 -7.435 8.200 1.00 0.00 H new ATOM 0 HB2 ASN A 118 1.094 -8.647 8.675 1.00 0.00 H new ATOM 0 HB3 ASN A 118 0.924 -8.939 6.956 1.00 0.00 H new ATOM 0 HD21 ASN A 118 2.961 -11.553 9.170 1.00 0.00 H new ATOM 0 HD22 ASN A 118 1.807 -10.356 9.766 1.00 0.00 H new ATOM 1788 N VAL A 119 4.460 -7.788 6.085 1.00 0.00 N ATOM 1789 CA VAL A 119 5.247 -7.941 4.861 1.00 0.00 C ATOM 1790 C VAL A 119 5.673 -9.401 4.656 1.00 0.00 C ATOM 1791 O VAL A 119 6.065 -10.075 5.616 1.00 0.00 O ATOM 1792 CB VAL A 119 6.506 -7.038 4.888 1.00 0.00 C ATOM 1793 CG1 VAL A 119 6.122 -5.578 4.732 1.00 0.00 C ATOM 1794 CG2 VAL A 119 7.283 -7.232 6.181 1.00 0.00 C ATOM 0 H VAL A 119 5.020 -7.791 6.938 1.00 0.00 H new ATOM 0 HA VAL A 119 4.610 -7.637 4.030 1.00 0.00 H new ATOM 0 HB VAL A 119 7.142 -7.327 4.051 1.00 0.00 H new ATOM 0 HG11 VAL A 119 7.020 -4.961 4.754 1.00 0.00 H new ATOM 0 HG12 VAL A 119 5.608 -5.437 3.781 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.462 -5.286 5.549 1.00 0.00 H new ATOM 0 HG21 VAL A 119 8.162 -6.588 6.177 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.648 -6.975 7.029 1.00 0.00 H new ATOM 0 HG23 VAL A 119 7.596 -8.273 6.265 1.00 0.00 H new ATOM 1804 N ARG A 120 5.616 -9.890 3.414 1.00 0.00 N ATOM 1805 CA ARG A 120 6.016 -11.271 3.121 1.00 0.00 C ATOM 1806 C ARG A 120 6.416 -11.445 1.653 1.00 0.00 C ATOM 1807 O ARG A 120 5.829 -10.831 0.763 1.00 0.00 O ATOM 1808 CB ARG A 120 4.891 -12.253 3.465 1.00 0.00 C ATOM 1809 CG ARG A 120 5.335 -13.711 3.446 1.00 0.00 C ATOM 1810 CD ARG A 120 4.199 -14.655 3.792 1.00 0.00 C ATOM 1811 NE ARG A 120 3.623 -14.351 5.098 1.00 0.00 N ATOM 1812 CZ ARG A 120 2.701 -15.093 5.701 1.00 0.00 C ATOM 1813 NH1 ARG A 120 2.285 -16.229 5.162 1.00 0.00 N ATOM 1814 NH2 ARG A 120 2.198 -14.695 6.854 1.00 0.00 N ATOM 0 H ARG A 120 5.301 -9.358 2.603 1.00 0.00 H new ATOM 0 HA ARG A 120 6.884 -11.488 3.743 1.00 0.00 H new ATOM 0 HB2 ARG A 120 4.499 -12.013 4.453 1.00 0.00 H new ATOM 0 HB3 ARG A 120 4.073 -12.120 2.756 1.00 0.00 H new ATOM 0 HG2 ARG A 120 5.724 -13.959 2.458 1.00 0.00 H new ATOM 0 HG3 ARG A 120 6.151 -13.851 4.155 1.00 0.00 H new ATOM 0 HD2 ARG A 120 3.424 -14.588 3.028 1.00 0.00 H new ATOM 0 HD3 ARG A 120 4.564 -15.682 3.786 1.00 0.00 H new ATOM 0 HE ARG A 120 3.950 -13.513 5.580 1.00 0.00 H new ATOM 0 HH11 ARG A 120 2.673 -16.544 4.273 1.00 0.00 H new ATOM 0 HH12 ARG A 120 1.576 -16.789 5.636 1.00 0.00 H new ATOM 0 HH21 ARG A 120 2.518 -13.823 7.276 1.00 0.00 H new ATOM 0 HH22 ARG A 120 1.490 -15.259 7.323 1.00 0.00 H new ATOM 1828 N ILE A 121 7.419 -12.293 1.418 1.00 0.00 N ATOM 1829 CA ILE A 121 7.911 -12.574 0.069 1.00 0.00 C ATOM 1830 C ILE A 121 7.114 -13.710 -0.577 1.00 0.00 C ATOM 1831 O ILE A 121 6.854 -14.736 0.052 1.00 0.00 O ATOM 1832 CB ILE A 121 9.412 -12.973 0.074 1.00 0.00 C ATOM 1833 CG1 ILE A 121 10.252 -11.992 0.909 1.00 0.00 C ATOM 1834 CG2 ILE A 121 9.949 -13.056 -1.353 1.00 0.00 C ATOM 1835 CD1 ILE A 121 10.243 -10.566 0.396 1.00 0.00 C ATOM 0 H ILE A 121 7.910 -12.801 2.153 1.00 0.00 H new ATOM 0 HA ILE A 121 7.786 -11.655 -0.504 1.00 0.00 H new ATOM 0 HB ILE A 121 9.492 -13.957 0.536 1.00 0.00 H new ATOM 0 HG12 ILE A 121 9.883 -11.999 1.935 1.00 0.00 H new ATOM 0 HG13 ILE A 121 11.282 -12.348 0.938 1.00 0.00 H new ATOM 0 HG21 ILE A 121 11.002 -13.337 -1.330 1.00 0.00 H new ATOM 0 HG22 ILE A 121 9.386 -13.805 -1.911 1.00 0.00 H new ATOM 0 HG23 ILE A 121 9.843 -12.086 -1.839 1.00 0.00 H new ATOM 0 HD11 ILE A 121 10.860 -9.943 1.043 1.00 0.00 H new ATOM 0 HD12 ILE A 121 10.641 -10.542 -0.618 1.00 0.00 H new ATOM 0 HD13 ILE A 121 9.221 -10.187 0.394 1.00 0.00 H new ATOM 1847 N TYR A 122 6.737 -13.519 -1.833 1.00 0.00 N ATOM 1848 CA TYR A 122 5.979 -14.517 -2.582 1.00 0.00 C ATOM 1849 C TYR A 122 6.685 -14.837 -3.895 1.00 0.00 C ATOM 1850 O TYR A 122 6.242 -14.437 -4.975 1.00 0.00 O ATOM 1851 CB TYR A 122 4.563 -14.029 -2.869 1.00 0.00 C ATOM 1852 CG TYR A 122 3.678 -13.912 -1.644 1.00 0.00 C ATOM 1853 CD1 TYR A 122 3.860 -12.891 -0.720 1.00 0.00 C ATOM 1854 CD2 TYR A 122 2.658 -14.828 -1.414 1.00 0.00 C ATOM 1855 CE1 TYR A 122 3.055 -12.786 0.397 1.00 0.00 C ATOM 1856 CE2 TYR A 122 1.848 -14.729 -0.298 1.00 0.00 C ATOM 1857 CZ TYR A 122 2.052 -13.709 0.605 1.00 0.00 C ATOM 1858 OH TYR A 122 1.252 -13.611 1.721 1.00 0.00 O ATOM 0 H TYR A 122 6.946 -12.672 -2.362 1.00 0.00 H new ATOM 0 HA TYR A 122 5.918 -15.419 -1.973 1.00 0.00 H new ATOM 0 HB2 TYR A 122 4.619 -13.055 -3.355 1.00 0.00 H new ATOM 0 HB3 TYR A 122 4.093 -14.712 -3.577 1.00 0.00 H new ATOM 0 HD1 TYR A 122 4.645 -12.166 -0.878 1.00 0.00 H new ATOM 0 HD2 TYR A 122 2.496 -15.630 -2.119 1.00 0.00 H new ATOM 0 HE1 TYR A 122 3.210 -11.985 1.104 1.00 0.00 H new ATOM 0 HE2 TYR A 122 1.059 -15.448 -0.135 1.00 0.00 H new ATOM 0 HH TYR A 122 1.172 -12.671 1.985 1.00 0.00 H new ATOM 1868 N LYS A 123 7.790 -15.549 -3.787 1.00 0.00 N ATOM 1869 CA LYS A 123 8.580 -15.936 -4.954 1.00 0.00 C ATOM 1870 C LYS A 123 7.893 -17.069 -5.717 1.00 0.00 C ATOM 1871 O LYS A 123 7.289 -17.958 -5.114 1.00 0.00 O ATOM 1872 CB LYS A 123 9.999 -16.358 -4.550 1.00 0.00 C ATOM 1873 CG LYS A 123 10.937 -16.531 -5.739 1.00 0.00 C ATOM 1874 CD LYS A 123 12.364 -16.816 -5.302 1.00 0.00 C ATOM 1875 CE LYS A 123 13.306 -16.900 -6.494 1.00 0.00 C ATOM 1876 NZ LYS A 123 14.720 -17.073 -6.068 1.00 0.00 N ATOM 0 H LYS A 123 8.168 -15.876 -2.898 1.00 0.00 H new ATOM 0 HA LYS A 123 8.656 -15.066 -5.606 1.00 0.00 H new ATOM 0 HB2 LYS A 123 10.414 -15.611 -3.874 1.00 0.00 H new ATOM 0 HB3 LYS A 123 9.948 -17.296 -3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 123 10.580 -17.348 -6.366 1.00 0.00 H new ATOM 0 HG3 LYS A 123 10.918 -15.628 -6.350 1.00 0.00 H new ATOM 0 HD2 LYS A 123 12.702 -16.032 -4.625 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.395 -17.753 -4.746 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.013 -17.735 -7.131 1.00 0.00 H new ATOM 0 HE3 LYS A 123 13.215 -15.994 -7.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 15.331 -17.126 -6.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.007 -16.264 -5.