USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 896 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 9 ASN :FLIP amide:sc= -7.02! C(o=-13!,f=-10!) USER MOD Set 1.2: A 130 MET CE :methyl -144:sc= -3.39 (180deg=-8.26!) USER MOD Set 2.1: A 105 THR OG1 : rot 122:sc= 1.17 USER MOD Set 2.2: A 108 THR OG1 : rot -62:sc= -1.19! USER MOD Set 3.1: A 103 THR OG1 : rot -92:sc= 0.257 USER MOD Set 3.2: A 127 CYS SG : rot 151:sc= -0.796 USER MOD Set 4.1: A 15 THR OG1 : rot 76:sc= 0.0505 USER MOD Set 4.2: A 126 LYS NZ :NH3+ -108:sc= -0.861 (180deg=-4.36!) USER MOD Set 5.1: A 6 TYR OH : rot 165:sc= -3.88 USER MOD Set 5.2: A 133 HIS : no HD1:sc= -6.79! C(o=-11!,f=-10!) USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl 172:sc= -0.336 (180deg=-0.575) USER MOD Single : A 16 CYS SG : rot -109:sc= -4.4! USER MOD Single : A 17 GLN : amide:sc= -0.584 K(o=-0.58,f=-6.1!) USER MOD Single : A 24 TYR OH : rot 170:sc= -0.831 USER MOD Single : A 25 LYS NZ :NH3+ -137:sc= -0.22 (180deg=-2.25!) USER MOD Single : A 27 SER OG : rot 36:sc= 0.199 USER MOD Single : A 29 SER OG : rot 88:sc= 0.0248 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 6:sc= 1.2 USER MOD Single : A 41 ASN : amide:sc=-0.00407 X(o=-0.0041,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -5.16! C(o=-5.2!,f=-9.6!) USER MOD Single : A 64 THR OG1 : rot 34:sc= -1.86! USER MOD Single : A 68 GLN : amide:sc= -1.64 X(o=-1.6,f=-2) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot -150:sc= -2.96! USER MOD Single : A 71 SER OG : rot -58:sc= -3.76! USER MOD Single : A 76 SER OG : rot 85:sc= 0.771 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0326 USER MOD Single : A 85 MET CE :methyl -134:sc= -6.31! (180deg=-9.89!) USER MOD Single : A 89 THR OG1 : rot -10:sc= 0.921! USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN :FLIP amide:sc= -0.66! C(o=-2.8!,f=-0.66!) USER MOD Single : A 101 THR OG1 : rot -100:sc= -1.15 USER MOD Single : A 104 LYS NZ :NH3+ -169:sc= -3.31 (180deg=-4.02!) USER MOD Single : A 107 LYS NZ :NH3+ -163:sc= 0.00802 (180deg=0) USER MOD Single : A 113 MET CE :methyl 164:sc= -0.0908 (180deg=-0.368) USER MOD Single : A 124 ASN : amide:sc= -1.31 K(o=-1.3,f=-2.3!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 33:sc= 0.777 USER MOD Single : A 137 SER OG : rot -35:sc= -0.359 USER MOD Single : A 138 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.17) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -17.535 13.908 1.205 1.00 0.00 N ATOM 21 CA TRP A 3 -17.032 12.844 0.277 1.00 0.00 C ATOM 22 C TRP A 3 -17.557 13.073 -1.167 1.00 0.00 C ATOM 23 O TRP A 3 -16.828 12.905 -2.135 1.00 0.00 O ATOM 24 CB TRP A 3 -17.506 11.529 0.741 1.00 0.00 C ATOM 25 CG TRP A 3 -16.611 10.947 1.802 1.00 0.00 C ATOM 26 CD1 TRP A 3 -16.961 9.866 2.483 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.259 11.343 2.322 1.00 0.00 C ATOM 28 NE1 TRP A 3 -15.978 9.541 3.390 1.00 0.00 N ATOM 29 CE2 TRP A 3 -14.914 10.411 3.337 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.302 12.389 2.043 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -13.713 10.489 4.036 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.100 12.445 2.763 1.00 0.00 C ATOM 33 CH2 TRP A 3 -12.812 11.502 3.753 1.00 0.00 C ATOM 0 HA TRP A 3 -15.943 12.883 0.272 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.518 11.627 1.134 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -17.558 10.844 -0.105 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -17.883 9.320 2.347 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.032 8.747 4.028 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.512 13.126 1.282 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.484 9.760 4.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.387 13.228 2.549 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -11.883 11.563 4.300 1.00 0.00 H new ATOM 44 N ASN A 4 -18.837 13.429 -1.301 1.00 0.00 N ATOM 45 CA ASN A 4 -19.454 13.648 -2.673 1.00 0.00 C ATOM 46 C ASN A 4 -18.719 14.749 -3.431 1.00 0.00 C ATOM 47 O ASN A 4 -18.692 14.745 -4.643 1.00 0.00 O ATOM 48 CB ASN A 4 -20.934 14.029 -2.531 1.00 0.00 C ATOM 49 CG ASN A 4 -21.792 12.763 -2.549 1.00 0.00 C ATOM 50 OD1 ASN A 4 -22.086 12.232 -3.601 1.00 0.00 O ATOM 51 ND2 ASN A 4 -22.204 12.252 -1.421 1.00 0.00 N ATOM 0 H ASN A 4 -19.476 13.576 -0.519 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.368 12.718 -3.234 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -21.092 14.575 -1.601 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.229 14.692 -3.344 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -22.774 11.406 -1.422 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -21.956 12.699 -0.538 1.00 0.00 H new ATOM 58 N ALA A 5 -18.124 15.670 -2.719 1.00 0.00 N ATOM 59 CA ALA A 5 -17.335 16.794 -3.372 1.00 0.00 C ATOM 60 C ALA A 5 -16.044 16.186 -3.909 1.00 0.00 C ATOM 61 O ALA A 5 -15.570 16.537 -4.991 1.00 0.00 O ATOM 62 CB ALA A 5 -17.021 17.884 -2.341 1.00 0.00 C ATOM 0 H ALA A 5 -18.143 15.704 -1.700 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.908 17.253 -4.178 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.456 18.684 -2.818 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.952 18.286 -1.941 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.432 17.458 -1.529 1.00 0.00 H new ATOM 68 N TYR A 6 -15.496 15.226 -3.187 1.00 0.00 N ATOM 69 CA TYR A 6 -14.254 14.519 -3.688 1.00 0.00 C ATOM 70 C TYR A 6 -14.682 13.564 -4.820 1.00 0.00 C ATOM 71 O TYR A 6 -13.874 13.108 -5.592 1.00 0.00 O ATOM 72 CB TYR A 6 -13.535 13.823 -2.546 1.00 0.00 C ATOM 73 CG TYR A 6 -13.392 14.859 -1.480 1.00 0.00 C ATOM 74 CD1 TYR A 6 -12.402 15.833 -1.553 1.00 0.00 C ATOM 75 CD2 TYR A 6 -14.315 14.892 -0.488 1.00 0.00 C ATOM 76 CE1 TYR A 6 -12.363 16.849 -0.596 1.00 0.00 C ATOM 77 CE2 TYR A 6 -14.283 15.875 0.483 1.00 0.00 C ATOM 78 CZ TYR A 6 -13.308 16.865 0.434 1.00 0.00 C ATOM 79 OH TYR A 6 -13.300 17.873 1.372 1.00 0.00 O ATOM 0 H TYR A 6 -15.846 14.903 -2.285 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.531 15.227 -4.092 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -14.104 12.966 -2.187 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.562 13.449 -2.864 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -11.668 15.804 -2.345 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -15.088 14.138 -0.456 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -11.607 17.618 -0.651 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -15.014 15.874 1.278 1.00 0.00 H new ATOM 0 HH TYR A 6 -14.148 17.870 1.863 1.00 0.00 H new ATOM 89 N ILE A 7 -15.998 13.367 -4.967 1.00 0.00 N ATOM 90 CA ILE A 7 -16.552 12.596 -6.119 1.00 0.00 C ATOM 91 C ILE A 7 -16.830 13.691 -7.246 1.00 0.00 C ATOM 92 O ILE A 7 -16.779 13.441 -8.477 1.00 0.00 O ATOM 93 CB ILE A 7 -17.822 11.845 -5.689 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.375 10.563 -4.948 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.675 11.475 -6.918 1.00 0.00 C ATOM 96 CD1 ILE A 7 -16.806 9.543 -5.937 1.00 0.00 C ATOM 0 H ILE A 7 -16.702 13.720 -4.319 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.874 11.827 -6.491 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.431 12.474 -5.040 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.622 10.812 -4.200 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.222 10.129 -4.416 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.570 10.944 -6.593 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.964 12.383 -7.447 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -18.095 10.836 -7.584 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.497 8.647 -5.398 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.570 9.280 -6.669 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -15.946 9.974 -6.449 1.00 0.00 H new ATOM 108 N ASP A 8 -17.051 14.931 -6.803 1.00 0.00 N ATOM 109 CA ASP A 8 -17.236 16.044 -7.736 1.00 0.00 C ATOM 110 C ASP A 8 -15.898 16.277 -8.454 1.00 0.00 C ATOM 111 O ASP A 8 -15.865 16.831 -9.501 1.00 0.00 O ATOM 112 CB ASP A 8 -17.714 17.270 -6.971 1.00 0.00 C ATOM 113 CG ASP A 8 -19.244 17.289 -6.941 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.840 17.206 -8.005 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.797 17.382 -5.858 1.00 0.00 O ATOM 0 H ASP A 8 -17.106 15.187 -5.817 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.997 15.825 -8.485 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.320 17.254 -5.955 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.338 18.177 -7.445 1.00 0.00 H new ATOM 120 N ASN A 9 -14.797 15.772 -7.874 1.00 0.00 N ATOM 121 CA ASN A 9 -13.427 15.844 -8.489 1.00 0.00 C ATOM 122 C ASN A 9 -13.522 15.353 -9.908 1.00 0.00 C ATOM 123 O ASN A 9 -13.180 16.022 -10.855 1.00 0.00 O ATOM 124 CB ASN A 9 -12.544 14.878 -7.581 1.00 0.00 C ATOM 125 CG ASN A 9 -11.620 13.811 -8.368 1.00 0.00 C ATOM 126 OD1 ASN A 9 -11.716 12.442 -8.071 1.00 0.00 O flip ATOM 127 ND2 ASN A 9 -10.833 14.190 -9.212 1.00 0.00 N flip ATOM 0 H ASN A 9 -14.813 15.301 -6.969 1.00 0.00 H new ATOM 0 HA ASN A 9 -12.998 16.845 -8.526 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.899 15.492 -6.952 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -13.210 14.330 -6.915 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -10.760 15.183 -9.431 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -10.246 13.515 -9.701 1.00 0.00 H new ATOM 134 N LEU A 10 -14.037 14.209 -9.996 1.00 0.00 N ATOM 135 CA LEU A 10 -14.297 13.490 -11.269 1.00 0.00 C ATOM 136 C LEU A 10 -15.102 14.304 -12.173 1.00 0.00 C ATOM 137 O LEU A 10 -14.917 14.346 -13.384 1.00 0.00 O ATOM 138 CB LEU A 10 -15.180 12.290 -10.927 1.00 0.00 C ATOM 139 CG LEU A 10 -14.486 11.278 -10.034 1.00 0.00 C ATOM 140 CD1 LEU A 10 -12.953 11.279 -10.191 1.00 0.00 C ATOM 141 CD2 LEU A 10 -14.866 11.514 -8.535 1.00 0.00 C ATOM 0 H LEU A 10 -14.322 13.676 -9.175 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.343 13.233 -11.730 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -16.086 12.642 -10.433 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.490 11.800 -11.850 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.839 10.298 -10.355 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.519 10.533 -9.525 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.693 11.040 -11.222 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -12.562 12.264 -9.937 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -14.358 10.779 -7.911 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.560 12.517 -8.236 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -15.944 11.412 -8.413 1.00 0.00 H new ATOM 153 N MET A 11 -16.040 14.889 -11.630 1.00 0.00 N ATOM 154 CA MET A 11 -16.954 15.645 -12.447 1.00 0.00 C ATOM 155 C MET A 11 -16.235 16.972 -12.908 1.00 0.00 C ATOM 156 O MET A 11 -16.450 17.462 -14.001 1.00 0.00 O ATOM 157 CB MET A 11 -18.240 15.760 -11.611 1.00 0.00 C ATOM 158 CG MET A 11 -18.671 14.243 -11.172 1.00 0.00 C ATOM 159 SD MET A 11 -19.420 13.417 -12.604 1.00 0.00 S ATOM 160 CE MET A 11 -18.012 12.342 -13.010 1.00 0.00 C ATOM 0 H MET A 11 -16.236 14.889 -10.629 1.00 0.00 H new ATOM 0 HA MET A 11 -17.248 15.193 -13.394 1.00 0.00 H new ATOM 0 HB2 MET A 11 -18.073 16.382 -10.732 1.00 0.00 H new ATOM 0 HB3 MET A 11 -19.034 16.233 -12.189 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.799 13.687 -10.828 1.00 0.00 H new ATOM 0 HG3 MET A 11 -19.377 14.275 -10.342 1.00 0.00 H new ATOM 0 HE1 MET A 11 -18.306 11.635 -13.786 1.00 0.00 H new ATOM 0 HE2 MET A 11 -17.182 12.950 -13.369 1.00 0.00 H new ATOM 0 HE3 MET A 11 -17.703 11.795 -12.119 1.00 0.00 H new ATOM 170 N ALA A 12 -15.339 17.477 -12.082 1.00 0.00 N ATOM 171 CA ALA A 12 -14.492 18.699 -12.392 1.00 0.00 C ATOM 172 C ALA A 12 -13.185 18.403 -13.216 1.00 0.00 C ATOM 173 O ALA A 12 -12.473 19.334 -13.573 1.00 0.00 O ATOM 174 CB ALA A 12 -14.082 19.338 -11.073 1.00 0.00 C ATOM 0 H ALA A 12 -15.149 17.077 -11.163 1.00 0.00 H new ATOM 0 HA ALA A 12 -15.108 19.349 -13.013 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.472 20.219 -11.270 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.973 19.630 -10.518 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.507 18.622 -10.485 1.00 0.00 H new ATOM 180 N ASP A 13 -12.796 17.140 -13.382 1.00 0.00 N ATOM 181 CA ASP A 13 -11.400 16.826 -14.047 1.00 0.00 C ATOM 182 C ASP A 13 -11.400 16.510 -15.551 1.00 0.00 C ATOM 183 O ASP A 13 -10.325 16.350 -16.105 1.00 0.00 O ATOM 184 CB ASP A 13 -10.721 15.616 -13.304 1.00 0.00 C ATOM 185 CG ASP A 13 -11.725 14.688 -12.727 1.00 0.00 C ATOM 186 OD1 ASP A 13 -12.626 14.347 -13.439 1.00 0.00 O ATOM 187 OD2 ASP A 13 -11.567 14.311 -11.579 1.00 0.00 O ATOM 0 H ASP A 13 -13.340 16.322 -13.107 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.852 17.763 -13.944 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -10.083 15.073 -14.002 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.076 15.993 -12.510 1.00 0.00 H new ATOM 192 N GLY A 14 -12.530 16.456 -16.226 1.00 0.00 N ATOM 193 CA GLY A 14 -12.536 16.164 -17.768 1.00 0.00 C ATOM 194 C GLY A 14 -11.442 15.084 -18.203 1.00 0.00 C ATOM 195 O GLY A 14 -11.054 15.021 -19.360 1.00 0.00 O ATOM 0 H GLY A 14 -13.453 16.595 -15.814 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.524 15.810 -18.061 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.356 17.093 -18.309 1.00 0.00 H new ATOM 199 N THR A 15 -10.983 14.272 -17.277 1.00 0.00 N ATOM 200 CA THR A 15 -9.959 13.206 -17.532 1.00 0.00 C ATOM 201 C THR A 15 -10.422 11.936 -16.811 1.00 0.00 C ATOM 202 O THR A 15 -10.089 10.826 -17.217 1.00 0.00 O ATOM 203 CB THR A 15 -8.607 13.668 -16.967 1.00 0.00 C ATOM 204 OG1 THR A 15 -8.144 14.786 -17.706 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.601 12.530 -17.064 1.00 0.00 C ATOM 0 H THR A 15 -11.294 14.309 -16.306 1.00 0.00 H new ATOM 0 HA THR A 15 -9.848 13.013 -18.599 1.00 0.00 H new ATOM 0 HB THR A 15 -8.725 13.953 -15.922 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.645 15.585 -17.439 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.642 12.857 -16.663 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.961 11.676 -16.491 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.479 12.241 -18.108 1.00 0.00 H new ATOM 213 N CYS A 16 -11.178 12.102 -15.731 1.00 0.00 N ATOM 214 CA CYS A 16 -11.646 10.975 -14.961 1.00 0.00 C ATOM 215 C CYS A 16 -12.702 10.181 -15.782 1.00 0.00 C ATOM 216 O CYS A 16 -13.011 10.503 -16.920 1.00 0.00 O ATOM 217 CB CYS A 16 -12.264 11.506 -13.668 1.00 0.00 C ATOM 218 SG CYS A 16 -14.035 11.798 -13.902 1.00 0.00 S ATOM 0 H CYS A 16 -11.475 13.011 -15.376 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.821 10.303 -14.727 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -12.109 10.791 -12.861 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -11.770 12.432 -13.373 1.00 0.00 H new ATOM 0 HG CYS A 16 -14.266 13.077 -13.915 1.00 0.00 H new ATOM 224 N GLN A 17 -13.234 9.167 -15.165 1.00 0.00 N ATOM 225 CA GLN A 17 -14.270 8.300 -15.770 1.00 0.00 C ATOM 226 C GLN A 17 -15.077 7.775 -14.587 1.00 0.00 C ATOM 227 O GLN A 17 -16.288 7.900 -14.514 1.00 0.00 O ATOM 228 CB GLN A 17 -13.586 7.167 -16.522 1.00 0.00 C ATOM 229 CG GLN A 17 -14.422 6.732 -17.730 1.00 0.00 C ATOM 230 CD GLN A 17 -15.387 5.602 -17.336 1.00 0.00 C ATOM 231 OE1 GLN A 17 -15.870 5.549 -16.220 1.00 0.00 O ATOM 232 NE2 GLN A 17 -15.699 4.693 -18.222 1.00 0.00 N ATOM 0 H GLN A 17 -12.976 8.894 -14.217 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.910 8.819 -16.483 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -12.599 7.489 -16.854 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.436 6.319 -15.853 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -14.985 7.582 -18.115 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -13.765 6.395 -18.532 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -15.296 4.734 -19.158 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -16.345 3.943 -17.977 1.00 0.00 H new ATOM 241 N ASP A 18 -14.345 7.219 -13.613 1.00 0.00 N ATOM 242 CA ASP A 18 -14.960 6.706 -12.361 1.00 0.00 C ATOM 243 C ASP A 18 -14.175 7.251 -11.161 1.00 0.00 C ATOM 244 O ASP A 18 -13.299 8.097 -11.317 1.00 0.00 O ATOM 245 CB ASP A 18 -14.997 5.182 -12.381 1.00 0.00 C ATOM 246 CG ASP A 18 -16.210 4.645 -11.574 1.00 0.00 C ATOM 247 OD1 ASP A 18 -17.202 5.359 -11.443 1.00 0.00 O ATOM 248 OD2 ASP A 18 -16.130 3.520 -11.118 1.00 0.00 O ATOM 0 H ASP A 18 -13.332 7.109 -13.658 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.991 7.048 -12.277 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.056 4.829 -13.411 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.072 4.787 -11.961 1.00 0.00 H new ATOM 253 N ALA A 19 -14.535 6.837 -9.967 1.00 0.00 N ATOM 254 CA ALA A 19 -13.890 7.387 -8.731 1.00 0.00 C ATOM 255 C ALA A 19 -14.317 6.575 -7.533 1.00 0.00 C ATOM 256 O ALA A 19 -15.506 6.374 -7.363 1.00 0.00 O ATOM 257 CB ALA A 19 -14.434 8.742 -8.571 1.00 0.00 C ATOM 0 H ALA A 19 -15.255 6.135 -9.796 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.803 7.370 -8.809 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -14.003 9.204 -7.683 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -14.186 9.340 -9.448 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -15.517 8.689 -8.463 1.00 0.00 H new ATOM 263 N ALA A 20 -13.402 6.107 -6.679 1.00 0.00 N ATOM 264 CA ALA A 20 -13.905 5.322 -5.473 1.00 0.00 C ATOM 265 C ALA A 20 -13.179 5.626 -4.182 1.00 0.00 C ATOM 266 O ALA A 20 -12.080 5.166 -3.946 1.00 0.00 O ATOM 267 CB ALA A 20 -13.815 3.840 -5.702 1.00 0.00 C ATOM 0 H ALA A 20 -12.392 6.224 -6.755 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.941 5.644 -5.366 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.182 3.313 -4.821 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.421 3.568 -6.566 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.777 3.562 -5.884 1.00 0.00 H new ATOM 273 N ILE A 21 -13.867 6.284 -3.287 1.00 0.00 N ATOM 274 CA ILE A 21 -13.320 6.506 -1.926 1.00 0.00 C ATOM 275 C ILE A 21 -13.866 5.311 -1.181 1.00 0.00 C ATOM 276 O ILE A 21 -15.062 5.175 -1.083 1.00 0.00 O ATOM 277 CB ILE A 21 -13.839 7.808 -1.336 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.435 8.952 -2.288 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.219 8.017 0.075 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.670 10.306 -1.628 1.00 0.00 C ATOM 0 H ILE A 21 -14.794 6.679 -3.447 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.234 6.592 -1.889 1.00 0.00 H new ATOM 0 HB ILE A 21 -14.924 7.786 -1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.385 8.852 -2.561 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -14.012 8.886 -3.211 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.589 8.950 0.501 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.500 7.186 0.722 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.133 8.062 -0.008 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.379 11.101 -2.315 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.726 10.411 -1.378 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.073 10.376 -0.719 1.00 0.00 H new ATOM 292 N VAL A 22 -13.029 4.382 -0.754 1.00 0.00 N ATOM 293 CA VAL A 22 -13.560 3.133 -0.137 1.00 0.00 C ATOM 294 C VAL A 22 -13.037 2.924 1.281 1.00 0.00 C ATOM 295 O VAL A 22 -11.870 2.673 1.458 1.00 0.00 O ATOM 296 CB VAL A 22 -13.091 1.941 -0.998 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.712 0.633 -0.472 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.507 2.169 -2.464 1.00 0.00 C ATOM 0 H VAL A 22 -12.012 4.442 -0.810 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.646 3.210 -0.091 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.005 1.862 -0.940 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.375 -0.202 -1.086 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.402 0.473 0.561 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.799 0.702 -0.518 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -13.175 1.327 -3.071 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.592 2.256 -2.525 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.048 3.086 -2.834 1.00 0.00 H new ATOM 308 N GLY A 23 -13.916 2.957 2.282 1.00 0.00 N ATOM 309 CA GLY A 23 -13.477 2.672 3.700 1.00 0.00 C ATOM 310 C GLY A 23 -13.076 1.182 3.746 1.00 0.00 C ATOM 311 O GLY A 23 -13.877 0.316 4.064 1.00 0.00 O ATOM 0 H GLY A 23 -14.908 3.168 2.173 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.638 3.308 3.981 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.283 2.878 4.404 1.00 0.00 H new ATOM 315 N TYR A 24 -11.844 0.900 3.376 1.00 0.00 N ATOM 316 CA TYR A 24 -11.316 -0.504 3.306 1.00 0.00 C ATOM 317 C TYR A 24 -10.856 -1.027 4.713 1.00 0.00 C ATOM 318 O TYR A 24 -9.922 -1.818 4.799 1.00 0.00 O ATOM 319 CB TYR A 24 -10.119 -0.509 2.289 1.00 0.00 C ATOM 320 CG TYR A 24 -8.829 -0.080 2.977 1.00 0.00 C ATOM 321 CD1 TYR A 24 -8.798 1.046 3.820 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.691 -0.839 2.796 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.618 1.396 4.470 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.509 -0.495 3.436 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.468 0.628 4.279 1.00 0.00 C ATOM 326 OH TYR A 24 -5.295 0.972 4.923 1.00 0.00 O ATOM 0 H TYR A 24 -11.162 1.611 3.111 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.107 -1.177 2.974 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.998 -1.506 1.867 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.336 0.164 1.460 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -9.690 1.639 3.963 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.721 -1.706 2.152 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.592 2.258 5.120 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.621 -1.091 3.286 1.00 0.00 H new ATOM 0 HH TYR A 24 -4.638 0.253 4.813 1.00 0.00 H new ATOM 336 N LYS A 25 -11.506 -0.597 5.794 1.00 0.00 N ATOM 337 CA LYS A 25 -11.130 -1.062 7.159 1.00 0.00 C ATOM 338 C LYS A 25 -11.369 -2.574 7.234 1.00 0.00 C ATOM 339 O LYS A 25 -11.336 -3.253 6.217 1.00 0.00 O ATOM 340 CB LYS A 25 -11.987 -0.311 8.165 1.00 0.00 C ATOM 341 CG LYS A 25 -11.416 1.093 8.368 1.00 0.00 C ATOM 342 CD LYS A 25 -11.796 1.965 7.197 1.00 0.00 C ATOM 343 CE LYS A 25 -11.747 3.424 7.639 1.00 0.00 C ATOM 344 NZ LYS A 25 -12.688 3.639 8.786 1.00 0.00 N ATOM 0 H LYS A 25 -12.285 0.061 5.770 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.081 -0.867 7.381 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.016 -0.250 7.810 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.009 -0.848 9.113 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.799 1.522 9.294 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.331 1.046 8.463 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.112 1.799 6.364 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.795 1.710 6.844 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.732 3.690 7.935 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.018 4.075 6.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.210 4.527 8.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.360 2.847 8.