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.812 -17.950 -5.517 1.00 0.00 H new ATOM 1890 N GLY A 124 7.984 -17.025 -7.039 1.00 0.00 N ATOM 1891 CA GLY A 124 7.364 -18.043 -7.866 1.00 0.00 C ATOM 1892 C GLY A 124 6.096 -17.535 -8.521 1.00 0.00 C ATOM 1893 O GLY A 124 5.071 -18.222 -8.521 1.00 0.00 O ATOM 0 H GLY A 124 8.479 -16.299 -7.557 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.067 -18.366 -8.634 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.134 -18.917 -7.257 1.00 0.00 H new ATOM 1897 N LYS A 125 6.183 -16.309 -9.059 1.00 0.00 N ATOM 1898 CA LYS A 125 5.065 -15.614 -9.726 1.00 0.00 C ATOM 1899 C LYS A 125 3.782 -15.665 -8.879 1.00 0.00 C ATOM 1900 O LYS A 125 3.862 -15.757 -7.653 1.00 0.00 O ATOM 1901 CB LYS A 125 4.844 -16.121 -11.173 1.00 0.00 C ATOM 1902 CG LYS A 125 4.435 -17.583 -11.310 1.00 0.00 C ATOM 1903 CD LYS A 125 4.323 -17.991 -12.772 1.00 0.00 C ATOM 1904 CE LYS A 125 3.883 -19.439 -12.914 1.00 0.00 C ATOM 1905 NZ LYS A 125 4.873 -20.383 -12.327 1.00 0.00 N ATOM 0 H LYS A 125 7.044 -15.762 -9.044 1.00 0.00 H new ATOM 0 HA LYS A 125 5.342 -14.563 -9.813 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.077 -15.504 -11.641 1.00 0.00 H new ATOM 0 HB3 LYS A 125 5.764 -15.967 -11.736 1.00 0.00 H new ATOM 0 HG2 LYS A 125 5.167 -18.216 -10.809 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.479 -17.744 -10.811 1.00 0.00 H new ATOM 0 HD2 LYS A 125 3.609 -17.341 -13.278 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.285 -17.852 -13.264 1.00 0.00 H new ATOM 0 HE2 LYS A 125 2.919 -19.574 -12.424 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.741 -19.673 -13.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.623 -21.357 -12.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 5.822 -20.159 -12.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 4.866 -20.293 -11.291 1.00 0.00 H new ATOM 1919 N ARG A 126 2.610 -15.579 -9.531 1.00 0.00 N ATOM 1920 CA ARG A 126 1.311 -15.588 -8.835 1.00 0.00 C ATOM 1921 C ARG A 126 1.106 -14.291 -8.047 1.00 0.00 C ATOM 1922 O ARG A 126 2.027 -13.780 -7.412 1.00 0.00 O ATOM 1923 CB ARG A 126 1.174 -16.808 -7.907 1.00 0.00 C ATOM 1924 CG ARG A 126 1.070 -18.132 -8.650 1.00 0.00 C ATOM 1925 CD ARG A 126 -0.280 -18.287 -9.339 1.00 0.00 C ATOM 1926 NE ARG A 126 -0.367 -19.505 -10.153 1.00 0.00 N ATOM 1927 CZ ARG A 126 -0.377 -20.749 -9.662 1.00 0.00 C ATOM 1928 NH1 ARG A 126 -0.338 -20.960 -8.354 1.00 0.00 N ATOM 1929 NH2 ARG A 126 -0.448 -21.783 -10.488 1.00 0.00 N ATOM 0 H ARG A 126 2.535 -15.502 -10.545 1.00 0.00 H new ATOM 0 HA ARG A 126 0.534 -15.659 -9.596 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.034 -16.843 -7.238 1.00 0.00 H new ATOM 0 HB3 ARG A 126 0.290 -16.681 -7.283 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.866 -18.197 -9.391 1.00 0.00 H new ATOM 0 HG3 ARG A 126 1.218 -18.955 -7.950 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -1.068 -18.302 -8.586 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -0.461 -17.419 -9.972 1.00 0.00 H new ATOM 0 HE ARG A 126 -0.424 -19.395 -11.165 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.300 -20.169 -7.711 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -0.346 -21.913 -7.991 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -0.495 -21.629 -11.495 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -0.456 -22.733 -10.117 1.00 0.00 H new ATOM 1943 N ARG A 127 -0.102 -13.749 -8.107 1.00 0.00 N ATOM 1944 CA ARG A 127 -0.401 -12.507 -7.407 1.00 0.00 C ATOM 1945 C ARG A 127 -1.370 -12.741 -6.255 1.00 0.00 C ATOM 1946 O ARG A 127 -2.362 -13.460 -6.397 1.00 0.00 O ATOM 1947 CB ARG A 127 -0.956 -11.455 -8.376 1.00 0.00 C ATOM 1948 CG ARG A 127 -2.242 -11.862 -9.081 1.00 0.00 C ATOM 1949 CD ARG A 127 -2.758 -10.747 -9.978 1.00 0.00 C ATOM 1950 NE ARG A 127 -1.828 -10.434 -11.068 1.00 0.00 N ATOM 1951 CZ ARG A 127 -2.009 -9.439 -11.939 1.00 0.00 C ATOM 1952 NH1 ARG A 127 -3.040 -8.621 -11.812 1.00 0.00 N ATOM 1953 NH2 ARG A 127 -1.146 -9.259 -12.923 1.00 0.00 N ATOM 0 H ARG A 127 -0.885 -14.145 -8.628 1.00 0.00 H new ATOM 0 HA ARG A 127 0.532 -12.130 -6.988 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -1.135 -10.531 -7.826 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -0.198 -11.236 -9.128 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -2.065 -12.758 -9.676 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -3.000 -12.116 -8.340 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -3.721 -11.038 -10.397 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -2.928 -9.852 -9.380 1.00 0.00 H new ATOM 0 HE ARG A 127 -0.993 -11.011 -11.166 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -3.701 -8.749 -11.046 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -3.174 -7.862 -12.480 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -0.342 -9.880 -13.017 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -1.283 -8.499 -13.589 1.00 0.00 H new ATOM 1967 N ALA A 128 -1.075 -12.126 -5.116 1.00 0.00 N ATOM 1968 CA ALA A 128 -1.918 -12.256 -3.937 1.00 0.00 C ATOM 1969 C ALA A 128 -3.140 -11.356 -4.038 1.00 0.00 C ATOM 1970 O ALA A 128 -3.044 -10.224 -4.515 1.00 0.00 O ATOM 1971 CB ALA A 128 -1.138 -11.932 -2.676 1.00 0.00 C ATOM 0 H ALA A 128 -0.256 -11.532 -4.985 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.254 -13.292 -3.884 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.789 -12.036 -1.808 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.296 -12.618 -2.582 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.767 -10.908 -2.730 1.00 0.00 H new ATOM 1977 N ASP A 129 -4.274 -11.864 -3.580 1.00 0.00 N ATOM 1978 CA ASP A 129 -5.519 -11.115 -3.604 1.00 0.00 C ATOM 1979 C ASP A 129 -6.429 -11.632 -2.486 1.00 0.00 C ATOM 1980 O ASP A 129 -5.951 -12.294 -1.561 1.00 0.00 O ATOM 1981 CB ASP A 129 -6.188 -11.269 -4.984 1.00 0.00 C ATOM 1982 CG ASP A 129 -7.085 -10.098 -5.350 1.00 0.00 C ATOM 1983 OD1 ASP A 129 -8.141 -9.920 -4.701 1.00 0.00 O ATOM 1984 OD2 ASP A 129 -6.731 -9.350 -6.284 1.00 0.00 O ATOM 0 H ASP A 129 -4.356 -12.800 -3.184 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.328 -10.055 -3.438 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.415 -11.378 -5.745 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.777 -12.186 -4.995 1.00 0.00 H new ATOM 1989 N GLN A 130 -7.720 -11.342 -2.573 1.00 0.00 N ATOM 1990 CA GLN A 130 -8.691 -11.777 -1.570 1.00 0.00 C ATOM 1991 C GLN A 130 -8.725 -13.301 -1.431 1.00 0.00 C ATOM 1992 O GLN A 130 -8.784 -13.830 -0.321 1.00 0.00 O ATOM 1993 CB GLN A 130 -10.089 -11.252 -1.927 1.00 0.00 C ATOM 1994 CG GLN A 130 -10.230 -9.743 -1.796 1.00 0.00 C ATOM 1995 CD GLN A 130 -10.192 -9.276 -0.355 1.00 0.00 C ATOM 1996 OE1 GLN A 130 -11.114 -9.535 0.420 1.00 0.00 O ATOM 1997 NE2 GLN A 130 -9.126 -8.589 0.020 1.00 0.00 N ATOM 0 H GLN A 130 -8.126 -10.801 -3.337 1.00 0.00 H new ATOM 0 HA GLN A 130 -8.380 -11.364 -0.611 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -10.325 -11.542 -2.951 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -10.824 -11.734 -1.282 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -9.428 -9.257 -2.352 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -11.169 -9.429 -2.251 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -8.383 -8.394 -0.651 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -9.047 -8.254 0.980 1.00 0.00 H new ATOM 2006 N ARG A 131 -8.689 -14.008 -2.559 1.00 0.00 N ATOM 2007 CA ARG A 131 -8.727 -15.469 -2.544 1.00 0.00 C ATOM 2008 C ARG A 131 -7.320 -16.091 -2.469 1.00 0.00 C ATOM 2009 O ARG A 131 -7.123 -17.228 -2.901 1.00 0.00 O ATOM 2010 CB ARG A 131 -9.475 -15.988 -3.778 1.00 0.00 C ATOM 2011 CG ARG A 131 -10.942 -15.579 -3.814 1.00 0.00 C ATOM 2012 CD ARG A 131 -11.682 -16.178 -5.007 1.00 0.00 C ATOM 2013 NE ARG A 131 -11.659 -17.648 -5.022 1.00 0.00 N ATOM 2014 CZ ARG A 131 -12.150 -18.435 -4.059 1.00 0.00 C ATOM 2015 NH1 ARG A 131 -12.729 -17.918 -2.982 1.00 0.00 N ATOM 2016 NH2 ARG A 131 -12.078 -19.747 -4.187 1.00 0.00 N ATOM 0 H ARG A 131 -8.634 -13.596 -3.490 1.00 0.00 H new ATOM 0 HA ARG A 131 -9.259 -15.772 -1.642 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -8.980 -15.617 -4.676 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -9.408 -17.076 -3.803 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -11.428 -15.896 -2.891 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -11.013 -14.492 -3.854 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -12.717 -15.837 -4.993 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -11.236 -15.804 -5.929 1.00 0.00 H new ATOM 0 HE ARG A 131 -11.235 -18.103 -5.830 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -12.805 -16.906 -2.880 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -13.098 -18.533 -2.257 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -11.649 -20.156 -5.017 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -12.451 -20.352 -3.455 1.00 0.00 H new ATOM 2030 N MET A 132 -6.342 -15.364 -1.916 1.00 0.00 N ATOM 2031 CA MET A 132 -4.984 -15.896 -1.801 1.00 0.00 C ATOM 2032 C MET A 132 -4.787 -16.622 -0.459 1.00 0.00 C ATOM 2033 O MET A 132 -4.524 -17.820 -0.440 1.00 0.00 O ATOM 2034 CB MET A 132 -3.957 -14.773 -1.981 1.00 0.00 C ATOM 2035 CG MET A 132 -2.531 -15.255 -2.224 1.00 0.00 C ATOM 2036 SD MET A 132 -1.669 -15.725 -0.711 1.00 0.00 S ATOM 2037 CE MET A 132 -1.693 -14.177 0.193 1.00 0.00 C ATOM 0 H MET A 132 -6.464 -14.421 -1.547 1.00 0.00 H new ATOM 0 HA MET A 132 -4.832 -16.628 -2.594 1.00 0.00 H new ATOM 0 HB2 MET A 132 -4.264 -14.148 -2.820 1.00 0.00 H new ATOM 0 HB3 MET A 132 -3.968 -14.142 -1.092 1.00 0.00 H new ATOM 0 HG2 MET A 132 -2.554 -16.109 -2.901 1.00 0.00 H new ATOM 0 HG3 MET A 132 -1.969 -14.467 -2.724 1.00 0.00 H new ATOM 0 HE1 MET A 132 -1.259 -14.326 1.181 1.00 0.00 H new ATOM 0 HE2 MET A 132 -1.113 -13.430 -0.349 1.00 0.00 H new ATOM 0 HE3 MET A 132 -2.722 -13.832 0.297 1.00 0.00 H new ATOM 2047 N TYR A 133 -4.918 -15.885 0.653 1.00 0.00 N ATOM 2048 CA TYR A 133 -4.752 -16.448 2.008 1.00 0.00 C ATOM 2049 C TYR A 133 -5.566 -15.650 3.034 1.00 0.00 C ATOM 2050 O TYR A 133 -5.127 -15.462 4.163 1.00 0.00 O ATOM 2051 CB TYR A 133 -3.267 -16.425 2.422 1.00 0.00 C ATOM 2052 CG TYR A 133 -2.595 -17.787 2.467 1.00 0.00 C ATOM 2053 CD1 TYR A 133 -2.299 -18.485 1.303 1.00 0.00 C ATOM 2054 CD2 TYR A 133 -2.244 -18.365 3.681 1.00 0.00 C ATOM 2055 CE1 TYR A 133 -1.679 -19.719 1.345 1.00 0.00 C ATOM 2056 CE2 TYR A 133 -1.622 -19.600 3.733 1.00 0.00 C ATOM 2057 CZ TYR A 133 -1.343 -20.272 2.562 1.00 0.00 C ATOM 2058 OH TYR A 133 -0.728 -21.503 2.604 1.00 0.00 O ATOM 0 H TYR A 133 -5.140 -14.890 0.644 1.00 0.00 H new ATOM 0 HA TYR A 133 -5.111 -17.477 1.986 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -2.720 -15.789 1.726 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -3.186 -15.963 3.406 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -2.558 -18.055 0.347 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -2.461 -17.841 4.600 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -1.459 -20.247 0.429 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -1.357 -20.035 4.685 1.00 0.00 H new ATOM 0 HH TYR A 133 -0.557 -21.751 3.536 1.00 0.00 H new ATOM 2173 N LEU A 140 -3.430 -15.668 7.829 1.00 0.00 N ATOM 2174 CA LEU A 140 -2.520 -14.521 7.875 1.00 0.00 C ATOM 2175 C LEU A 140 -2.661 -13.773 9.200 1.00 0.00 C ATOM 2176 O LEU A 140 -3.765 -13.623 9.718 1.00 0.00 O ATOM 2177 CB LEU A 140 -2.807 -13.558 6.705 1.00 0.00 C ATOM 2178 CG LEU A 140 -2.352 -14.027 5.313 1.00 0.00 C ATOM 2179 CD1 LEU A 140 -2.848 -13.064 4.244 1.00 0.00 C ATOM 2180 CD2 LEU A 140 -0.833 -14.138 5.252 1.00 0.00 C ATOM 0 HA LEU A 140 -1.500 -14.896 7.788 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -3.880 -13.372 6.670 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -2.325 -12.604 6.920 1.00 0.00 H new ATOM 0 HG LEU A 140 -2.779 -15.013 5.128 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -2.519 -13.408 3.263 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -3.937 -13.024 4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -2.444 -12.070 4.434 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -0.532 -14.471 4.259 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -0.388 -13.164 5.458 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -0.491 -14.858 5.995 1.00 0.00 H new ATOM 2192 N SER A 141 -1.541 -13.305 9.739 1.00 0.00 N ATOM 2193 CA SER A 141 -1.554 -12.569 11.001 1.00 0.00 C ATOM 2194 C SER A 141 -0.600 -11.369 10.946 1.00 0.00 C ATOM 2195 O SER A 141 0.619 -11.537 10.966 1.00 0.00 O ATOM 2196 CB SER A 141 -1.178 -13.497 12.159 1.00 0.00 C ATOM 2197 OG SER A 141 0.050 -14.162 11.907 1.00 0.00 O ATOM 0 H SER A 141 -0.616 -13.420 9.325 1.00 0.00 H new ATOM 0 HA SER A 141 -2.563 -12.192 11.166 1.00 0.00 H new ATOM 0 HB2 SER A 141 -1.099 -12.920 13.080 1.00 0.00 H new ATOM 0 HB3 SER A 141 -1.968 -14.232 12.310 1.00 0.00 H new ATOM 0 HG SER A 141 0.679 -13.539 11.487 1.00 0.00 H new ATOM 2203 N PRO A 142 -1.149 -10.139 10.852 1.00 0.00 N ATOM 2204 CA PRO A 142 -0.364 -8.896 10.773 1.00 0.00 C ATOM 2205 C PRO A 142 0.207 -8.449 12.127 1.00 0.00 C ATOM 2206 O PRO A 142 -0.043 -9.080 13.153 1.00 0.00 O ATOM 2207 CB PRO A 142 -1.372 -7.866 10.238 1.00 0.00 C ATOM 2208 CG PRO A 142 -2.608 -8.643 9.902 1.00 0.00 C ATOM 2209 CD PRO A 142 -2.583 -9.852 10.787 1.00 0.00 C ATOM 0 HA PRO A 142 0.515 -9.022 10.141 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -1.582 -7.100 10.984 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -0.980 -7.355 9.359 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -3.504 -8.048 10.078 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -2.617 -8.928 8.850 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -3.005 -9.648 11.771 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -3.148 -10.682 10.363 1.00 0.00 H new ATOM 2217 N PHE A 143 0.998 -7.370 12.109 1.00 0.00 N ATOM 2218 CA PHE A 143 1.647 -6.851 13.317 1.00 0.00 C ATOM 2219 C PHE A 143 0.711 -6.016 14.216 1.00 0.00 C ATOM 2220 O PHE A 143 1.098 -5.624 15.316 1.00 0.00 O ATOM 2221 CB PHE A 143 2.892 -6.040 12.926 1.00 0.00 C ATOM 2222 CG PHE A 143 3.702 -5.544 14.095 1.00 0.00 C ATOM 2223 CD1 PHE A 143 4.212 -6.424 15.042 1.00 0.00 C ATOM 2224 CD2 PHE A 143 3.948 -4.191 14.245 1.00 0.00 C ATOM 2225 CE1 PHE A 143 4.950 -5.955 16.113 1.00 0.00 C ATOM 2226 CE2 PHE A 143 4.684 -3.718 15.312 1.00 0.00 C ATOM 2227 CZ PHE A 143 5.187 -4.601 16.248 1.00 0.00 C ATOM 0 H PHE A 143 1.205 -6.837 11.264 1.00 0.00 H new ATOM 0 HA PHE A 143 1.936 -7.715 13.916 1.00 0.00 H new ATOM 0 HB2 PHE A 143 3.530 -6.658 12.293 1.00 0.00 H new ATOM 0 HB3 PHE A 143 2.580 -5.185 12.326 1.00 0.00 H new ATOM 0 HD1 PHE A 143 4.030 -7.484 14.940 1.00 0.00 H new ATOM 0 HD2 PHE A 143 3.558 -3.495 13.517 1.00 0.00 H new ATOM 0 HE1 PHE A 143 5.341 -6.647 16.844 1.00 0.00 H new ATOM 0 HE2 PHE A 143 4.867 -2.659 15.415 1.00 0.00 H new ATOM 0 HZ PHE A 143 5.764 -4.233 17.083 1.00 0.00 H new ATOM 2237 N ARG A 144 -0.518 -5.759 13.754 1.00 0.00 N ATOM 2238 CA ARG A 144 -1.519 -4.978 14.525 1.00 0.00 C ATOM 2239 C ARG A 144 -1.194 -3.474 14.573 1.00 0.00 C ATOM 2240 O ARG A 144 -2.038 -2.670 14.975 1.00 0.00 O ATOM 2241 CB ARG A 144 -1.693 -5.526 15.952 1.00 0.00 C ATOM 2242 CG ARG A 144 -2.219 -6.953 15.997 1.00 0.00 C ATOM 2243 CD ARG A 144 -2.364 -7.461 17.424 1.00 0.00 C ATOM 2244 NE ARG A 144 -1.071 -7.573 18.109 1.00 0.00 N ATOM 2245 CZ ARG A 144 -0.927 -7.984 19.369 1.00 0.00 C ATOM 2246 NH1 ARG A 144 -1.996 -8.320 20.082 1.00 0.00 N ATOM 2247 NH2 ARG A 144 0.287 -8.071 19.902 1.00 0.00 N ATOM 0 H ARG A 144 -0.854 -6.078 12.846 1.00 0.00 H new ATOM 0 HA ARG A 144 -2.461 -5.094 13.989 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -0.733 -5.485 16.467 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -2.377 -4.878 16.500 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -3.186 -6.999 15.495 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -1.543 -7.607 15.446 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -3.012 -6.786 17.984 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -2.852 -8.435 17.413 1.00 0.00 H new ATOM 0 HE ARG A 144 -0.231 -7.321 17.589 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -2.925 -8.263 19.665 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -1.888 -8.635 21.046 1.00 0.00 H new ATOM 0 HH21 ARG A 144 1.106 -7.824 19.347 1.00 0.00 H new ATOM 0 HH22 ARG A 144 0.399 -8.385 20.866 1.00 0.00 H new ATOM 2261 N GLY A 145 0.009 -3.112 14.130 1.00 0.00 N ATOM 2262 CA GLY A 145 0.452 -1.711 14.084 1.00 0.00 C ATOM 2263 C GLY A 145 0.229 -0.909 15.365 1.00 0.00 C ATOM 2264 O GLY A 145 -0.889 -0.455 15.638 1.00 0.00 O ATOM 0 H GLY A 145 0.706 -3.776 13.793 1.00 0.00 H new ATOM 0 HA2 GLY A 145 1.515 -1.692 13.844 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -0.068 -1.210 13.267 1.00 0.00 H new ATOM 2268 N ASP A 146 1.298 -0.687 16.130 1.00 0.00 N ATOM 2269 CA ASP A 146 1.205 0.090 17.358 1.00 0.00 C ATOM 2270 C ASP A 146 2.541 0.744 17.692 1.00 0.00 C ATOM 2271 O ASP A 146 3.601 0.228 17.330 1.00 0.00 O ATOM 2272 CB ASP A 146 0.700 -0.769 18.541 1.00 0.00 C ATOM 2273 CG ASP A 146 1.553 -1.995 18.843 1.00 0.00 C ATOM 2274 OD1 ASP A 146 2.750 -1.836 19.163 1.00 0.00 O ATOM 2275 OD2 ASP A 146 1.013 -3.124 18.782 1.00 0.00 O ATOM 0 H ASP A 146 2.234 -1.034 15.919 1.00 0.00 H new ATOM 0 HA ASP A 146 0.472 0.879 17.190 1.00 0.00 H new ATOM 0 HB2 ASP A 146 0.655 -0.145 19.433 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -0.318 -1.094 18.328 1.00 0.00 H new ATOM 2280 N ASN A 147 2.465 1.905 18.352 1.00 0.00 N ATOM 2281 CA ASN A 147 3.645 2.686 18.742 1.00 0.00 C ATOM 2282 C ASN A 147 4.633 1.841 19.553 1.00 0.00 C ATOM 2283 O ASN A 147 4.538 1.763 20.782 1.00 0.00 O ATOM 2284 CB ASN A 147 3.246 3.898 19.594 1.00 0.00 C ATOM 2285 CG ASN A 147 2.238 4.844 18.952 1.00 0.00 C ATOM 2286 OD1 ASN A 147 1.730 4.517 17.772 1.00 0.00 O flip ATOM 2287 ND2 ASN A 147 1.888 5.866 19.538 1.00 0.00 N flip ATOM 0 H ASN A 147 1.581 2.331 18.632 1.00 0.00 H new ATOM 0 HA ASN A 147 4.118 3.017 17.818 1.00 0.00 H new ATOM 0 HB2 ASN A 147 2.832 3.538 20.536 1.00 0.00 H new ATOM 0 HB3 ASN A 147 4.146 4.463 19.836 1.00 0.00 H new ATOM 0 HD21 ASN A 147 2.292 6.098 20.445 1.00 0.00 H new ATOM 0 HD22 ASN A 147 1.193 6.483 19.117 1.00 0.00 H new ATOM 2294 N GLY A 148 5.569 1.213 18.861 1.00 0.00 N ATOM 2295 CA GLY A 148 6.554 0.384 19.522 1.00 0.00 C ATOM 2296 C GLY A 148 7.803 0.206 18.689 1.00 0.00 C ATOM 2297 O GLY A 148 8.417 1.185 18.264 1.00 0.00 O ATOM 0 H GLY A 148 5.665 1.263 17.847 1.00 0.00 H new ATOM 0 HA2 GLY A 148 6.819 0.832 20.480 1.00 0.00 H new ATOM 0 HA3 GLY A 148 6.120 -0.593 19.736 1.00 0.00 H new ATOM 2301 N TRP A 149 8.173 -1.045 18.449 1.00 0.00 N ATOM 2302 CA TRP A 149 9.357 -1.375 17.654 1.00 0.00 C ATOM 2303 C TRP A 149 9.213 -2.768 17.042 1.00 0.00 C ATOM 2304 O TRP A 149 8.649 -3.672 17.660 1.00 0.00 O ATOM 2305 CB TRP A 149 10.639 -1.281 18.504 1.00 0.00 C ATOM 2306 CG TRP A 149 10.500 -1.825 19.902 1.00 0.00 C ATOM 2307 CD1 TRP A 149 10.079 -3.073 20.263 1.00 0.00 C ATOM 2308 CD2 TRP A 149 10.782 -1.130 21.126 1.00 0.00 C ATOM 2309 NE1 TRP A 149 10.080 -3.195 21.628 1.00 0.00 N ATOM 2310 CE2 TRP A 149 10.509 -2.019 22.181 1.00 0.00 C ATOM 2311 CE3 TRP A 149 11.244 0.156 21.430 1.00 0.00 C ATOM 2312 CZ2 TRP A 149 10.676 -1.664 23.518 1.00 0.00 C ATOM 2313 CZ3 TRP A 149 11.409 0.508 22.758 1.00 0.00 C ATOM 2314 CH2 TRP A 149 11.129 -0.400 23.786 1.00 0.00 C ATOM 0 H TRP A 149 7.666 -1.859 18.796 1.00 0.00 H new ATOM 0 HA TRP A 149 9.440 -0.648 16.846 1.00 0.00 H new ATOM 0 HB2 TRP A 149 11.438 -1.820 17.995 1.00 0.00 H new ATOM 0 HB3 TRP A 149 10.946 -0.237 18.562 1.00 0.00 H new ATOM 0 HD1 TRP A 149 9.788 -3.851 19.573 1.00 0.00 H new ATOM 0 HE1 TRP A 149 9.805 -4.028 22.148 1.00 0.00 H new ATOM 0 HE3 TRP A 149 11.468 0.860 20.