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.148 3.692 9.673 1.00 0.00 H new ATOM 358 N ASP A 26 -11.612 -3.110 8.421 1.00 0.00 N ATOM 359 CA ASP A 26 -11.881 -4.619 8.588 1.00 0.00 C ATOM 360 C ASP A 26 -12.801 -5.089 7.462 1.00 0.00 C ATOM 361 O ASP A 26 -12.445 -5.942 6.658 1.00 0.00 O ATOM 362 CB ASP A 26 -12.551 -4.918 9.935 1.00 0.00 C ATOM 363 CG ASP A 26 -13.449 -3.753 10.399 1.00 0.00 C ATOM 364 OD1 ASP A 26 -12.922 -2.814 10.971 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.648 -3.835 10.188 1.00 0.00 O ATOM 0 H ASP A 26 -11.639 -2.578 9.291 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.927 -5.145 8.552 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -13.148 -5.826 9.850 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.786 -5.109 10.687 1.00 0.00 H new ATOM 370 N SER A 27 -13.952 -4.478 7.382 1.00 0.00 N ATOM 371 CA SER A 27 -14.912 -4.765 6.319 1.00 0.00 C ATOM 372 C SER A 27 -14.884 -3.539 5.387 1.00 0.00 C ATOM 373 O SER A 27 -15.035 -2.424 5.866 1.00 0.00 O ATOM 374 CB SER A 27 -16.287 -4.940 6.923 1.00 0.00 C ATOM 375 OG SER A 27 -16.511 -3.939 7.913 1.00 0.00 O ATOM 0 H SER A 27 -14.262 -3.767 8.044 1.00 0.00 H new ATOM 0 HA SER A 27 -14.668 -5.678 5.775 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.047 -4.871 6.145 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.375 -5.931 7.368 1.00 0.00 H new ATOM 0 HG SER A 27 -16.090 -3.100 7.631 1.00 0.00 H new ATOM 381 N PRO A 28 -14.641 -3.756 4.089 1.00 0.00 N ATOM 382 CA PRO A 28 -14.530 -2.668 3.140 1.00 0.00 C ATOM 383 C PRO A 28 -15.889 -2.168 2.739 1.00 0.00 C ATOM 384 O PRO A 28 -16.869 -2.903 2.758 1.00 0.00 O ATOM 385 CB PRO A 28 -13.784 -3.274 1.965 1.00 0.00 C ATOM 386 CG PRO A 28 -13.981 -4.795 2.075 1.00 0.00 C ATOM 387 CD PRO A 28 -14.483 -5.083 3.479 1.00 0.00 C ATOM 0 HA PRO A 28 -14.011 -1.801 3.549 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.174 -2.898 1.019 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.726 -3.014 1.999 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.697 -5.145 1.331 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.044 -5.319 1.887 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.428 -5.627 3.460 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.774 -5.695 4.037 1.00 0.00 H new ATOM 395 N SER A 29 -15.952 -0.910 2.375 1.00 0.00 N ATOM 396 CA SER A 29 -17.211 -0.294 1.966 1.00 0.00 C ATOM 397 C SER A 29 -16.897 0.878 1.079 1.00 0.00 C ATOM 398 O SER A 29 -15.795 1.405 1.099 1.00 0.00 O ATOM 399 CB SER A 29 -17.978 0.180 3.196 1.00 0.00 C ATOM 400 OG SER A 29 -17.139 1.037 3.966 1.00 0.00 O ATOM 0 H SER A 29 -15.148 -0.283 2.351 1.00 0.00 H new ATOM 0 HA SER A 29 -17.825 -1.017 1.429 1.00 0.00 H new ATOM 0 HB2 SER A 29 -18.882 0.710 2.895 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.294 -0.674 3.795 1.00 0.00 H new ATOM 0 HG SER A 29 -17.228 1.958 3.643 1.00 0.00 H new ATOM 406 N VAL A 30 -17.846 1.283 0.298 1.00 0.00 N ATOM 407 CA VAL A 30 -17.641 2.404 -0.611 1.00 0.00 C ATOM 408 C VAL A 30 -18.025 3.708 0.104 1.00 0.00 C ATOM 409 O VAL A 30 -19.193 4.050 0.223 1.00 0.00 O ATOM 410 CB VAL A 30 -18.482 2.139 -1.858 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.579 3.390 -2.721 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.805 1.007 -2.660 1.00 0.00 C ATOM 0 H VAL A 30 -18.776 0.866 0.259 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.599 2.508 -0.913 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.492 1.853 -1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -19.183 3.177 -3.603 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -19.044 4.192 -2.148 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.580 3.697 -3.030 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.387 0.798 -3.557 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.798 1.314 -2.944 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.750 0.108 -2.046 1.00 0.00 H new ATOM 422 N TRP A 31 -17.024 4.420 0.577 1.00 0.00 N ATOM 423 CA TRP A 31 -17.245 5.702 1.295 1.00 0.00 C ATOM 424 C TRP A 31 -17.753 6.761 0.315 1.00 0.00 C ATOM 425 O TRP A 31 -18.335 7.759 0.719 1.00 0.00 O ATOM 426 CB TRP A 31 -15.904 6.144 1.921 1.00 0.00 C ATOM 427 CG TRP A 31 -15.763 5.545 3.298 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.515 4.525 3.793 1.00 0.00 C ATOM 429 CD2 TRP A 31 -14.832 5.903 4.358 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.126 4.261 5.068 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.087 5.078 5.474 1.00 0.00 C ATOM 432 CE3 TRP A 31 -13.802 6.861 4.463 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.358 5.199 6.654 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.065 6.983 5.649 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.345 6.154 6.743 1.00 0.00 C ATOM 0 H TRP A 31 -16.044 4.152 0.488 1.00 0.00 H new ATOM 0 HA TRP A 31 -17.992 5.576 2.079 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.075 5.826 1.289 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -15.861 7.231 1.981 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.297 4.007 3.258 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -16.551 3.544 5.656 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.580 7.504 3.624 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -14.575 4.558 7.495 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.278 7.719 5.720 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -12.776 6.254 7.656 1.00 0.00 H new ATOM 446 N ALA A 32 -17.561 6.536 -0.989 1.00 0.00 N ATOM 447 CA ALA A 32 -18.059 7.506 -2.025 1.00 0.00 C ATOM 448 C ALA A 32 -17.544 7.121 -3.419 1.00 0.00 C ATOM 449 O ALA A 32 -16.587 7.701 -3.927 1.00 0.00 O ATOM 450 CB ALA A 32 -17.604 8.932 -1.683 1.00 0.00 C ATOM 0 H ALA A 32 -17.080 5.719 -1.366 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.148 7.469 -2.029 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -17.972 9.623 -2.442 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.002 9.217 -0.709 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.515 8.970 -1.655 1.00 0.00 H new ATOM 456 N ALA A 33 -18.203 6.172 -4.060 1.00 0.00 N ATOM 457 CA ALA A 33 -17.804 5.774 -5.433 1.00 0.00 C ATOM 458 C ALA A 33 -18.893 6.217 -6.359 1.00 0.00 C ATOM 459 O ALA A 33 -20.058 5.944 -6.108 1.00 0.00 O ATOM 460 CB ALA A 33 -17.656 4.259 -5.568 1.00 0.00 C ATOM 0 H ALA A 33 -19.000 5.663 -3.679 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.842 6.231 -5.666 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -17.363 4.012 -6.588 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.893 3.905 -4.875 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.607 3.779 -5.337 1.00 0.00 H new ATOM 466 N VAL A 34 -18.542 6.888 -7.448 1.00 0.00 N ATOM 467 CA VAL A 34 -19.590 7.353 -8.449 1.00 0.00 C ATOM 468 C VAL A 34 -20.533 6.137 -8.743 1.00 0.00 C ATOM 469 O VAL A 34 -20.130 5.214 -9.428 1.00 0.00 O ATOM 470 CB VAL A 34 -18.900 7.842 -9.750 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.961 8.340 -10.731 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.956 9.004 -9.421 1.00 0.00 C ATOM 0 H VAL A 34 -17.582 7.134 -7.688 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.167 8.186 -8.049 1.00 0.00 H new ATOM 0 HB VAL A 34 -18.339 7.018 -10.191 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.478 8.684 -11.646 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.648 7.528 -10.967 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.514 9.164 -10.281 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.471 9.348 -10.334 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.526 9.823 -8.982 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.199 8.668 -8.712 1.00 0.00 H new ATOM 482 N PRO A 35 -21.749 6.141 -8.135 1.00 0.00 N ATOM 483 CA PRO A 35 -22.685 5.010 -8.254 1.00 0.00 C ATOM 484 C PRO A 35 -23.252 4.860 -9.656 1.00 0.00 C ATOM 485 O PRO A 35 -23.421 5.826 -10.389 1.00 0.00 O ATOM 486 CB PRO A 35 -23.785 5.317 -7.219 1.00 0.00 C ATOM 487 CG PRO A 35 -23.713 6.839 -6.942 1.00 0.00 C ATOM 488 CD PRO A 35 -22.281 7.277 -7.323 1.00 0.00 C ATOM 0 HA PRO A 35 -22.190 4.057 -8.067 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.767 5.038 -7.602 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.626 4.748 -6.303 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.455 7.378 -7.531 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -23.921 7.055 -5.894 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.288 8.205 -7.895 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.670 7.453 -6.437 1.00 0.00 H new ATOM 496 N GLY A 36 -23.545 3.622 -10.023 1.00 0.00 N ATOM 497 CA GLY A 36 -24.108 3.322 -11.367 1.00 0.00 C ATOM 498 C GLY A 36 -23.008 2.790 -12.303 1.00 0.00 C ATOM 499 O GLY A 36 -23.311 2.265 -13.365 1.00 0.00 O ATOM 0 H GLY A 36 -23.411 2.804 -9.429 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -24.906 2.585 -11.278 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -24.552 4.222 -11.792 1.00 0.00 H new ATOM 503 N LYS A 37 -21.727 2.947 -11.935 1.00 0.00 N ATOM 504 CA LYS A 37 -20.615 2.472 -12.831 1.00 0.00 C ATOM 505 C LYS A 37 -20.083 1.070 -12.427 1.00 0.00 C ATOM 506 O LYS A 37 -20.493 0.071 -13.005 1.00 0.00 O ATOM 507 CB LYS A 37 -19.472 3.486 -12.793 1.00 0.00 C ATOM 508 CG LYS A 37 -19.721 4.565 -13.856 1.00 0.00 C ATOM 509 CD LYS A 37 -20.273 5.831 -13.189 1.00 0.00 C ATOM 510 CE LYS A 37 -20.928 6.728 -14.245 1.00 0.00 C ATOM 511 NZ LYS A 37 -22.411 6.638 -14.125 1.00 0.00 N ATOM 0 H LYS A 37 -21.423 3.379 -11.062 1.00 0.00 H new ATOM 0 HA LYS A 37 -21.018 2.385 -13.840 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -19.405 3.941 -11.805 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -18.521 2.987 -12.979 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -18.793 4.794 -14.380 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -20.426 4.198 -14.602 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -21.001 5.562 -12.424 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -19.469 6.370 -12.688 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.604 7.760 -14.112 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.614 6.421 -15.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -22.855 7.247 -14.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -22.712 5.654 -14.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -22.702 6.951 -13.177 1.00 0.00 H new ATOM 525 N THR A 38 -19.130 0.993 -11.478 1.00 0.00 N ATOM 526 CA THR A 38 -18.535 -0.362 -11.109 1.00 0.00 C ATOM 527 C THR A 38 -17.813 -0.336 -9.724 1.00 0.00 C ATOM 528 O THR A 38 -17.798 -1.330 -9.016 1.00 0.00 O ATOM 529 CB THR A 38 -17.525 -0.719 -12.244 1.00 0.00 C ATOM 530 OG1 THR A 38 -18.239 -1.226 -13.359 1.00 0.00 O ATOM 531 CG2 THR A 38 -16.457 -1.766 -11.802 1.00 0.00 C ATOM 0 H THR A 38 -18.754 1.789 -10.962 1.00 0.00 H new ATOM 0 HA THR A 38 -19.326 -1.106 -11.018 1.00 0.00 H new ATOM 0 HB THR A 38 -16.992 0.196 -12.501 1.00 0.00 H new ATOM 0 HG1 THR A 38 -19.202 -1.145 -13.195 1.00 0.00 H new ATOM 0 HG21 THR A 38 -15.784 -1.973 -12.634 1.00 0.00 H new ATOM 0 HG22 THR A 38 -15.885 -1.370 -10.963 1.00 0.00 H new ATOM 0 HG23 THR A 38 -16.954 -2.688 -11.500 1.00 0.00 H new ATOM 539 N PHE A 39 -17.175 0.763 -9.391 1.00 0.00 N ATOM 540 CA PHE A 39 -16.377 0.862 -8.102 1.00 0.00 C ATOM 541 C PHE A 39 -17.223 0.717 -6.871 1.00 0.00 C ATOM 542 O PHE A 39 -16.796 0.130 -5.899 1.00 0.00 O ATOM 543 CB PHE A 39 -15.743 2.200 -8.053 1.00 0.00 C ATOM 544 CG PHE A 39 -14.685 2.354 -9.147 1.00 0.00 C ATOM 545 CD1 PHE A 39 -14.466 1.347 -10.130 1.00 0.00 C ATOM 546 CD2 PHE A 39 -13.926 3.508 -9.180 1.00 0.00 C ATOM 547 CE1 PHE A 39 -13.515 1.528 -11.103 1.00 0.00 C ATOM 548 CE2 PHE A 39 -12.977 3.678 -10.150 1.00 0.00 C ATOM 549 CZ PHE A 39 -12.767 2.681 -11.124 1.00 0.00 C ATOM 0 H PHE A 39 -17.167 1.611 -9.958 1.00 0.00 H new ATOM 0 HA PHE A 39 -15.652 0.048 -8.107 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -16.505 2.970 -8.170 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -15.284 2.352 -7.076 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -15.050 0.439 -10.110 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -14.082 4.277 -8.438 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.355 0.766 -11.851 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -12.385 4.581 -10.170 1.00 0.00 H new ATOM 0 HZ PHE A 39 -12.017 2.823 -11.888 1.00 0.00 H new ATOM 559 N VAL A 40 -18.399 1.270 -6.898 1.00 0.00 N ATOM 560 CA VAL A 40 -19.322 1.203 -5.722 1.00 0.00 C ATOM 561 C VAL A 40 -19.622 -0.280 -5.407 1.00 0.00 C ATOM 562 O VAL A 40 -20.020 -0.616 -4.296 1.00 0.00 O ATOM 563 CB VAL A 40 -20.603 1.998 -6.036 1.00 0.00 C ATOM 564 CG1 VAL A 40 -21.122 1.615 -7.417 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.667 1.724 -4.964 1.00 0.00 C ATOM 0 H VAL A 40 -18.773 1.778 -7.700 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.863 1.650 -4.840 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.376 3.064 -6.032 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -22.028 2.180 -7.635 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -20.364 1.842 -8.167 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -21.345 0.548 -7.439 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -22.569 2.290 -5.194 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.901 0.660 -4.947 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -21.287 2.027 -3.988 1.00 0.00 H new ATOM 575 N ASN A 41 -19.384 -1.172 -6.366 1.00 0.00 N ATOM 576 CA ASN A 41 -19.585 -2.608 -6.140 1.00 0.00 C ATOM 577 C ASN A 41 -18.258 -3.197 -5.587 1.00 0.00 C ATOM 578 O ASN A 41 -17.975 -4.378 -5.756 1.00 0.00 O ATOM 579 CB ASN A 41 -19.922 -3.256 -7.478 1.00 0.00 C ATOM 580 CG ASN A 41 -21.287 -2.757 -7.967 1.00 0.00 C ATOM 581 OD1 ASN A 41 -22.314 -3.237 -7.530 1.00 0.00 O ATOM 582 ND2 ASN A 41 -21.340 -1.811 -8.865 1.00 0.00 N ATOM 0 H ASN A 41 -19.054 -0.932 -7.301 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.393 -2.791 -5.431 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.153 -3.017 -8.212 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.937 -4.341 -7.374 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -22.243 -1.475 -9.199 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -20.478 -1.408 -9.232 1.00 0.00 H new ATOM 589 N ILE A 42 -17.432 -2.358 -4.932 1.00 0.00 N ATOM 590 CA ILE A 42 -16.138 -2.812 -4.383 1.00 0.00 C ATOM 591 C ILE A 42 -16.402 -3.642 -3.093 1.00 0.00 C ATOM 592 O ILE A 42 -17.153 -3.251 -2.215 1.00 0.00 O ATOM 593 CB ILE A 42 -15.249 -1.530 -4.134 1.00 0.00 C ATOM 594 CG1 ILE A 42 -14.443 -1.253 -5.429 1.00 0.00 C ATOM 595 CG2 ILE A 42 -14.269 -1.683 -2.923 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.872 0.172 -5.428 1.00 0.00 C ATOM 0 H ILE A 42 -17.634 -1.371 -4.771 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.599 -3.465 -5.069 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.911 -0.701 -3.885 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.630 -1.974 -5.517 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.086 -1.390 -6.298 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.688 -0.768 -2.807 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.841 -1.868 -2.013 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.595 -2.520 -3.104 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.311 0.340 -6.347 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.689 0.891 -5.365 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.210 0.298 -4.571 1.00 0.00 H new ATOM 608 N THR A 43 -15.777 -4.784 -3.028 1.00 0.00 N ATOM 609 CA THR A 43 -15.912 -5.748 -1.867 1.00 0.00 C ATOM 610 C THR A 43 -14.493 -6.049 -1.316 1.00 0.00 C ATOM 611 O THR A 43 -13.545 -5.613 -1.898 1.00 0.00 O ATOM 612 CB THR A 43 -16.538 -7.046 -2.437 1.00 0.00 C ATOM 613 OG1 THR A 43 -16.016 -7.304 -3.740 1.00 0.00 O ATOM 614 CG2 THR A 43 -18.039 -6.874 -2.529 1.00 0.00 C ATOM 0 H THR A 43 -15.147 -5.114 -3.759 1.00 0.00 H new ATOM 0 HA THR A 43 -16.529 -5.341 -1.066 1.00 0.00 H new ATOM 0 HB THR A 43 -16.297 -7.882 -1.780 1.00 0.00 H new ATOM 0 HG1 THR A 43 -16.414 -8.126 -4.095 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.486 -7.784 -2.929 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.444 -6.677 -1.536 1.00 0.00 H new ATOM 0 HG23 THR A 43 -18.270 -6.037 -3.187 1.00 0.00 H new ATOM 622 N PRO A 44 -14.371 -6.835 -0.217 1.00 0.00 N ATOM 623 CA PRO A 44 -13.037 -7.195 0.337 1.00 0.00 C ATOM 624 C PRO A 44 -12.256 -8.157 -0.571 1.00 0.00 C ATOM 625 O PRO A 44 -11.141 -8.557 -0.247 1.00 0.00 O ATOM 626 CB PRO A 44 -13.340 -7.829 1.671 1.00 0.00 C ATOM 627 CG PRO A 44 -14.824 -8.288 1.623 1.00 0.00 C ATOM 628 CD PRO A 44 -15.507 -7.413 0.548 1.00 0.00 C ATOM 0 HA PRO A 44 -12.396 -6.318 0.423 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.679 -8.676 1.856 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.181 -7.118 2.482 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.897 -9.346 1.369 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -15.304 -8.159 2.593 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -16.160 -8.005 -0.093 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -16.123 -6.634 0.999 1.00 0.00 H new ATOM 636 N ALA A 45 -12.807 -8.493 -1.702 1.00 0.00 N ATOM 637 CA ALA A 45 -12.109 -9.391 -2.671 1.00 0.00 C ATOM 638 C ALA A 45 -11.251 -8.518 -3.572 1.00 0.00 C ATOM 639 O ALA A 45 -9.992 -8.554 -3.547 1.00 0.00 O ATOM 640 CB ALA A 45 -13.153 -10.122 -3.513 1.00 0.00 C ATOM 0 H ALA A 45 -13.729 -8.179 -2.004 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.493 -10.124 -2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.652 -10.780 -4.223 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.796 -10.714 -2.862 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.757 -9.395 -4.056 1.00 0.00 H new ATOM 646 N GLU A 46 -11.917 -7.711 -4.346 1.00 0.00 N ATOM 647 CA GLU A 46 -11.216 -6.778 -5.266 1.00 0.00 C ATOM 648 C GLU A 46 -10.362 -5.794 -4.406 1.00 0.00 C ATOM 649 O GLU A 46 -9.296 -5.366 -4.813 1.00 0.00 O ATOM 650 CB GLU A 46 -12.253 -6.050 -6.165 1.00 0.00 C ATOM 651 CG GLU A 46 -13.303 -5.323 -5.323 1.00 0.00 C ATOM 652 CD GLU A 46 -12.683 -4.086 -4.684 1.00 0.00 C ATOM 653 OE1 GLU A 46 -12.015 -3.356 -5.380 1.00 0.00 O ATOM 654 OE2 GLU A 46 -12.849 -3.919 -3.506 1.00 0.00 O ATOM 0 H GLU A 46 -12.935 -7.658 -4.380 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.544 -7.313 -5.937 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.741 -5.335 -6.809 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.743 -6.773 -6.817 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -14.149 -5.036 -5.948 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.688 -5.989 -4.551 1.00 0.00 H new ATOM 661 N VAL A 47 -10.814 -5.514 -3.171 1.00 0.00 N ATOM 662 CA VAL A 47 -10.036 -4.664 -2.214 1.00 0.00 C ATOM 663 C VAL A 47 -8.959 -5.518 -1.544 1.00 0.00 C ATOM 664 O VAL A 47 -7.964 -5.004 -1.101 1.00 0.00 O ATOM 665 CB VAL A 47 -11.003 -3.942 -1.209 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.424 -3.813 0.147 1.00 0.00 C ATOM 667 CG2 VAL A 47 -11.145 -2.476 -1.635 1.00 0.00 C ATOM 0 H VAL A 47 -11.703 -5.853 -2.802 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.518 -3.863 -2.742 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.922 -4.528 -1.207 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.135 -3.307 0.800 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.207 -4.804 0.546 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.502 -3.233 0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.814 -1.960 -0.946 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.167 -1.996 -1.618 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.555 -2.428 -2.644 1.00 0.00 H new ATOM 677 N GLY A 48 -9.148 -6.826 -1.500 1.00 0.00 N ATOM 678 CA GLY A 48 -8.115 -7.730 -0.897 1.00 0.00 C ATOM 679 C GLY A 48 -6.809 -7.552 -1.638 1.00 0.00 C ATOM 680 O GLY A 48 -5.745 -7.687 -1.063 1.00 0.00 O ATOM 0 H GLY A 48 -9.977 -7.301 -1.858 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.983 -7.498 0.160 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.443 -8.768 -0.956 1.00 0.00 H new ATOM 684 N VAL A 49 -6.887 -7.248 -2.918 1.00 0.00 N ATOM 685 CA VAL A 49 -5.621 -7.037 -3.735 1.00 0.00 C ATOM 686 C VAL A 49 -5.253 -5.548 -3.793 1.00 0.00 C ATOM 687 O VAL A 49 -4.086 -5.185 -3.696 1.00 0.00 O ATOM 688 CB VAL A 49 -5.771 -7.595 -5.162 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.764 -6.760 -5.982 1.00 0.00 C ATOM 690 CG2 VAL A 49 -4.406 -7.552 -5.841 1.00 0.00 C ATOM 0 H VAL A 49 -7.759 -7.136 -3.435 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.819 -7.582 -3.238 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.148 -8.616 -5.105 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.849 -7.178 -6.985 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.740 -6.777 -5.498 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.408 -5.732 -6.046 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.491 -7.944 -6.855 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.051 -6.522 -5.879 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.699 -8.159 -5.276 1.00 0.00 H new ATOM 700 N LEU A 50 -6.240 -4.699 -3.918 1.00 0.00 N ATOM 701 CA LEU A 50 -6.008 -3.226 -3.949 1.00 0.00 C ATOM 702 C LEU A 50 -5.323 -2.778 -2.671 1.00 0.00 C ATOM 703 O LEU A 50 -4.722 -1.707 -2.613 1.00 0.00 O ATOM 704 CB LEU A 50 -7.361 -2.550 -3.995 1.00 0.00 C ATOM 705 CG LEU A 50 -7.852 -2.272 -5.389 1.00 0.00 C ATOM 706 CD1 LEU A 50 -9.302 -1.793 -5.283 1.00 0.00 C ATOM 707 CD2 LEU A 50 -7.025 -1.163 -5.996 1.00 0.00 C ATOM 0 H LEU A 50 -7.219 -4.973 -4.002 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.389 -2.972 -4.810 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -8.089 -3.179 -3.482 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -7.307 -1.611 -3.445 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.776 -3.167 -6.006 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.689 -1.582 -6.280 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.908 -2.569 -4.815 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.343 -0.887 -4.679 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.377 -0.958 -7.007 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.121 -0.263 -5.389 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.979 -1.467 -6.031 1.00 0.00 H new ATOM 719 N VAL A 51 -5.486 -3.551 -1.635 1.00 0.00 N ATOM 720 CA VAL A 51 -4.953 -3.179 -0.307 1.00 0.00 C ATOM 721 C VAL A 51 -4.175 -4.356 0.329 1.00 0.00 C ATOM 722 O VAL A 51 -3.471 -4.172 1.311 1.00 0.00 O ATOM 723 CB VAL A 51 -6.176 -2.718 0.567 1.00 0.00 C ATOM 724 CG1 VAL A 51 -7.138 -1.885 -0.300 1.00 0.00 C ATOM 725 CG2 VAL A 51 -6.951 -3.927 1.147 1.00 0.00 C ATOM 0 H VAL A 51 -5.978 -4.444 -1.659 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.233 -2.364 -0.385 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.789 -2.125 1.396 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.987 -1.564 0.304 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.615 -1.010 -0.685 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.494 -2.491 -1.133 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.789 -3.569 1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.326 -4.545 0.331 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.285 -4.519 1.774 1.00 0.00 H new ATOM 735 N GLY A 52 -4.300 -5.566 -0.241 1.00 0.00 N ATOM 736 CA GLY A 52 -3.583 -6.773 0.281 1.00 0.00 C ATOM 737 C GLY A 52 -2.151 -6.430 0.682 1.00 0.00 C ATOM 738 O GLY A 52 -1.519 -5.547 0.117 1.00 0.00 O ATOM 0 H GLY A 52 -4.883 -5.748 -1.058 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.119 -7.174 1.141 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -3.574 -7.552 -0.481 1.00 0.00 H new ATOM 822 N PHE A 58 0.351 -8.953 -7.044 1.00 0.00 N ATOM 823 CA PHE A 58 -0.517 -8.002 -7.859 1.00 0.00 C ATOM 824 C PHE A 58 0.222 -6.863 -8.552 1.00 0.00 C ATOM 825 O PHE A 58 -0.306 -6.308 -9.504 1.00 0.00 O ATOM 826 CB PHE A 58 -1.680 -7.466 -7.044 1.00 0.00 C ATOM 827 CG PHE A 58 -1.233 -6.777 -5.782 1.00 0.00 C ATOM 828 CD1 PHE A 58 -1.038 -7.513 -4.606 1.00 0.00 C ATOM 829 CD2 PHE A 58 -1.051 -5.392 -5.778 1.00 0.00 C ATOM 830 CE1 PHE A 58 -0.660 -6.857 -3.429 1.00 0.00 C ATOM 831 CE2 PHE A 58 -0.670 -4.742 -4.605 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.474 -5.474 -3.431 1.00 0.00 C ATOM 0 HA PHE A 58 -0.895 -8.627 -8.668 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.253 -6.766 -7.652 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.349 -8.288 -6.788 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -1.179 -8.584 -4.608 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.205 -4.825 -6.684 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -0.512 -7.421 -2.520 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -0.526 -3.672 -4.604 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.178 -4.969 -2.524 1.00 0.00 H new ATOM 842 N TYR A 59 1.408 -6.468 -8.117 1.00 0.00 N ATOM 843 CA TYR A 59 2.103 -5.331 -8.826 1.00 0.00 