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 10.456 -2.360 24.314 1.00 0.00 H new ATOM 0 HZ3 TRP A 149 11.759 1.499 23.005 1.00 0.00 H new ATOM 0 HH2 TRP A 149 11.273 -0.097 24.813 1.00 0.00 H new ATOM 2325 N HIS A 150 9.682 -2.925 15.809 1.00 0.00 N ATOM 2326 CA HIS A 150 9.561 -4.194 15.099 1.00 0.00 C ATOM 2327 C HIS A 150 10.743 -4.423 14.152 1.00 0.00 C ATOM 2328 O HIS A 150 11.184 -3.501 13.473 1.00 0.00 O ATOM 2329 CB HIS A 150 8.248 -4.178 14.317 1.00 0.00 C ATOM 2330 CG HIS A 150 7.971 -5.408 13.523 1.00 0.00 C ATOM 2331 ND1 HIS A 150 8.061 -5.622 12.195 1.00 0.00 N flip ATOM 2332 CD2 HIS A 150 7.516 -6.585 14.074 1.00 0.00 C flip ATOM 2333 CE1 HIS A 150 7.655 -6.912 11.964 1.00 0.00 C flip ATOM 2334 NE2 HIS A 150 7.330 -7.471 13.116 1.00 0.00 N flip ATOM 0 H HIS A 150 10.150 -2.189 15.280 1.00 0.00 H new ATOM 0 HA HIS A 150 9.566 -5.012 15.819 1.00 0.00 H new ATOM 0 HB2 HIS A 150 7.427 -4.024 15.018 1.00 0.00 H new ATOM 0 HB3 HIS A 150 8.255 -3.322 13.642 1.00 0.00 H new ATOM 0 HD2 HIS A 150 7.339 -6.755 15.126 1.00 0.00 H new ATOM 0 HE1 HIS A 150 7.609 -7.392 10.998 1.00 0.00 H new ATOM 0 HE2 HIS A 150 6.993 -8.425 13.243 1.00 0.00 H new ATOM 2343 N THR A 151 11.240 -5.657 14.110 1.00 0.00 N ATOM 2344 CA THR A 151 12.365 -6.003 13.243 1.00 0.00 C ATOM 2345 C THR A 151 12.251 -7.446 12.752 1.00 0.00 C ATOM 2346 O THR A 151 11.805 -8.327 13.488 1.00 0.00 O ATOM 2347 CB THR A 151 13.717 -5.850 13.970 1.00 0.00 C ATOM 2348 OG1 THR A 151 13.685 -4.723 14.854 1.00 0.00 O ATOM 2349 CG2 THR A 151 14.859 -5.677 12.974 1.00 0.00 C ATOM 0 H THR A 151 10.882 -6.434 14.666 1.00 0.00 H new ATOM 0 HA THR A 151 12.328 -5.313 12.400 1.00 0.00 H new ATOM 0 HB THR A 151 13.887 -6.760 14.546 1.00 0.00 H new ATOM 0 HG1 THR A 151 14.549 -4.640 15.309 1.00 0.00 H new ATOM 0 HG21 THR A 151 15.800 -5.571 13.514 1.00 0.00 H new ATOM 0 HG22 THR A 151 14.910 -6.550 12.324 1.00 0.00 H new ATOM 0 HG23 THR A 151 14.684 -4.786 12.372 1.00 0.00 H new ATOM 2357 N ARG A 152 12.665 -7.673 11.509 1.00 0.00 N ATOM 2358 CA ARG A 152 12.636 -9.003 10.894 1.00 0.00 C ATOM 2359 C ARG A 152 13.268 -8.972 9.508 1.00 0.00 C ATOM 2360 O ARG A 152 13.061 -8.024 8.749 1.00 0.00 O ATOM 2361 CB ARG A 152 11.203 -9.559 10.792 1.00 0.00 C ATOM 2362 CG ARG A 152 10.225 -8.646 10.062 1.00 0.00 C ATOM 2363 CD ARG A 152 8.894 -9.338 9.806 1.00 0.00 C ATOM 2364 NE ARG A 152 8.272 -9.830 11.037 1.00 0.00 N ATOM 2365 CZ ARG A 152 7.051 -10.366 11.094 1.00 0.00 C ATOM 2366 NH1 ARG A 152 6.327 -10.507 9.995 1.00 0.00 N ATOM 2367 NH2 ARG A 152 6.573 -10.786 12.248 1.00 0.00 N ATOM 0 H ARG A 152 13.030 -6.943 10.897 1.00 0.00 H new ATOM 0 HA ARG A 152 13.213 -9.663 11.542 1.00 0.00 H new ATOM 0 HB2 ARG A 152 11.235 -10.521 10.280 1.00 0.00 H new ATOM 0 HB3 ARG A 152 10.826 -9.745 11.798 1.00 0.00 H new ATOM 0 HG2 ARG A 152 10.059 -7.744 10.652 1.00 0.00 H new ATOM 0 HG3 ARG A 152 10.660 -8.331 9.113 1.00 0.00 H new ATOM 0 HD2 ARG A 152 8.215 -8.642 9.313 1.00 0.00 H new ATOM 0 HD3 ARG A 152 9.048 -10.172 9.122 1.00 0.00 H new ATOM 0 HE ARG A 152 8.804 -9.759 11.904 1.00 0.00 H new ATOM 0 HH11 ARG A 152 6.701 -10.205 9.095 1.00 0.00 H new ATOM 0 HH12 ARG A 152 5.395 -10.918 10.048 1.00 0.00 H new ATOM 0 HH21 ARG A 152 7.136 -10.701 13.094 1.00 0.00 H new ATOM 0 HH22 ARG A 152 5.640 -11.196 12.295 1.00 0.00 H new ATOM 2381 N ASN A 153 14.029 -10.014 9.180 1.00 0.00 N ATOM 2382 CA ASN A 153 14.671 -10.104 7.871 1.00 0.00 C ATOM 2383 C ASN A 153 13.643 -10.365 6.796 1.00 0.00 C ATOM 2384 O ASN A 153 12.720 -11.161 6.987 1.00 0.00 O ATOM 2385 CB ASN A 153 15.791 -11.170 7.830 1.00 0.00 C ATOM 2386 CG ASN A 153 15.445 -12.525 8.442 1.00 0.00 C ATOM 2387 OD1 ASN A 153 14.174 -12.793 8.677 1.00 0.00 O flip ATOM 2388 ND2 ASN A 153 16.333 -13.343 8.673 1.00 0.00 N flip ATOM 0 H ASN A 153 14.215 -10.803 9.799 1.00 0.00 H new ATOM 0 HA ASN A 153 15.147 -9.142 7.681 1.00 0.00 H new ATOM 0 HB2 ASN A 153 16.080 -11.326 6.791 1.00 0.00 H new ATOM 0 HB3 ASN A 153 16.664 -10.772 8.347 1.00 0.00 H new ATOM 0 HD21 ASN A 153 17.307 -13.107 8.481 1.00 0.00 H new ATOM 0 HD22 ASN A 153 16.096 -14.258 9.057 1.00 0.00 H new ATOM 2395 N LEU A 154 13.793 -9.685 5.670 1.00 0.00 N ATOM 2396 CA LEU A 154 12.856 -9.862 4.585 1.00 0.00 C ATOM 2397 C LEU A 154 13.462 -9.531 3.223 1.00 0.00 C ATOM 2398 O LEU A 154 13.003 -10.039 2.201 1.00 0.00 O ATOM 2399 CB LEU A 154 11.573 -9.045 4.818 1.00 0.00 C ATOM 2400 CG LEU A 154 11.706 -7.517 4.727 1.00 0.00 C ATOM 2401 CD1 LEU A 154 11.515 -7.035 3.297 1.00 0.00 C ATOM 2402 CD2 LEU A 154 10.698 -6.845 5.634 1.00 0.00 C ATOM 0 H LEU A 154 14.543 -9.018 5.490 1.00 0.00 H new ATOM 0 HA LEU A 154 12.598 -10.921 4.572 1.00 0.00 H new ATOM 0 HB2 LEU A 154 10.827 -9.366 4.091 1.00 0.00 H new ATOM 0 HB3 LEU A 154 11.184 -9.295 5.805 1.00 0.00 H new ATOM 0 HG LEU A 154 12.712 -7.249 5.050 1.00 0.00 H new ATOM 0 HD11 LEU A 154 11.614 -5.950 3.262 1.00 0.00 H new ATOM 0 HD12 LEU A 154 12.271 -7.489 2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 154 10.523 -7.320 2.946 1.00 0.00 H new ATOM 0 HD21 LEU A 154 10.805 -5.763 5.558 1.00 0.00 H new ATOM 0 HD22 LEU A 154 9.690 -7.132 5.334 1.00 0.00 H new ATOM 0 HD23 LEU A 154 10.872 -7.155 6.664 1.00 0.00 H new ATOM 2414 N GLY A 155 14.469 -8.662 3.207 1.00 0.00 N ATOM 2415 CA GLY A 155 15.095 -8.263 1.953 1.00 0.00 C ATOM 2416 C GLY A 155 15.986 -9.337 1.353 1.00 0.00 C ATOM 2417 O GLY A 155 17.107 -9.045 0.938 1.00 0.00 O ATOM 0 H GLY A 155 14.865 -8.225 4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 155 14.318 -8.003 1.234 1.00 0.00 H new ATOM 0 HA3 GLY A 155 15.687 -7.363 2.121 1.00 0.00 H new ATOM 2421 N TYR A 156 15.491 -10.581 1.321 1.00 0.00 N ATOM 2422 CA TYR A 156 16.245 -11.722 0.783 1.00 0.00 C ATOM 2423 C TYR A 156 17.580 -11.855 1.527 1.00 0.00 C ATOM 2424 O TYR A 156 18.600 -12.263 0.968 1.00 0.00 O ATOM 2425 CB TYR A 156 16.456 -11.549 -0.734 1.00 0.00 C ATOM 2426 CG TYR A 156 16.999 -12.776 -1.437 1.00 0.00 C ATOM 2427 CD1 TYR A 156 16.382 -14.012 -1.292 1.00 0.00 C ATOM 2428 CD2 TYR A 156 18.122 -12.694 -2.249 1.00 0.00 C ATOM 2429 CE1 TYR A 156 16.870 -15.132 -1.934 1.00 0.00 C ATOM 2430 CE2 TYR A 156 18.615 -13.809 -2.897 1.00 0.00 C ATOM 2431 CZ TYR A 156 17.988 -15.025 -2.737 1.00 0.00 C ATOM 2432 OH TYR A 156 18.478 -16.136 -3.385 1.00 0.00 O ATOM 0 H TYR A 156 14.562 -10.825 1.665 1.00 0.00 H new ATOM 0 HA TYR A 156 15.679 -12.641 0.936 1.00 0.00 H new ATOM 0 HB2 TYR A 156 15.505 -11.275 -1.191 1.00 0.00 H new ATOM 0 HB3 TYR A 156 17.141 -10.718 -0.900 1.00 0.00 H new ATOM 0 HD1 TYR A 156 15.506 -14.098 -0.666 1.00 0.00 H new ATOM 0 HD2 TYR A 156 18.618 -11.743 -2.376 1.00 0.00 H new ATOM 0 HE1 TYR A 156 16.380 -16.086 -1.809 1.00 0.00 H new ATOM 0 HE2 TYR A 156 19.489 -13.728 -3.527 1.00 0.00 H new ATOM 0 HH TYR A 