C ATOM 844 C TYR A 59 2.386 -5.646 -10.293 1.00 0.00 C ATOM 845 O TYR A 59 2.855 -4.783 -11.025 1.00 0.00 O ATOM 846 CB TYR A 59 3.413 -4.936 -8.128 1.00 0.00 C ATOM 847 CG TYR A 59 3.173 -4.629 -6.676 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.181 -3.728 -6.317 1.00 0.00 C ATOM 849 CD2 TYR A 59 3.966 -5.226 -5.696 1.00 0.00 C ATOM 850 CE1 TYR A 59 1.971 -3.420 -4.969 1.00 0.00 C ATOM 851 CE2 TYR A 59 3.757 -4.926 -4.349 1.00 0.00 C ATOM 852 CZ TYR A 59 2.759 -4.022 -3.984 1.00 0.00 C ATOM 853 OH TYR A 59 2.554 -3.721 -2.653 1.00 0.00 O ATOM 0 H TYR A 59 1.911 -6.870 -7.326 1.00 0.00 H new ATOM 0 HA TYR A 59 1.411 -4.490 -8.782 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.137 -5.746 -8.218 1.00 0.00 H new ATOM 0 HB3 TYR A 59 3.845 -4.066 -8.622 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.571 -3.265 -7.078 1.00 0.00 H new ATOM 0 HD2 TYR A 59 4.742 -5.921 -5.980 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.200 -2.717 -4.689 1.00 0.00 H new ATOM 0 HE2 TYR A 59 4.367 -5.393 -3.590 1.00 0.00 H new ATOM 0 HH TYR A 59 3.187 -4.227 -2.102 1.00 0.00 H new ATOM 863 N VAL A 60 2.136 -6.857 -10.726 1.00 0.00 N ATOM 864 CA VAL A 60 2.413 -7.240 -12.124 1.00 0.00 C ATOM 865 C VAL A 60 1.159 -7.795 -12.809 1.00 0.00 C ATOM 866 O VAL A 60 0.989 -7.617 -14.015 1.00 0.00 O ATOM 867 CB VAL A 60 3.508 -8.298 -12.139 1.00 0.00 C ATOM 868 CG1 VAL A 60 4.865 -7.603 -12.085 1.00 0.00 C ATOM 869 CG2 VAL A 60 3.374 -9.255 -10.931 1.00 0.00 C ATOM 0 H VAL A 60 1.744 -7.602 -10.150 1.00 0.00 H new ATOM 0 HA VAL A 60 2.732 -6.352 -12.670 1.00 0.00 H new ATOM 0 HB VAL A 60 3.415 -8.886 -13.052 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.658 -8.351 -12.095 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.973 -6.948 -12.950 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.935 -7.012 -11.172 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.169 -10.000 -10.967 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.453 -8.685 -10.005 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.406 -9.755 -10.968 1.00 0.00 H new ATOM 879 N ASN A 61 0.277 -8.479 -12.070 1.00 0.00 N ATOM 880 CA ASN A 61 -0.939 -9.043 -12.703 1.00 0.00 C ATOM 881 C ASN A 61 -2.023 -7.984 -12.765 1.00 0.00 C ATOM 882 O ASN A 61 -2.759 -7.904 -13.745 1.00 0.00 O ATOM 883 CB ASN A 61 -1.419 -10.278 -11.945 1.00 0.00 C ATOM 884 CG ASN A 61 -1.663 -9.981 -10.488 1.00 0.00 C ATOM 885 OD1 ASN A 61 -2.448 -9.118 -10.153 1.00 0.00 O ATOM 886 ND2 ASN A 61 -1.024 -10.686 -9.586 1.00 0.00 N ATOM 0 H ASN A 61 0.368 -8.656 -11.070 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.698 -9.354 -13.720 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.338 -10.649 -12.399 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -0.677 -11.071 -12.035 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -1.185 -10.511 -8.594 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.366 -11.409 -9.876 1.00 0.00 H new ATOM 893 N GLY A 62 -2.116 -7.142 -11.746 1.00 0.00 N ATOM 894 CA GLY A 62 -3.119 -6.063 -11.758 1.00 0.00 C ATOM 895 C GLY A 62 -4.048 -6.141 -10.553 1.00 0.00 C ATOM 896 O GLY A 62 -4.382 -7.216 -10.072 1.00 0.00 O ATOM 0 H GLY A 62 -1.528 -7.174 -10.913 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.614 -5.097 -11.766 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.706 -6.123 -12.674 1.00 0.00 H new ATOM 900 N LEU A 63 -4.497 -4.983 -10.092 1.00 0.00 N ATOM 901 CA LEU A 63 -5.466 -4.931 -8.922 1.00 0.00 C ATOM 902 C LEU A 63 -6.864 -5.192 -9.465 1.00 0.00 C ATOM 903 O LEU A 63 -7.007 -5.736 -10.549 1.00 0.00 O ATOM 904 CB LEU A 63 -5.450 -3.543 -8.224 1.00 0.00 C ATOM 905 CG LEU A 63 -4.079 -3.209 -7.681 1.00 0.00 C ATOM 906 CD1 LEU A 63 -4.097 -1.753 -7.178 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.774 -4.155 -6.526 1.00 0.00 C ATOM 0 H LEU A 63 -4.237 -4.073 -10.472 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.172 -5.679 -8.186 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.758 -2.775 -8.933 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -6.176 -3.536 -7.411 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.316 -3.319 -8.452 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.115 -1.493 -6.782 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.344 -1.086 -8.004 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.845 -1.649 -6.392 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.788 -3.929 -6.121 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.524 -4.030 -5.745 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.792 -5.184 -6.884 1.00 0.00 H new ATOM 919 N THR A 64 -7.899 -4.800 -8.720 1.00 0.00 N ATOM 920 CA THR A 64 -9.271 -5.015 -9.152 1.00 0.00 C ATOM 921 C THR A 64 -10.162 -4.079 -8.384 1.00 0.00 C ATOM 922 O THR A 64 -10.110 -4.017 -7.159 1.00 0.00 O ATOM 923 CB THR A 64 -9.677 -6.444 -8.850 1.00 0.00 C ATOM 924 OG1 THR A 64 -9.248 -6.784 -7.538 1.00 0.00 O ATOM 925 CG2 THR A 64 -9.021 -7.371 -9.851 1.00 0.00 C ATOM 0 H THR A 64 -7.808 -4.334 -7.817 1.00 0.00 H new ATOM 0 HA THR A 64 -9.359 -4.832 -10.223 1.00 0.00 H new ATOM 0 HB THR A 64 -10.760 -6.542 -8.917 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.295 -5.992 -6.963 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.310 -8.400 -9.638 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.342 -7.105 -10.858 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.938 -7.276 -9.779 1.00 0.00 H new ATOM 933 N LEU A 65 -10.967 -3.361 -9.089 1.00 0.00 N ATOM 934 CA LEU A 65 -11.914 -2.408 -8.454 1.00 0.00 C ATOM 935 C LEU A 65 -13.292 -2.547 -9.086 1.00 0.00 C ATOM 936 O LEU A 65 -13.555 -2.075 -10.176 1.00 0.00 O ATOM 937 CB LEU A 65 -11.395 -0.969 -8.513 1.00 0.00 C ATOM 938 CG LEU A 65 -10.491 -0.708 -9.731 1.00 0.00 C ATOM 939 CD1 LEU A 65 -11.261 -0.889 -11.019 1.00 0.00 C ATOM 940 CD2 LEU A 65 -9.963 0.725 -9.643 1.00 0.00 C ATOM 0 H LEU A 65 -11.015 -3.390 -10.107 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.999 -2.657 -7.396 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.242 -0.284 -8.542 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.839 -0.751 -7.601 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.665 -1.419 -9.727 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.602 -0.699 -11.866 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.641 -1.909 -11.076 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -12.096 -0.189 -11.045 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.319 0.929 -10.499 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.801 1.422 -9.645 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.392 0.846 -8.723 1.00 0.00 H new ATOM 952 N GLY A 66 -14.170 -3.236 -8.388 1.00 0.00 N ATOM 953 CA GLY A 66 -15.550 -3.475 -8.892 1.00 0.00 C ATOM 954 C GLY A 66 -15.495 -4.546 -9.976 1.00 0.00 C ATOM 955 O GLY A 66 -16.318 -4.567 -10.884 1.00 0.00 O ATOM 0 H GLY A 66 -13.977 -3.647 -7.475 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.200 -3.795 -8.077 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.971 -2.553 -9.293 1.00 0.00 H new ATOM 959 N GLY A 67 -14.510 -5.436 -9.893 1.00 0.00 N ATOM 960 CA GLY A 67 -14.365 -6.513 -10.909 1.00 0.00 C ATOM 961 C GLY A 67 -13.544 -6.002 -12.101 1.00 0.00 C ATOM 962 O GLY A 67 -13.424 -6.695 -13.106 1.00 0.00 O ATOM 0 H GLY A 67 -13.806 -5.448 -9.155 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.876 -7.380 -10.465 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -15.348 -6.840 -11.247 1.00 0.00 H new ATOM 966 N GLN A 68 -12.963 -4.784 -12.012 1.00 0.00 N ATOM 967 CA GLN A 68 -12.148 -4.265 -13.175 1.00 0.00 C ATOM 968 C GLN A 68 -10.658 -4.389 -12.858 1.00 0.00 C ATOM 969 O GLN A 68 -10.105 -3.635 -12.071 1.00 0.00 O ATOM 970 CB GLN A 68 -12.537 -2.821 -13.480 1.00 0.00 C ATOM 971 CG GLN A 68 -11.459 -2.068 -14.342 1.00 0.00 C ATOM 972 CD GLN A 68 -10.963 -2.952 -15.513 1.00 0.00 C ATOM 973 OE1 GLN A 68 -11.716 -3.730 -16.064 1.00 0.00 O ATOM 974 NE2 GLN A 68 -9.710 -2.857 -15.912 1.00 0.00 N ATOM 0 H GLN A 68 -13.025 -4.161 -11.206 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.355 -4.862 -14.063 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.490 -2.810 -14.009 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.686 -2.284 -12.543 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.884 -1.144 -14.735 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.615 -1.788 -13.711 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.076 -2.204 -15.451 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.375 -3.436 -16.682 1.00 0.00 H new ATOM 983 N LYS A 69 -10.024 -5.348 -13.476 1.00 0.00 N ATOM 984 CA LYS A 69 -8.585 -5.594 -13.264 1.00 0.00 C ATOM 985 C LYS A 69 -7.736 -4.456 -13.848 1.00 0.00 C ATOM 986 O LYS A 69 -7.572 -4.359 -15.060 1.00 0.00 O ATOM 987 CB LYS A 69 -8.214 -6.901 -13.971 1.00 0.00 C ATOM 988 CG LYS A 69 -7.271 -7.710 -13.096 1.00 0.00 C ATOM 989 CD LYS A 69 -7.544 -9.184 -13.321 1.00 0.00 C ATOM 990 CE LYS A 69 -6.633 -10.029 -12.418 1.00 0.00 C ATOM 991 NZ LYS A 69 -6.917 -11.473 -12.652 1.00 0.00 N ATOM 0 H LYS A 69 -10.466 -5.986 -14.138 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.389 -5.653 -12.193 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -9.114 -7.479 -14.183 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.741 -6.685 -14.929 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.235 -7.476 -13.340 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -7.417 -7.455 -12.046 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.589 -9.406 -13.107 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.372 -9.439 -14.367 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.586 -9.812 -12.632 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -6.803 -9.777 -11.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.303 -12.051 -12.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.913 -11.672 -12.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -6.734 -11.706 -13.649 1.00 0.00 H new ATOM 1005 N CYS A 70 -7.143 -3.636 -12.990 1.00 0.00 N ATOM 1006 CA CYS A 70 -6.236 -2.549 -13.483 1.00 0.00 C ATOM 1007 C CYS A 70 -4.808 -3.035 -13.258 1.00 0.00 C ATOM 1008 O CYS A 70 -4.597 -4.214 -13.029 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.524 -1.230 -12.761 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.746 -1.482 -10.984 1.00 0.00 S ATOM 0 H CYS A 70 -7.253 -3.679 -11.977 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.396 -2.345 -14.542 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.703 -0.534 -12.931 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.421 -0.773 -13.180 1.00 0.00 H new ATOM 0 HG CYS A 70 -7.561 -0.584 -10.517 1.00 0.00 H new ATOM 1016 N SER A 71 -3.830 -2.180 -13.372 1.00 0.00 N ATOM 1017 CA SER A 71 -2.403 -2.662 -13.232 1.00 0.00 C ATOM 1018 C SER A 71 -1.477 -1.646 -12.604 1.00 0.00 C ATOM 1019 O SER A 71 -1.023 -0.707 -13.248 1.00 0.00 O ATOM 1020 CB SER A 71 -1.904 -2.973 -14.595 1.00 0.00 C ATOM 1021 OG SER A 71 -1.922 -1.760 -15.349 1.00 0.00 O ATOM 0 H SER A 71 -3.941 -1.182 -13.553 1.00 0.00 H new ATOM 0 HA SER A 71 -2.409 -3.529 -12.572 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.894 -3.380 -14.549 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.531 -3.728 -15.069 1.00 0.00 H new ATOM 0 HG SER A 71 -2.834 -1.402 -15.370 1.00 0.00 H new ATOM 1027 N VAL A 72 -1.155 -1.862 -11.369 1.00 0.00 N ATOM 1028 CA VAL A 72 -0.212 -0.960 -10.620 1.00 0.00 C ATOM 1029 C VAL A 72 0.984 -0.595 -11.462 1.00 0.00 C ATOM 1030 O VAL A 72 1.750 -1.450 -11.898 1.00 0.00 O ATOM 1031 CB VAL A 72 0.308 -1.675 -9.399 1.00 0.00 C ATOM 1032 CG1 VAL A 72 1.080 -0.695 -8.515 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.841 -2.285 -8.614 1.00 0.00 C ATOM 0 H VAL A 72 -1.509 -2.645 -10.820 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.766 -0.060 -10.353 1.00 0.00 H new ATOM 0 HB VAL A 72 0.976 -2.475 -9.718 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.454 -1.217 -7.634 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.919 -0.283 -9.076 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.418 0.114 -8.204 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.450 -2.798 -7.735 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.525 -1.497 -8.299 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -1.373 -2.998 -9.243 1.00 0.00 H new ATOM 1043 N ILE A 73 1.165 0.671 -11.631 1.00 0.00 N ATOM 1044 CA ILE A 73 2.305 1.185 -12.364 1.00 0.00 C ATOM 1045 C ILE A 73 2.901 2.321 -11.500 1.00 0.00 C ATOM 1046 O ILE A 73 2.776 3.467 -11.774 1.00 0.00 O ATOM 1047 CB ILE A 73 1.881 1.632 -13.758 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.522 0.364 -14.602 1.00 0.00 C ATOM 1049 CG2 ILE A 73 3.019 2.407 -14.452 1.00 0.00 C ATOM 1050 CD1 ILE A 73 0.418 0.677 -15.647 1.00 0.00 C ATOM 0 H ILE A 73 0.536 1.389 -11.271 1.00 0.00 H new ATOM 0 HA ILE A 73 3.070 0.427 -12.533 1.00 0.00 H new ATOM 0 HB ILE A 73 1.017 2.292 -13.676 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.414 -0.002 -15.111 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.184 -0.433 -13.940 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.695 2.717 -15.446 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.272 3.288 -13.862 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.896 1.765 -14.540 1.00 0.00 H new ATOM 0 HD11 ILE A 73 0.191 -0.224 -16.217 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.481 1.019 -15.135 1.00 0.00 H new ATOM 0 HD13 ILE A 73 0.768 1.456 -16.324 1.00 0.00 H new ATOM 1062 N ARG A 74 3.495 1.896 -10.413 1.00 0.00 N ATOM 1063 CA ARG A 74 4.166 2.755 -9.340 1.00 0.00 C ATOM 1064 C ARG A 74 3.410 2.586 -8.038 1.00 0.00 C ATOM 1065 O ARG A 74 2.705 3.483 -7.575 1.00 0.00 O ATOM 1066 CB ARG A 74 4.264 4.228 -9.706 1.00 0.00 C ATOM 1067 CG ARG A 74 5.419 4.391 -10.665 1.00 0.00 C ATOM 1068 CD ARG A 74 5.704 5.870 -10.904 1.00 0.00 C ATOM 1069 NE ARG A 74 6.574 6.004 -12.104 1.00 0.00 N ATOM 1070 CZ ARG A 74 6.105 6.530 -13.201 1.00 0.00 C ATOM 1071 NH1 ARG A 74 5.323 5.833 -13.981 1.00 0.00 N ATOM 1072 NH2 ARG A 74 6.417 7.751 -13.520 1.00 0.00 N ATOM 0 H ARG A 74 3.553 0.901 -10.196 1.00 0.00 H new ATOM 0 HA ARG A 74 5.194 2.407 -9.243 1.00 0.00 H new ATOM 0 HB2 ARG A 74 3.336 4.570 -10.164 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.421 4.834 -8.813 1.00 0.00 H new ATOM 0 HG2 ARG A 74 6.307 3.903 -10.262 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.187 3.901 -11.611 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.772 6.415 -11.051 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.193 6.305 -10.033 1.00 0.00 H new ATOM 0 HE ARG A 74 7.541 5.683 -12.068 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.078 4.875 -13.733 1.00 0.00 H new ATOM 0 HH12 ARG A 74 4.958 6.247 -14.839 1.00 0.00 H new ATOM 0 HH21 ARG A 74 7.028 8.297 -12.912 1.00 0.00 H new ATOM 0 HH22 ARG A 74 6.051 8.163 -14.378 1.00 0.00 H new ATOM 1086 N ASP A 75 3.553 1.422 -7.428 1.00 0.00 N ATOM 1087 CA ASP A 75 2.844 1.164 -6.145 1.00 0.00 C ATOM 1088 C ASP A 75 3.477 1.992 -5.056 1.00 0.00 C ATOM 1089 O ASP A 75 4.447 1.584 -4.431 1.00 0.00 O ATOM 1090 CB ASP A 75 2.822 -0.368 -5.806 1.00 0.00 C ATOM 1091 CG ASP A 75 2.812 -0.636 -4.276 1.00 0.00 C ATOM 1092 OD1 ASP A 75 1.736 -0.614 -3.695 1.00 0.00 O ATOM 1093 OD2 ASP A 75 3.878 -0.868 -3.728 1.00 0.00 O ATOM 0 H ASP A 75 4.128 0.652 -7.769 1.00 0.00 H new ATOM 0 HA ASP A 75 1.800 1.464 -6.235 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.941 -0.825 -6.258 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.694 -0.848 -6.251 1.00 0.00 H new ATOM 1098 N SER A 76 2.894 3.148 -4.797 1.00 0.00 N ATOM 1099 CA SER A 76 3.414 4.020 -3.708 1.00 0.00 C ATOM 1100 C SER A 76 2.273 4.214 -2.652 1.00 0.00 C ATOM 1101 O SER A 76 2.332 5.078 -1.820 1.00 0.00 O ATOM 1102 CB SER A 76 3.928 5.391 -4.289 1.00 0.00 C ATOM 1103 OG SER A 76 3.569 5.520 -5.664 1.00 0.00 O ATOM 0 H SER A 76 2.084 3.515 -5.297 1.00 0.00 H new ATOM 0 HA SER A 76 4.271 3.554 -3.222 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.503 6.216 -3.718 1.00 0.00 H new ATOM 0 HB3 SER A 76 5.011 5.454 -4.183 1.00 0.00 H new ATOM 0 HG SER A 76 2.660 5.880 -5.732 1.00 0.00 H new ATOM 1109 N LEU A 77 1.249 3.341 -2.725 1.00 0.00 N ATOM 1110 CA LEU A 77 0.042 3.334 -1.796 1.00 0.00 C ATOM 1111 C LEU A 77 0.373 3.701 -0.365 1.00 0.00 C ATOM 1112 O LEU A 77 -0.180 4.658 0.165 1.00 0.00 O ATOM 1113 CB LEU A 77 -0.507 1.898 -1.820 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.005 1.857 -1.593 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -2.720 2.625 -2.710 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -2.471 0.397 -1.612 1.00 0.00 C ATOM 0 H LEU A 77 1.212 2.603 -3.429 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.670 4.082 -2.144 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.273 1.437 -2.780 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.008 1.307 -1.052 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.240 2.315 -0.632 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.797 2.593 -2.542 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.384 3.662 -2.711 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.489 2.167 -3.672 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.548 0.357 -1.449 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.233 -0.048 -2.578 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.964 -0.157 -0.822 1.00 0.00 H new ATOM 1128 N LEU A 78 1.188 2.933 0.302 1.00 0.00 N ATOM 1129 CA LEU A 78 1.480 3.250 1.738 1.00 0.00 C ATOM 1130 C LEU A 78 2.940 3.717 1.926 1.00 0.00 C ATOM 1131 O LEU A 78 3.616 3.317 2.882 1.00 0.00 O ATOM 1132 CB LEU A 78 1.152 2.054 2.641 1.00 0.00 C ATOM 1133 CG LEU A 78 0.051 1.145 2.015 1.00 0.00 C ATOM 1134 CD1 LEU A 78 0.694 -0.086 1.370 1.00 0.00 C ATOM 1135 CD2 LEU A 78 -0.931 0.692 3.100 1.00 0.00 C ATOM 0 H LEU A 78 1.661 2.111 -0.073 1.00 0.00 H new ATOM 0 HA LEU A 78 0.835 4.077 2.035 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.055 1.468 2.811 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.817 2.413 3.614 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.484 1.715 1.255 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.082 -0.716 0.935 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.384 0.231 0.588 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.238 -0.651 2.127 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.697 0.057 2.655 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.394 0.131 3.865 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.401 1.565 3.553 1.00 0.00 H new ATOM 1183 N GLU A 82 3.158 10.088 -0.537 1.00 0.00 N ATOM 1184 CA GLU A 82 2.925 9.717 -1.910 1.00 0.00 C ATOM 1185 C GLU A 82 1.602 8.974 -2.006 1.00 0.00 C ATOM 1186 O GLU A 82 0.666 9.426 -2.643 1.00 0.00 O ATOM 1187 CB GLU A 82 4.007 8.785 -2.383 1.00 0.00 C ATOM 1188 CG GLU A 82 5.186 9.525 -3.017 1.00 0.00 C ATOM 1189 CD GLU A 82 4.716 10.481 -4.137 1.00 0.00 C ATOM 1190 OE1 GLU A 82 3.963 10.039 -4.987 1.00 0.00 O ATOM 1191 OE2 GLU A 82 5.121 11.633 -4.115 1.00 0.00 O ATOM 0 HA GLU A 82 2.914 10.620 -2.520 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.365 8.193 -1.541 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.589 8.087 -3.108 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.716 10.092 -2.251 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.893 8.803 -3.426 1.00 0.00 H new ATOM 1198 N PHE A 83 1.548 7.798 -1.383 1.00 0.00 N ATOM 1199 CA PHE A 83 0.308 6.915 -1.435 1.00 0.00 C ATOM 1200 C PHE A 83 -0.332 6.830 -2.851 1.00 0.00 C ATOM 1201 O PHE A 83 -1.434 6.345 -2.967 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.793 7.367 -0.458 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.708 8.834 -0.135 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.308 9.313 0.684 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -1.663 9.715 -0.662 1.00 0.00 C ATOM 1206 CE1 PHE A 83 0.374 10.693 0.977 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -1.596 11.081 -0.371 1.00 0.00 C ATOM 1208 CZ PHE A 83 -0.579 11.569 0.448 1.00 0.00 C ATOM 0 H PHE A 83 2.317 7.410 -0.836 1.00 0.00 H new ATOM 0 HA PHE A 83 0.682 5.933 -1.146 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.770 7.149 -0.890 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.716 6.790 0.464 1.00 0.00 H new ATOM 0 HD1 PHE A 83 1.042 8.635 1.093 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -2.453 9.337 -1.295 1.00 0.00 H new ATOM 0 HE1 PHE A 83 1.162 11.072 1.611 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -2.332 11.757 -0.780 1.00 0.00 H new ATOM 0 HZ PHE A 83 -0.527 12.624 0.674 1.00 0.00 H new ATOM 1218 N SER A 84 0.320 7.269 -3.918 1.00 0.00 N ATOM 1219 CA SER A 84 -0.330 7.196 -5.255 1.00 0.00 C ATOM 1220 C SER A 84 0.108 5.956 -5.958 1.00 0.00 C ATOM 1221 O SER A 84 1.238 5.561 -5.884 1.00 0.00 O ATOM 1222 CB SER A 84 0.012 8.435 -6.072 1.00 0.00 C ATOM 1223 OG SER A 84 1.369 8.811 -5.832 1.00 0.00 O ATOM 0 H SER A 84 1.259 7.667 -3.908 1.00 0.00 H new ATOM 0 HA SER A 84 -1.412 7.161 -5.131 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.138 8.235 -7.133 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.655 9.254 -5.804 1.00 0.00 H new ATOM 0 HG SER A 84 1.586 9.607 -6.360 1.00 0.00 H new ATOM 1229 N MET A 85 -0.806 5.323 -6.613 1.00 0.00 N ATOM 1230 CA MET A 85 -0.498 4.055 -7.330 1.00 0.00 C ATOM 1231 C MET A 85 -1.087 4.160 -8.725 1.00 0.00 C ATOM 1232 O MET A 85 -2.268 4.364 -8.864 1.00 0.00 O ATOM 1233 CB MET A 85 -1.166 2.959 -6.545 1.00 0.00 C ATOM 1234 CG MET A 85 -0.549 1.607 -6.811 1.00 0.00 C ATOM 1235 SD MET A 85 -0.363 0.745 -5.237 1.00 0.00 S ATOM 1236 CE MET A 85 -0.961 -0.859 -5.754 1.00 0.00 C ATOM 0 H MET A 85 -1.776 5.630 -6.688 1.00 0.00 H new ATOM 0 HA MET A 85 0.570 3.857 -7.417 1.00 0.00 H new ATOM 0 HB2 MET A 85 -1.098 3.184 -5.481 1.00 0.00 H new ATOM 0 HB3 MET A 85 -2.226 2.928 -6.797 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.179 1.029 -7.487 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.420 1.721 -7.297 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.662 -1.242 -5.012 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.465 -0.767 -6.716 1.00 0.00 H new ATOM 0 HE3 MET A 85 -0.121 -1.547 -5.849 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.284 4.055 -9.773 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.859 4.195 -11.136 1.00 0.00 C ATOM 1248 C ASP A 86 -1.372 2.846 -11.633 1.00 0.00 C ATOM 1249 O ASP A 86 -0.758 2.218 -12.503 1.00 0.00 O ATOM 1250 CB ASP A 86 0.205 4.694 -12.044 1.00 0.00 C ATOM 1251 CG ASP A 86 0.195 6.221 -12.084 1.00 0.00 C ATOM 1252 OD1 ASP A 86 -0.763 6.770 -12.600 1.00 0.00 O ATOM 1253 OD2 ASP A 86 1.145 6.816 -11.603 1.00 0.00 O ATOM 0 H ASP A 86 0.720 3.882 -9.732 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.695 4.894 -11.115 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.178 4.339 -11.705 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.052 4.296 -13.047 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.515 2.390 -11.147 1.00 0.00 N ATOM 1259 CA LEU A 87 -3.014 1.087 -11.652 1.00 0.00 C ATOM 1260 C LEU A 87 -3.932 1.338 -12.820 1.00 0.00 C ATOM 1261 O LEU A 87 -4.988 1.939 -12.696 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.636 0.148 -10.569 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.290 0.854 -9.357 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.267 1.624 -8.542 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.411 1.769 -9.817 1.00 0.00 C ATOM 0 H LEU A 87 -3.095 2.854 -10.448 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.148 0.515 -11.985 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.387 -0.479 -11.048 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.855 -0.516 -10.200 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.712 0.084 -8.711 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.762 2.107 -7.699 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.506 0.937 -8.171 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.797 2.382 -9.170 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.860 2.257 -8.952 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.010 2.524 -10.493 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.169 1.183 -10.337 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.463 0.949 -13.997 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.236 1.223 -15.248 1.00 0.00 C ATOM 1279 C ARG A 88 -4.834 -0.026 -15.842 1.00 0.00 C ATOM 1280 O ARG A 88 -4.269 -1.109 -15.767 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.299 1.911 -16.313 1.00 0.00 C ATOM 1282 CG ARG A 88 -2.561 0.889 -17.294 1.00 0.00 C ATOM 1283 CD ARG A 88 -1.980 1.684 -18.456 1.00 0.00 C ATOM 1284 NE ARG A 88 -0.555 1.323 -18.673 1.00 0.00 N ATOM 1285 CZ ARG A 88 0.076 1.790 -19.714 1.00 0.00 C ATOM 1286 NH1 ARG A 88 0.606 2.983 -19.674 1.00 0.00 N ATOM 1287 NH2 ARG A 88 0.170 1.069 -20.800 1.00 0.00 N ATOM 0 H ARG A 88 -2.581 0.456 -14.135 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.058 1.886 -14.979 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -3.893 2.604 -16.909 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -2.547 2.503 -15.791 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.771 0.356 -16.765 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.262 0.138 -17.659 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.553 1.487 -19.362 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.064 2.751 -18.252 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.074 0.714 -18.012 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.526 3.548 -18.829 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.100 3.349 -20.488 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.250 0.140 -20.834 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.664 1.435 -21.614 1.00 0.00 H new ATOM 1301 N THR A 89 -5.943 0.153 -16.515 1.00 0.00 N ATOM 1302 CA THR A 89 -6.592 -0.962 -17.224 1.00 0.00 C ATOM 1303 C THR A 89 -5.694 -1.290 -18.395 1.00 0.00 C ATOM 1304 O THR A 89 -5.573 -0.491 -19.314 1.00 0.00 O ATOM 1305 CB THR A 89 -7.989 -0.526 -17.747 1.00 0.00 C ATOM 1306 OG1 THR A 89 -7.872 0.224 -18.943 1.00 0.00 O ATOM 1307 CG2 THR A 89 -8.707 0.326 -16.701 1.00 0.00 C ATOM 0 H THR A 89 -6.426 1.048 -16.597 1.00 0.00 H new ATOM 0 HA THR A 89 -6.734 -1.820 -16.566 1.00 0.00 H new ATOM 0 HB THR A 89 -8.563 -1.431 -17.945 1.00 0.00 H new ATOM 0 HG1 THR A 89 -6.931 0.450 -19.097 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.684 0.623 -17.082 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.835 -0.253 -15.786 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.115 1.216 -16.487 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.046 -2.417 -18.384 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.167 -2.736 -19.485 1.00 0.00 C ATOM 1317 C LYS A 90 -4.949 -3.676 -20.383 1.00 0.00 C ATOM 1318 O LYS A 90 -5.623 -4.580 -19.905 1.00 0.00 O ATOM 1319 CB LYS A 90 -2.894 -3.398 -18.998 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.523 -2.989 -17.595 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.000 -3.255 -17.430 1.00 0.00 C ATOM 1322 CE LYS A 90 -0.775 -4.637 -16.795 1.00 0.00 C ATOM 1323 NZ LYS A 90 -0.239 -5.574 -17.823 1.00 0.00 N ATOM 0 H LYS A 90 -5.102 -3.120 -17.647 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.861 -1.834 -20.015 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.015 -4.481 -19.036 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.077 -3.145 -19.674 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.751 -1.936 -17.428 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.095 -3.559 -16.863 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.506 -3.207 -18.401 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.553 -2.481 -16.806 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.077 -4.557 -15.961 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.712 -5.020 -16.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.086 -6.509 -17.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.920 -5.658 -18.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.664 -5.209 -18.188 1.00 0.00 H new ATOM 1434 N ASN A 99 -6.578 4.373 -17.491 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.698 4.424 -16.273 1.00 0.00 C ATOM 1436 C ASN A 99 -6.422 4.968 -15.040 1.00 0.00 C ATOM 1437 O ASN A 99 -7.430 5.651 -15.126 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.413 5.269 -16.565 1.00 0.00 C ATOM 1439 CG ASN A 99 -3.956 5.170 -18.053 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -2.698 4.983 -18.305 1.00 0.00 O flip ATOM 1441 ND2 ASN A 99 -4.735 5.278 -18.971 1.00 0.00 N flip ATOM 0 HA ASN A 99 -5.414 3.396 -16.046 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.605 6.313 -16.316 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.605 4.930 -15.917 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -5.727 5.425 -18.784 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -4.401 5.222 -19.933 1.00 0.00 H new ATOM 1448 N VAL A 100 -5.877 4.627 -13.880 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.441 5.041 -12.571 1.00 0.00 C ATOM 1450 C VAL A 100 -5.290 5.368 -11.621 1.00 0.00 C ATOM 1451 O VAL A 100 -4.247 4.706 -11.648 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.183 3.850 -11.926 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -8.017 4.335 -10.759 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -8.088 3.157 -12.948 1.00 0.00 C ATOM 0 H VAL A 100 -5.034 4.058 -13.803 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.105 5.891 -12.731 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.441 3.134 -11.573 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.538 3.490 -10.308 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.368 4.800 -10.016 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.746 5.065 -11.111 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.601 2.321 -12.472 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.824 3.868 -13.323 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.484 2.788 -13.777 1.00 0.00 H new ATOM 1464 N THR A 101 -5.502 6.295 -10.724 1.00 0.00 N ATOM 1465 CA THR A 101 -4.498 6.599 -9.695 1.00 0.00 C ATOM 1466 C THR A 101 -5.208 6.294 -8.406 1.00 0.00 C ATOM 1467 O THR A 101 -6.328 6.701 -8.217 1.00 0.00 O ATOM 1468 CB THR A 101 -4.054 8.088 -9.737 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.075 8.252 -10.754 1.00 0.00 O ATOM 1470 CG2 THR A 101 -3.450 8.493 -8.363 1.00 0.00 C ATOM 0 H THR A 101 -6.350 6.859 -10.671 1.00 0.00 H new ATOM 0 HA THR A 101 -3.583 6.023 -9.832 1.00 0.00 H new ATOM 0 HB THR A 101 -4.915 8.721 -9.949 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.183 8.269 -10.349 1.00 0.00 H new ATOM 0 HG21 THR A 101 -3.140 9.537 -8.396 1.00 0.00 H new ATOM 0 HG22 THR A 101 -4.200 8.361 -7.583 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.586 7.864 -8.146 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.586 5.584 -7.545 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.229 5.215 -6.271 1.00 0.00 C ATOM 1480 C VAL A 102 -4.386 5.779 -5.101 1.00 0.00 C ATOM 1481 O VAL A 102 -3.208 5.490 -4.960 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.385 3.688 -6.312 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -5.505 3.082 -4.904 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.647 3.386 -7.117 1.00 0.00 C ATOM 0 H VAL A 102 -3.637 5.231 -7.665 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.220 5.643 -6.118 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.501 3.245 -6.769 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.614 2.000 -4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.609 3.317 -4.329 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -6.378 3.499 -4.402 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.795 2.307 -7.170 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.507 3.847 -6.631 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.541 3.788 -8.125 1.00 0.00 H new ATOM 1494 N THR A 103 -5.012 6.642 -4.297 1.00 0.00 N ATOM 1495 CA THR A 103 -4.298 7.322 -3.158 1.00 0.00 C ATOM 1496 C THR A 103 -4.756 6.764 -1.812 1.00 0.00 C ATOM 1497 O THR A 103 -5.876 6.990 -1.380 1.00 0.00 O ATOM 1498 CB THR A 103 -4.576 8.824 -3.182 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.943 9.054 -3.439 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.720 9.488 -4.265 1.00 0.00 C ATOM 0 H THR A 103 -5.995 6.899 -4.392 1.00 0.00 H new ATOM 0 HA THR A 103 -3.231 7.136 -3.280 1.00 0.00 H new ATOM 0 HB THR A 103 -4.322 9.253 -2.213 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.082 9.156 -4.404 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.920 10.559 -4.281 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.665 9.319 -4.050 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.965 9.059 -5.237 1.00 0.00 H new ATOM 1508 N LYS A 104 -3.885 6.043 -1.154 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.201 5.438 0.170 1.00 0.00 C ATOM 1510 C LYS A 104 -3.822 6.402 1.299 1.00 0.00 C ATOM 1511 O LYS A 104 -2.659 6.737 1.478 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.385 4.152 0.290 1.00 0.00 C ATOM 1513 CG LYS A 104 -3.439 3.556 1.717 1.00 0.00 C ATOM 1514 CD LYS A 104 -4.832 2.997 1.986 1.00 0.00 C ATOM 1515 CE LYS A 104 -4.826 1.453 1.917 1.00 0.00 C ATOM 1516 NZ LYS A 104 -3.934 0.954 0.820 1.00 0.00 N ATOM 0 H LYS A 104 -2.943 5.845 -1.491 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.268 5.230 0.249 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.760 3.418 -0.423 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.348 4.355 0.022 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.694 2.768 1.821 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -3.196 4.323 2.452 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -5.175 3.320 2.969 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -5.536 3.396 1.256 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -4.492 1.047 2.872 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -5.841 1.091 1.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.094 -0.064 0.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -4.149 1.464 -0.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -2.940 1.116 1.080 1.00 0.00 H new ATOM 1530 N THR A 105 -4.795 6.794 2.086 1.00 0.00 N ATOM 1531 CA THR A 105 -4.523 7.685 3.251 1.00 0.00 C ATOM 1532 C THR A 105 -4.077 6.776 4.416 1.00 0.00 C ATOM 1533 O THR A 105 -3.392 5.785 4.183 1.00 0.00 O ATOM 1534 CB THR A 105 -5.805 8.451 3.605 1.00 0.00 C ATOM 1535 OG1 THR A 105 -6.787 7.532 4.048 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.316 9.207 2.368 1.00 0.00 C ATOM 0 H THR A 105 -5.773 6.531 1.968 1.00 0.00 H new ATOM 0 HA THR A 105 -3.746 8.418 3.033 1.00 0.00 H new ATOM 0 HB THR A 105 -5.596 9.170 4.397 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.075 7.772 4.954 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.226 9.750 2.623 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.555 9.912 2.033 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.529 8.496 1.570 1.00 0.00 H new ATOM 1544 N ASP A 106 -4.458 7.084 5.653 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.055 6.219 6.803 1.00 0.00 C ATOM 1546 C ASP A 106 -5.134 5.164 7.066 1.00 0.00 C ATOM 1547 O ASP A 106 -4.847 4.105 7.612 1.00 0.00 O ATOM 1548 CB ASP A 106 -3.876 7.075 8.049 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.269 6.222 9.163 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -3.980 5.390 9.701 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -2.102 6.412 9.457 1.00 0.00 O ATOM 0 H ASP A 106 -5.026 7.894 5.900 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.115 5.723 6.561 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.228 7.924 7.831 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -4.837 7.480 8.367 1.00 0.00 H new ATOM 1556 N LYS A 107 -6.386 5.452 6.696 1.00 0.00 N ATOM 1557 CA LYS A 107 -7.503 4.462 6.950 1.00 0.00 C ATOM 1558 C LYS A 107 -8.568 4.539 5.838 1.00 0.00 C ATOM 1559 O LYS A 107 -9.690 4.102 6.027 1.00 0.00 O ATOM 1560 CB LYS A 107 -8.173 4.772 8.308 1.00 0.00 C ATOM 1561 CG LYS A 107 -7.103 5.052 9.368 1.00 0.00 C ATOM 1562 CD LYS A 107 -7.769 5.492 10.677 1.00 0.00 C ATOM 1563 CE LYS A 107 -6.910 6.577 11.350 1.00 0.00 C ATOM 1564 NZ LYS A 107 -5.934 5.938 12.283 1.00 0.00 N ATOM 0 H LYS A 107 -6.671 6.317 6.237 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.075 3.460 6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -8.833 5.634 8.209 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -8.792 3.930 8.618 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.503 4.158 9.537 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.424 5.829 9.016 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -8.769 5.877 10.477 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -7.884 4.638 11.344 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -6.380 7.156 10.594 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -7.547 7.273 11.