156 19.268 -15.887 -3.909 1.00 0.00 H new ATOM 2442 N GLY A 157 17.548 -11.480 2.799 1.00 0.00 N ATOM 2443 CA GLY A 157 18.729 -11.523 3.630 1.00 0.00 C ATOM 2444 C GLY A 157 18.755 -10.351 4.585 1.00 0.00 C ATOM 2445 O GLY A 157 19.031 -10.513 5.771 1.00 0.00 O ATOM 0 H GLY A 157 16.710 -11.142 3.273 1.00 0.00 H new ATOM 0 HA2 GLY A 157 18.750 -12.457 4.192 1.00 0.00 H new ATOM 0 HA3 GLY A 157 19.621 -11.508 3.004 1.00 0.00 H new ATOM 2449 N LEU A 158 18.442 -9.166 4.053 1.00 0.00 N ATOM 2450 CA LEU A 158 18.402 -7.931 4.835 1.00 0.00 C ATOM 2451 C LEU A 158 17.248 -7.973 5.846 1.00 0.00 C ATOM 2452 O LEU A 158 16.478 -8.932 5.857 1.00 0.00 O ATOM 2453 CB LEU A 158 18.268 -6.720 3.894 1.00 0.00 C ATOM 2454 CG LEU A 158 19.481 -6.426 2.985 1.00 0.00 C ATOM 2455 CD1 LEU A 158 20.782 -6.495 3.766 1.00 0.00 C ATOM 2456 CD2 LEU A 158 19.525 -7.371 1.794 1.00 0.00 C ATOM 0 H LEU A 158 18.210 -9.038 3.068 1.00 0.00 H new ATOM 0 HA LEU A 158 19.333 -7.833 5.394 1.00 0.00 H new ATOM 0 HB2 LEU A 158 17.394 -6.873 3.261 1.00 0.00 H new ATOM 0 HB3 LEU A 158 18.071 -5.835 4.500 1.00 0.00 H new ATOM 0 HG LEU A 158 19.363 -5.411 2.606 1.00 0.00 H new ATOM 0 HD11 LEU A 158 21.618 -6.284 3.099 1.00 0.00 H new ATOM 0 HD12 LEU A 158 20.763 -5.759 4.570 1.00 0.00 H new ATOM 0 HD13 LEU A 158 20.899 -7.492 4.190 1.00 0.00 H new ATOM 0 HD21 LEU A 158 20.391 -7.136 1.175 1.00 0.00 H new ATOM 0 HD22 LEU A 158 19.600 -8.399 2.148 1.00 0.00 H new ATOM 0 HD23 LEU A 158 18.616 -7.256 1.204 1.00 0.00 H new ATOM 2468 N LYS A 159 17.106 -6.942 6.682 1.00 0.00 N ATOM 2469 CA LYS A 159 16.026 -6.918 7.672 1.00 0.00 C ATOM 2470 C LYS A 159 15.360 -5.556 7.725 1.00 0.00 C ATOM 2471 O LYS A 159 16.009 -4.532 7.525 1.00 0.00 O ATOM 2472 CB LYS A 159 16.515 -7.215 9.096 1.00 0.00 C ATOM 2473 CG LYS A 159 17.154 -8.573 9.318 1.00 0.00 C ATOM 2474 CD LYS A 159 17.025 -9.003 10.778 1.00 0.00 C ATOM 2475 CE LYS A 159 18.297 -8.744 11.585 1.00 0.00 C ATOM 2476 NZ LYS A 159 18.755 -7.327 11.509 1.00 0.00 N ATOM 0 H LYS A 159 17.715 -6.124 6.695 1.00 0.00 H new ATOM 0 HA LYS A 159 15.331 -7.693 7.348 1.00 0.00 H new ATOM 0 HB2 LYS A 159 17.236 -6.448 9.377 1.00 0.00 H new ATOM 0 HB3 LYS A 159 15.668 -7.120 9.775 1.00 0.00 H new ATOM 0 HG2 LYS A 159 16.679 -9.313 8.673 1.00 0.00 H new ATOM 0 HG3 LYS A 159 18.207 -8.534 9.038 1.00 0.00 H new ATOM 0 HD2 LYS A 159 16.193 -8.469 11.237 1.00 0.00 H new ATOM 0 HD3 LYS A 159 16.784 -10.065 10.819 1.00 0.00 H new ATOM 0 HE2 LYS A 159 18.119 -9.008 12.628 1.00 0.00 H new ATOM 0 HE3 LYS A 159 19.091 -9.397 11.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 19.736 -7.297 11.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 18.143 -6.799 10.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 18.706 -6.895 12.454 1.00 0.00 H new ATOM 2490 N SER A 160 14.078 -5.537 8.044 1.00 0.00 N ATOM 2491 CA SER A 160 13.365 -4.278 8.166 1.00 0.00 C ATOM 2492 C SER A 160 13.080 -3.990 9.639 1.00 0.00 C ATOM 2493 O SER A 160 12.465 -4.804 10.335 1.00 0.00 O ATOM 2494 CB SER A 160 12.065 -4.298 7.360 1.00 0.00 C ATOM 2495 OG SER A 160 11.632 -2.985 7.052 1.00 0.00 O ATOM 0 H SER A 160 13.515 -6.369 8.221 1.00 0.00 H new ATOM 0 HA SER A 160 13.991 -3.484 7.760 1.00 0.00 H new ATOM 0 HB2 SER A 160 12.214 -4.860 6.438 1.00 0.00 H new ATOM 0 HB3 SER A 160 11.291 -4.815 7.927 1.00 0.00 H new ATOM 0 HG SER A 160 11.011 -3.015 6.294 1.00 0.00 H new ATOM 2501 N ARG A 161 13.531 -2.833 10.101 1.00 0.00 N ATOM 2502 CA ARG A 161 13.330 -2.420 11.480 1.00 0.00 C ATOM 2503 C ARG A 161 12.515 -1.136 11.507 1.00 0.00 C ATOM 2504 O ARG A 161 12.823 -0.184 10.783 1.00 0.00 O ATOM 2505 CB ARG A 161 14.675 -2.210 12.187 1.00 0.00 C ATOM 2506 CG ARG A 161 14.565 -1.998 13.696 1.00 0.00 C ATOM 2507 CD ARG A 161 15.936 -1.832 14.345 1.00 0.00 C ATOM 2508 NE ARG A 161 15.861 -1.785 15.814 1.00 0.00 N ATOM 2509 CZ ARG A 161 15.352 -0.770 16.522 1.00 0.00 C ATOM 2510 NH1 ARG A 161 14.911 0.326 15.917 1.00 0.00 N ATOM 2511 NH2 ARG A 161 15.298 -0.851 17.844 1.00 0.00 N ATOM 0 H ARG A 161 14.044 -2.158 9.533 1.00 0.00 H new ATOM 0 HA ARG A 161 12.790 -3.205 12.010 1.00 0.00 H new ATOM 0 HB2 ARG A 161 15.310 -3.075 11.999 1.00 0.00 H new ATOM 0 HB3 ARG A 161 15.173 -1.347 11.746 1.00 0.00 H new ATOM 0 HG2 ARG A 161 13.959 -1.115 13.896 1.00 0.00 H new ATOM 0 HG3 ARG A 161 14.050 -2.847 14.146 1.00 0.00 H new ATOM 0 HD2 ARG A 161 16.580 -2.658 14.043 1.00 0.00 H new ATOM 0 HD3 ARG A 161 16.400 -0.916 13.978 1.00 0.00 H new ATOM 0 HE ARG A 161 16.224 -2.586 16.331 1.00 0.00 H new ATOM 0 HH11 ARG A 161 14.958 0.402 14.901 1.00 0.00 H new ATOM 0 HH12 ARG A 161 14.525 1.093 16.468 1.00 0.00 H new ATOM 0 HH21 ARG A 161 15.644 -1.685 18.318 1.00 0.00 H new ATOM 0 HH22 ARG A 161 14.911 -0.079 18.387 1.00 0.00 H new ATOM 2525 N GLY A 162 11.479 -1.118 12.327 1.00 0.00 N ATOM 2526 CA GLY A 162 10.639 0.048 12.419 1.00 0.00 C ATOM 2527 C GLY A 162 9.467 -0.139 13.334 1.00 0.00 C ATOM 2528 O GLY A 162 9.595 -0.736 14.399 1.00 0.00 O ATOM 0 H GLY A 162 11.206 -1.893 12.931 1.00 0.00 H new ATOM 0 HA2 GLY A 162 11.235 0.890 12.770 1.00 0.00 H new ATOM 0 HA3 GLY A 162 10.277 0.306 11.424 1.00 0.00 H new ATOM 2532 N PHE A 163 8.322 0.391 12.911 1.00 0.00 N ATOM 2533 CA PHE A 163 7.089 0.312 13.682 1.00 0.00 C ATOM 2534 C PHE A 163 5.962 1.018 12.942 1.00 0.00 C ATOM 2535 O PHE A 163 6.177 1.604 11.880 1.00 0.00 O ATOM 2536 CB PHE A 163 7.268 0.925 15.087 1.00 0.00 C ATOM 2537 CG PHE A 163 7.998 2.246 15.103 1.00 0.00 C ATOM 2538 CD1 PHE A 163 7.411 3.395 14.595 1.00 0.00 C ATOM 2539 CD2 PHE A 163 9.281 2.331 15.627 1.00 0.00 C ATOM 2540 CE1 PHE A 163 8.088 4.599 14.608 1.00 0.00 C ATOM 2541 CE2 PHE A 163 9.961 3.532 15.641 1.00 0.00 C ATOM 2542 CZ PHE A 163 9.366 4.666 15.132 1.00 0.00 C ATOM 0 H PHE A 163 8.225 0.886 12.025 1.00 0.00 H new ATOM 0 HA PHE A 163 6.834 -0.741 13.803 1.00 0.00 H new ATOM 0 HB2 PHE A 163 6.285 1.061 15.538 1.00 0.00 H new ATOM 0 HB3 PHE A 163 7.811 0.216 15.713 1.00 0.00 H new ATOM 0 HD1 PHE A 163 6.413 3.348 14.185 1.00 0.00 H new ATOM 0 HD2 PHE A 163 9.753 1.446 16.029 1.00 0.00 H new ATOM 0 HE1 PHE A 163 7.620 5.487 14.209 1.00 0.00 H new ATOM 0 HE2 PHE A 163 10.959 3.583 16.051 1.00 0.00 H new ATOM 0 HZ PHE A 163 9.897 5.606 15.142 1.00 0.00 H new ATOM 2552 N MET A 164 4.775 0.964 13.516 1.00 0.00 N ATOM 2553 CA MET A 164 3.606 1.607 12.926 1.00 0.00 C ATOM 2554 C MET A 164 2.880 2.430 13.981 1.00 0.00 C ATOM 2555 O MET A 164 2.348 1.886 14.942 1.00 0.00 O ATOM 2556 CB MET A 164 2.653 0.564 12.333 1.00 0.00 C ATOM 2557 CG MET A 164 1.506 1.157 11.527 1.00 0.00 C ATOM 2558 SD MET A 164 0.369 -0.103 10.924 1.00 0.00 S ATOM 2559 CE MET A 164 -0.789 0.893 9.989 1.00 0.00 C ATOM 0 H MET A 164 4.590 0.480 14.395 1.00 0.00 H new ATOM 0 HA MET A 164 3.942 2.263 12.123 1.00 0.00 H new ATOM 0 HB2 MET A 164 3.222 -0.110 11.693 1.00 0.00 H new ATOM 0 HB3 MET A 164 2.241 -0.038 13.143 1.00 0.00 H new ATOM 0 HG2 MET A 164 0.960 1.869 12.146 1.00 0.00 H new ATOM 0 HG3 MET A 164 1.909 1.714 10.681 1.00 0.00 H new ATOM 0 HE1 MET A 164 -1.491 0.242 9.468 1.00 0.00 H new ATOM 0 HE2 MET A 164 -1.336 1.548 10.667 1.00 0.00 H new ATOM 0 HE3 MET A 164 -0.246 1.497 9.262 1.00 0.00 H new ATOM 2569 N ASN A 165 2.862 3.736 13.796 1.00 0.00 N ATOM 2570 CA ASN A 165 2.201 4.633 14.735 1.00 0.00 C ATOM 2571 C ASN A 165 0.710 4.725 14.431 1.00 0.00 C ATOM 2572 O ASN A 165 0.314 4.938 13.283 1.00 0.00 O ATOM 2573 CB ASN A 165 2.840 6.026 14.664 1.00 0.00 C ATOM 2574 CG ASN A 165 2.100 7.074 15.480 1.00 0.00 C ATOM 2575 OD1 ASN A 165 2.208 7.113 16.702 1.00 0.00 O ATOM 2576 ND2 ASN A 165 1.328 7.916 14.804 1.00 0.00 N ATOM 0 H ASN A 165 3.298 4.205 13.002 1.00 0.00 H new ATOM 0 HA ASN A 165 2.323 4.234 15.742 1.00 0.00 H new ATOM 0 HB2 ASN A 165 3.870 5.963 15.016 1.00 0.00 H new ATOM 0 HB3 ASN A 165 2.878 6.347 13.623 1.00 0.00 H new ATOM 0 HD21 ASN A 165 0.796 8.631 15.300 1.00 0.00 H new ATOM 0 HD22 ASN A 165 1.267 7.849 13.788 1.00 0.00 H new ATOM 2583 N SER A 166 -0.101 4.571 15.469 1.00 0.00 N ATOM 2584 CA SER A 166 -1.541 4.648 15.336 1.00 0.00 C ATOM 2585 C SER A 166 -2.028 6.085 15.581 1.00 0.00 C ATOM 2586 O SER A 166 -1.556 7.019 14.932 1.00 0.00 O ATOM 2587 CB SER A 166 -2.205 3.660 16.302 1.00 0.00 C ATOM 2588 OG SER A 166 -1.608 3.723 17.588 1.00 0.00 O ATOM 0 H SER A 166 0.223 4.390 16.419 1.00 0.00 H new ATOM 0 HA SER A 166 -1.823 4.374 14.319 1.00 0.00 H new ATOM 0 HB2 SER A 166 -3.269 3.883 16.380 1.00 0.00 H new ATOM 0 HB3 SER A 166 -2.120 2.648 15.907 1.00 0.00 H new ATOM 0 HG SER A 166 -2.050 3.085 18.186 1.00 0.00 H new ATOM 2594 N SER A 167 -2.958 6.252 16.529 1.00 0.00 N ATOM 2595 CA SER A 167 -3.513 7.567 16.880 1.00 0.00 C ATOM 2596 C SER A 167 -4.274 8.190 15.700 1.00 0.00 C ATOM 2597 O SER A 167 -4.035 9.341 15.315 1.00 0.00 O ATOM 2598 CB SER A 167 -2.410 8.512 17.387 1.00 0.00 C ATOM 2599 OG SER A 167 -1.736 7.959 18.510 1.00 0.00 O ATOM 0 H SER A 167 -3.347 5.482 17.074 1.00 0.00 H new ATOM 0 HA SER A 167 -4.228 7.418 17.689 1.00 0.00 H new ATOM 0 HB2 SER A 167 -1.694 8.702 16.587 1.00 0.00 H new ATOM 0 HB3 SER A 167 -2.847 9.473 17.659 1.00 0.00 H new ATOM 0 HG SER A 167 -1.039 8.579 18.811 1.00 0.00 H new ATOM 2605 N GLY A 168 -5.206 7.414 15.136 1.00 0.00 N ATOM 2606 CA GLY A 168 -6.015 7.878 14.014 1.00 0.00 C ATOM 2607 C GLY A 168 -5.272 7.891 12.690 1.00 0.00 C ATOM 2608 O GLY A 168 -5.609 7.133 11.778 1.00 0.00 O ATOM 0 H GLY A 168 -5.415 6.463 15.441 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -6.893 7.239 13.922 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -6.375 8.884 14.229 1.00 0.00 H new ATOM 2612 N HIS A 169 -4.257 8.741 12.580 1.00 0.00 N ATOM 2613 CA HIS A 169 -3.462 8.832 11.357 1.00 0.00 C ATOM 2614 C HIS A 169 -2.325 7.822 11.418 1.00 0.00 C ATOM 2615 O HIS A 169 -1.497 7.876 12.323 1.00 0.00 O ATOM 2616 CB HIS A 169 -2.924 10.253 11.172 1.00 0.00 C ATOM 2617 CG HIS A 169 -3.998 11.293 11.021 1.00 0.00 C ATOM 2618 ND1 HIS A 169 -3.731 12.645 10.980 1.00 0.00 N ATOM 2619 CD2 HIS A 169 -5.349 11.178 10.895 1.00 0.00 C ATOM 2620 CE1 HIS A 169 -4.859 13.313 10.836 1.00 0.00 C ATOM 2621 NE2 HIS A 169 -5.854 12.449 10.779 1.00 0.00 N ATOM 0 H HIS A 169 -3.964 9.377 13.321 1.00 0.00 H new ATOM 0 HA HIS A 169 -4.092 8.602 10.498 1.00 0.00 H new ATOM 0 HB2 HIS A 169 -2.300 10.510 12.028 1.00 0.00 H new ATOM 0 HB3 HIS A 169 -2.282 10.277 10.292 1.00 0.00 H new ATOM 0 HD2 HIS A 169 -5.917 10.259 10.888 1.00 0.00 H new ATOM 0 HE1 HIS A 169 -4.952 14.387 10.775 1.00 0.00 H new ATOM 0 HE2 HIS A 169 -6.839 12.687 10.667 1.00 0.00 H new ATOM 2630 N ALA A 170 -2.306 6.884 10.483 1.00 0.00 N ATOM 2631 CA ALA A 170 -1.283 5.846 10.492 1.00 0.00 C ATOM 2632 C ALA A 170 -0.040 6.215 9.693 1.00 0.00 C ATOM 2633 O ALA A 170 -0.124 6.627 8.538 1.00 0.00 O ATOM 2634 CB ALA A 170 -1.867 4.531 9.997 1.00 0.00 C ATOM 0 H ALA A 170 -2.977 6.819 9.718 1.00 0.00 H new ATOM 0 HA ALA A 170 -0.957 5.737 11.526 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -1.094 3.763 10.008 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -2.688 4.229 10.648 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.238 4.658 8.980 1.00 0.00 H new ATOM 2640 N ILE A 171 1.114 6.008 10.318 1.00 0.00 N ATOM 2641 CA ILE A 171 2.404 6.253 9.684 1.00 0.00 C ATOM 2642 C ILE A 171 3.317 5.048 9.922 1.00 0.00 C ATOM 2643 O ILE A 171 3.658 4.723 11.064 1.00 0.00 O ATOM 2644 CB ILE A 171 3.105 7.558 10.165 1.00 0.00 C ATOM 2645 CG1 ILE A 171 3.129 7.667 11.699 1.00 0.00 C ATOM 2646 CG2 ILE A 171 2.432 8.781 9.549 1.00 0.00 C ATOM 2647 CD1 ILE A 171 3.944 8.837 12.219 1.00 0.00 C ATOM 0 H ILE A 171 1.181 5.666 11.277 1.00 0.00 H new ATOM 0 HA ILE A 171 2.212 6.392 8.620 1.00 0.00 H new ATOM 0 HB ILE A 171 4.141 7.517 9.828 1.00 0.00 H new ATOM 0 HG12 ILE A 171 2.106 7.759 12.063 1.00 0.00 H new ATOM 0 HG13 ILE A 171 3.533 6.743 12.113 1.00 0.00 H new ATOM 0 HG21 ILE A 171 2.933 9.685 9.895 1.00 0.00 H new ATOM 0 HG22 ILE A 171 2.497 8.723 8.462 1.00 0.00 H new ATOM 0 HG23 ILE A 171 1.385 8.810 9.849 1.00 0.00 H new ATOM 0 HD11 ILE A 171 3.913 8.847 13.309 1.00 0.00 H new ATOM 0 HD12 ILE A 171 4.977 8.737 11.887 1.00 0.00 H new ATOM 0 HD13 ILE A 171 3.528 9.769 11.836 1.00 0.00 H new ATOM 2659 N LEU A 172 3.674 4.370 8.840 1.00 0.00 N ATOM 2660 CA LEU A 172 4.519 3.180 8.913 1.00 0.00 C ATOM 2661 C LEU A 172 5.981 3.531 8.673 1.00 0.00 C ATOM 2662 O LEU A 172 6.356 3.990 7.593 1.00 0.00 O ATOM 2663 CB LEU A 172 4.047 2.147 7.879 1.00 0.00 C ATOM 2664 CG LEU A 172 4.726 0.776 7.949 1.00 0.00 C ATOM 2665 CD1 LEU A 172 4.300 0.018 9.197 1.00 0.00 C ATOM 2666 CD2 LEU A 172 4.403 -0.039 6.708 1.00 0.00 C ATOM 0 H LEU A 172 3.391 4.624 7.894 1.00 0.00 H new ATOM 0 HA LEU A 172 4.434 2.757 9.914 1.00 0.00 H new ATOM 0 HB2 LEU A 172 2.973 2.006 7.998 1.00 0.00 H new ATOM 0 HB3 LEU A 172 4.206 2.560 6.883 1.00 0.00 H new ATOM 0 HG LEU A 172 5.803 0.937 7.997 1.00 0.00 H new ATOM 0 HD11 LEU A 172 4.797 -0.952 9.221 1.00 0.00 H new ATOM 0 HD12 LEU A 172 4.577 0.590 10.082 1.00 0.00 H new ATOM 0 HD13 LEU A 172 3.220 -0.128 9.183 1.00 0.00 H new ATOM 0 HD21 LEU A 172 4.893 -1.011 6.773 1.00 0.00 H new ATOM 0 HD22 LEU A 172 3.325 -0.180 6.636 1.00 0.00 H new ATOM 0 HD23 LEU A 172 4.759 0.489 5.823 1.00 0.00 H new ATOM 2678 N GLU A 173 6.797 3.284 9.686 1.00 0.00 N ATOM 2679 CA GLU A 173 8.227 3.547 9.610 1.00 0.00 C ATOM 2680 C GLU A 173 9.010 2.239 9.683 1.00 0.00 C ATOM 2681 O GLU A 173 9.855 2.054 10.555 1.00 0.00 O ATOM 2682 CB GLU A 173 8.682 4.495 10.728 1.00 0.00 C ATOM 2683 CG GLU A 173 8.386 5.966 10.463 1.00 0.00 C ATOM 2684 CD GLU A 173 9.601 6.861 10.679 1.00 0.00 C ATOM 2685 OE1 GLU A 173 10.698 6.330 10.983 1.00 0.00 O ATOM 2686 OE2 GLU A 173 9.461 8.093 10.537 1.00 0.00 O ATOM 0 H GLU A 173 6.490 2.898 10.579 1.00 0.00 H new ATOM 0 HA GLU A 173 8.426 4.032 8.654 1.00 0.00 H new ATOM 0 HB2 GLU A 173 8.196 4.201 11.658 1.00 0.00 H new ATOM 0 HB3 GLU A 173 9.755 4.374 10.877 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.033 6.082 9.438 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.578 6.293 11.118 1.00 0.00 H new ATOM 2693 N ILE A 174 8.728 1.328 8.763 1.00 0.00 N ATOM 2694 CA ILE A 174 9.424 0.046 8.727 1.00 0.00 C ATOM 2695 C ILE A 174 10.556 0.115 7.674 1.00 0.00 C ATOM 2696 O ILE A 174 10.366 -0.171 6.489 1.00 0.00 O ATOM 2697 CB ILE A 174 8.425 -1.141 8.498 1.00 0.00 C ATOM 2698 CG1 ILE A 174 9.117 -2.494 8.630 1.00 0.00 C ATOM 2699 CG2 ILE A 174 7.690 -1.056 7.172 1.00 0.00 C ATOM 2700 CD1 ILE A 174 9.311 -2.932 10.063 1.00 0.00 C ATOM 0 H ILE A 174 8.026 1.450 8.034 1.00 0.00 H new ATOM 0 HA ILE A 174 9.885 -0.155 9.694 1.00 0.00 H new ATOM 0 HB ILE A 174 7.678 -1.050 9.287 1.00 0.00 H new ATOM 0 HG12 ILE A 174 8.530 -3.247 8.104 1.00 0.00 H new ATOM 0 HG13 ILE A 174 10.088 -2.446 8.138 1.00 0.00 H new ATOM 0 HG21 ILE A 174 7.015 -1.906 7.075 1.00 0.00 H new ATOM 0 HG22 ILE A 174 7.116 -0.130 7.133 1.00 0.00 H new ATOM 0 HG23 ILE A 174 8.411 -1.070 6.355 1.00 0.00 H new ATOM 0 HD11 ILE A 174 9.809 -3.902 10.083 1.00 0.00 H new ATOM 0 HD12 ILE A 174 9.924 -2.199 10.588 1.00 0.00 H new ATOM 0 HD13 ILE A 174 8.341 -3.012 10.554 1.00 0.00 H new ATOM 2712 N HIS A 175 11.731 0.563 8.126 1.00 0.00 N ATOM 2713 CA HIS A 175 12.908 0.746 7.258 1.00 0.00 C ATOM 2714 C HIS A 175 13.733 -0.539 7.157 1.00 0.00 C ATOM 2715 O HIS A 175 14.226 -1.042 8.165 1.00 0.00 O ATOM 2716 CB HIS A 175 13.808 1.862 7.823 1.00 0.00 C ATOM 2717 CG HIS A 175 13.114 3.169 8.126 1.00 0.00 C ATOM 2718 ND1 HIS A 175 13.761 4.238 8.710 1.00 0.00 N ATOM 2719 CD2 HIS A 175 11.833 3.575 7.934 1.00 0.00 C ATOM 2720 CE1 HIS A 175 12.911 5.239 8.862 1.00 0.00 C ATOM 2721 NE2 HIS A 175 11.737 4.862 8.400 1.00 0.00 N ATOM 0 H HIS A 175 11.897 0.810 9.102 1.00 0.00 H new ATOM 0 HA HIS A 175 12.546 1.013 6.265 1.00 0.00 H new ATOM 0 HB2 HIS A 175 14.276 1.499 8.738 1.00 0.00 H new ATOM 0 HB3 HIS A 175 14.610 2.054 7.110 1.00 0.00 H new ATOM 0 HD2 HIS A 175 11.036 2.992 7.495 1.00 0.00 H new ATOM 0 HE1 HIS A 175 13.141 6.203 9.292 1.00 0.00 H new ATOM 0 HE2 HIS A 175 10.893 5.434 8.390 1.00 0.00 H new ATOM 2730 N VAL A 176 13.910 -1.050 5.944 1.00 0.00 N ATOM 2731 CA VAL A 176 14.713 -2.260 5.729 1.00 0.00 C ATOM 2732 C VAL A 176 16.169 -1.883 5.446 1.00 0.00 C ATOM 2733 O VAL A 176 16.447 -1.037 4.598 1.00 0.00 O ATOM 2734 CB VAL A 176 14.144 -3.149 4.584 1.00 0.00 C ATOM 2735 CG1 VAL A 176 14.062 -2.389 3.266 1.00 0.00 C ATOM 2736 CG2 VAL A 176 14.969 -4.423 4.423 1.00 0.00 C ATOM 0 H VAL A 176 13.512 -0.651 5.094 1.00 0.00 H new ATOM 0 HA VAL A 176 14.667 -2.851 6.644 1.00 0.00 H new ATOM 0 HB VAL A 176 13.129 -3.429 4.864 1.00 0.00 H new ATOM 0 HG11 VAL A 176 13.660 -3.044 2.493 1.00 0.00 H new ATOM 0 HG12 VAL A 176 13.409 -1.524 3.385 1.00 0.00 H new ATOM 0 HG13 VAL A 176 15.058 -2.054 2.976 1.00 0.00 H new ATOM 0 HG21 VAL A 176 14.552 -5.027 3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 176 16.000 -4.161 4.184 1.00 0.00 H new ATOM 0 HG23 VAL A 176 14.945 -4.992 5.353 1.00 0.00 H new ATOM 2746 N THR A 177 17.078 -2.526 6.162 1.00 0.00 N ATOM 2747 CA THR A 177 18.507 -2.296 6.010 1.00 0.00 C ATOM 2748 C THR A 177 19.252 -3.620 6.137 1.00 0.00 C ATOM 2749 O THR A 177 18.652 -4.679 5.968 1.00 0.00 O ATOM 2750 CB THR A 177 19.037 -1.300 7.066 1.00 0.00 C ATOM 2751 OG1 THR A 177 18.629 -1.714 8.377 1.00 0.00 O ATOM 2752 CG2 THR A 177 18.540 0.116 6.796 1.00 0.00 C ATOM 0 H THR A 177 16.845 -3.225 6.868 1.00 0.00 H new ATOM 0 HA THR A 177 18.677 -1.864 5.024 1.00 0.00 H new ATOM 0 HB THR A 177 20.125 -1.295 7.005 1.00 0.00 H new ATOM 0 HG1 THR A 177 18.970 -1.079 9.041 1.00 0.00 H new ATOM 0 HG21 THR A 177 18.932 0.790 7.557 1.00 0.00 H new ATOM 0 HG22 THR A 177 18.882 0.440 5.813 1.00 0.00 H new ATOM 0 HG23 THR A 177 17.450 0.131 6.824 1.00 0.00 H new ATOM 2760 N LYS A 178 20.544 -3.571 6.440 1.00 0.00 N ATOM 2761 CA LYS A 178 21.341 -4.784 6.582 1.00 0.00 C ATOM 2762 C LYS A 178 20.902 -5.612 7.789 1.00 0.00 C ATOM 2763 O LYS A 178 20.582 -5.067 8.849 1.00 0.00 O ATOM 2764 CB LYS A 178 22.828 -4.427 6.696 1.00 0.00 C ATOM 2765 CG LYS A 178 23.758 -5.629 6.609 1.00 0.00 C ATOM 2766 CD LYS A 178 25.219 -5.225 6.723 1.00 0.00 C ATOM 2767 CE LYS A 178 26.135 -6.435 6.633 1.00 0.00 C ATOM 2768 NZ LYS A 178 27.564 -6.072 6.833 1.00 0.00 N ATOM 0 H LYS A 178 21.062 -2.705 6.592 1.00 0.00 H new ATOM 0 HA LYS A 178 21.183 -5.391 5.691 1.00 0.00 H new ATOM 0 HB2 LYS A 178 23.085 -3.723 5.904 1.00 0.00 H new ATOM 0 HB3 LYS A 178 22.998 -3.916 7.644 1.00 0.00 H new ATOM 0 HG2 LYS A 178 23.514 -6.335 7.403 1.00 0.00 H new ATOM 0 HG3 LYS A 178 23.597 -6.145 5.662 1.00 0.00 H new ATOM 0 HD2 LYS A 178 25.466 -4.519 5.930 1.00 0.00 H new ATOM 0 HD3 LYS A 178 25.384 -4.711 7.670 1.00 0.00 H new ATOM 0 HE2 LYS A 178 25.840 -7.169 7.383 1.00 0.00 H new ATOM 0 HE3 LYS A 178 26.015 -6.908 5.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 28.152 -6.927 6.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 27.855 -5.391 6.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 27.685 -5.644 7.773 1.00 0.00 H new ATOM 2782 N ALA A 179 20.909 -6.934 7.616 1.00 0.00 N ATOM 2783 CA ALA A 179 20.540 -7.857 8.681 1.00 0.00 C ATOM 2784 C ALA A 179 21.613 -7.861 9.770 1.00 0.00 C ATOM 2785 O ALA A 179 21.249 -7.884 10.967 1.00 0.00 O ATOM 2786 CB ALA A 179 20.350 -9.259 8.127 1.00 0.00 C ATOM 2787 OXT ALA A 179 22.812 -7.815 9.422 1.00 0.00 O ATOM 0 H ALA A 179 21.169 -7.389 6.741 1.00 0.00 H new ATOM 0 HA ALA A 179 19.597 -7.526 9.116 1.00 0.00 H new ATOM 0 HB1 ALA A 179 20.075 -9.936 8.936 1.00 0.00 H new ATOM 0 HB2 ALA A 179 19.559 -9.250 7.377 1.00 0.00 H new ATOM 0 HB3 ALA A 179 21.280 -9.599 7.670 1.00 0.00 H new