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -5.561 6.654 12.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -6.410 5.188 12.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -5.150 5.527 11.737 1.00 0.00 H new ATOM 1578 N THR A 108 -8.224 5.079 4.680 1.00 0.00 N ATOM 1579 CA THR A 108 -9.214 5.176 3.558 1.00 0.00 C ATOM 1580 C THR A 108 -8.499 4.744 2.273 1.00 0.00 C ATOM 1581 O THR A 108 -7.293 4.916 2.139 1.00 0.00 O ATOM 1582 CB THR A 108 -9.769 6.619 3.463 1.00 0.00 C ATOM 1583 OG1 THR A 108 -8.856 7.460 2.779 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.016 7.159 4.888 1.00 0.00 C ATOM 0 H THR A 108 -7.299 5.455 4.470 1.00 0.00 H new ATOM 0 HA THR A 108 -10.071 4.524 3.727 1.00 0.00 H new ATOM 0 HB THR A 108 -10.705 6.606 2.905 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.013 7.502 3.278 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.407 8.175 4.829 1.00 0.00 H new ATOM 0 HG22 THR A 108 -10.738 6.521 5.399 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.078 7.163 5.443 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.222 4.145 1.367 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.612 3.624 0.099 1.00 0.00 C ATOM 1594 C LEU A 109 -9.200 4.487 -1.049 1.00 0.00 C ATOM 1595 O LEU A 109 -10.176 4.095 -1.669 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.088 2.123 -0.015 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.073 1.133 -0.666 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.595 0.604 -1.980 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -6.696 1.727 -0.863 1.00 0.00 C ATOM 0 H LEU A 109 -10.227 3.990 1.449 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.524 3.671 0.066 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.328 1.761 0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.012 2.098 -0.593 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.969 0.311 0.042 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.867 -0.083 -2.411 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.535 0.079 -1.813 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.760 1.434 -2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.041 0.985 -1.320 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -6.765 2.599 -1.514 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.287 2.026 0.102 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.631 5.689 -1.330 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.214 6.547 -2.386 1.00 0.00 C ATOM 1613 C VAL A 110 -8.741 6.043 -3.715 1.00 0.00 C ATOM 1614 O VAL A 110 -7.605 5.636 -3.860 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.783 8.050 -2.173 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -8.891 8.836 -3.485 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.706 8.724 -1.136 1.00 0.00 C ATOM 0 H VAL A 110 -7.808 6.070 -0.863 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.302 6.507 -2.343 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.751 8.053 -1.824 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.589 9.870 -3.316 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.239 8.386 -4.234 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.921 8.812 -3.840 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.400 9.761 -0.996 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.736 8.694 -1.492 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.635 8.194 -0.186 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.599 6.122 -4.689 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.244 5.725 -6.049 1.00 0.00 C ATOM 1629 C LEU A 111 -9.739 6.836 -6.971 1.00 0.00 C ATOM 1630 O LEU A 111 -10.705 7.528 -6.669 1.00 0.00 O ATOM 1631 CB LEU A 111 -9.906 4.367 -6.455 1.00 0.00 C ATOM 1632 CG LEU A 111 -9.966 3.373 -5.269 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -10.651 2.070 -5.724 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -8.574 3.041 -4.758 1.00 0.00 C ATOM 0 H LEU A 111 -10.556 6.457 -4.582 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.166 5.582 -6.122 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -10.915 4.552 -6.825 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.343 3.920 -7.274 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.532 3.842 -4.464 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -10.693 1.370 -4.889 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -11.663 2.290 -6.064 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -10.082 1.626 -6.541 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.649 2.341 -3.926 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.990 2.589 -5.560 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.083 3.954 -4.421 1.00 0.00 H new ATOM 1646 N LEU A 112 -9.089 7.006 -8.072 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.472 8.031 -9.056 1.00 0.00 C ATOM 1648 C LEU A 112 -9.385 7.359 -10.379 1.00 0.00 C ATOM 1649 O LEU A 112 -8.310 7.169 -10.905 1.00 0.00 O ATOM 1650 CB LEU A 112 -8.470 9.192 -9.024 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.666 10.205 -10.215 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -10.140 10.418 -10.581 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -8.028 11.527 -9.837 1.00 0.00 C ATOM 0 H LEU A 112 -8.275 6.453 -8.340 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.465 8.431 -8.851 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.571 9.726 -8.079 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.457 8.792 -9.057 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.187 9.781 -11.098 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.211 11.125 -11.407 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.582 9.467 -10.878 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.676 10.813 -9.718 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.156 12.239 -10.652 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.504 11.917 -8.937 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.965 11.377 -9.649 1.00 0.00 H new ATOM 1665 N MET A 113 -10.469 7.000 -10.930 1.00 0.00 N ATOM 1666 CA MET A 113 -10.399 6.309 -12.268 1.00 0.00 C ATOM 1667 C MET A 113 -10.718 7.285 -13.290 1.00 0.00 C ATOM 1668 O MET A 113 -11.507 8.188 -13.056 1.00 0.00 O ATOM 1669 CB MET A 113 -11.347 5.139 -12.336 1.00 0.00 C ATOM 1670 CG MET A 113 -11.135 4.333 -13.639 1.00 0.00 C ATOM 1671 SD MET A 113 -12.727 3.754 -14.276 1.00 0.00 S ATOM 1672 CE MET A 113 -12.260 2.013 -14.487 1.00 0.00 C ATOM 0 H MET A 113 -11.404 7.137 -10.547 1.00 0.00 H new ATOM 0 HA MET A 113 -9.396 5.910 -12.421 1.00 0.00 H new ATOM 0 HB2 MET A 113 -11.194 4.491 -11.473 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.376 5.496 -12.287 1.00 0.00 H new ATOM 0 HG2 MET A 113 -10.640 4.955 -14.385 1.00 0.00 H new ATOM 0 HG3 MET A 113 -10.480 3.483 -13.448 1.00 0.00 H new ATOM 0 HE1 MET A 113 -13.158 1.407 -14.601 1.00 0.00 H new ATOM 0 HE2 MET A 113 -11.636 1.909 -15.375 1.00 0.00 H new ATOM 0 HE3 MET A 113 -11.704 1.677 -13.612 1.00 0.00 H new ATOM 1682 N GLY A 114 -10.093 7.159 -14.425 1.00 0.00 N ATOM 1683 CA GLY A 114 -10.343 8.106 -15.468 1.00 0.00 C ATOM 1684 C GLY A 114 -9.852 7.662 -16.758 1.00 0.00 C ATOM 1685 O GLY A 114 -8.781 7.003 -16.843 1.00 0.00 O ATOM 0 H GLY A 114 -9.420 6.425 -14.648 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -11.415 8.290 -15.536 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.872 9.055 -15.212 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.099 10.703 -15.429 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.260 11.673 -14.640 1.00 0.00 C ATOM 1775 C GLY A 121 -1.150 12.814 -14.140 1.00 0.00 C ATOM 1776 O GLY A 121 -0.951 13.345 -13.052 1.00 0.00 O ATOM 0 HA2 GLY A 121 0.209 11.165 -13.797 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.543 12.068 -15.262 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.154 13.168 -14.924 1.00 0.00 N ATOM 1781 CA LEU A 122 -3.112 14.256 -14.524 1.00 0.00 C ATOM 1782 C LEU A 122 -4.081 13.646 -13.564 1.00 0.00 C ATOM 1783 O LEU A 122 -4.479 14.265 -12.626 1.00 0.00 O ATOM 1784 CB LEU A 122 -3.907 14.816 -15.752 1.00 0.00 C ATOM 1785 CG LEU A 122 -3.113 14.692 -17.082 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -3.919 13.860 -18.091 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -2.856 16.093 -17.663 1.00 0.00 C ATOM 0 H LEU A 122 -2.349 12.744 -15.831 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.556 15.086 -14.087 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.851 14.279 -15.845 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.152 15.863 -15.575 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.160 14.200 -16.886 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.359 13.775 -19.022 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -4.097 12.865 -17.683 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -4.874 14.348 -18.285 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.299 16.004 -18.596 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.808 16.588 -17.855 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.278 16.682 -16.951 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.427 12.393 -13.782 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.331 11.678 -12.848 1.00 0.00 C ATOM 1801 C ILE A 123 -4.537 11.491 -11.567 1.00 0.00 C ATOM 1802 O ILE A 123 -5.071 11.589 -10.486 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.685 10.316 -13.467 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.767 10.512 -14.590 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.197 9.293 -12.381 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -7.232 9.144 -15.110 1.00 0.00 C ATOM 0 H ILE A 123 -4.112 11.840 -14.579 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.257 12.219 -12.654 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.778 9.897 -13.903 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.617 11.069 -14.196 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.352 11.100 -15.408 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.436 8.343 -12.860 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.419 9.137 -11.633 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.090 9.691 -11.898 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.982 9.286 -15.888 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.380 8.602 -15.522 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -7.664 8.571 -14.290 1.00 0.00 H new ATOM 1818 N ASN A 124 -3.242 11.234 -11.704 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.378 11.060 -10.524 1.00 0.00 C ATOM 1820 C ASN A 124 -2.353 12.366 -9.738 1.00 0.00 C ATOM 1821 O ASN A 124 -2.108 12.375 -8.534 1.00 0.00 O ATOM 1822 CB ASN A 124 -0.960 10.705 -10.966 1.00 0.00 C ATOM 1823 CG ASN A 124 -0.115 10.382 -9.733 1.00 0.00 C ATOM 1824 OD1 ASN A 124 0.072 11.221 -8.875 1.00 0.00 O ATOM 1825 ND2 ASN A 124 0.400 9.192 -9.603 1.00 0.00 N ATOM 0 H ASN A 124 -2.765 11.141 -12.601 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.767 10.255 -9.900 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -0.980 9.850 -11.642 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.519 11.536 -11.516 1.00 0.00 H new ATOM 0 HD21 ASN A 124 0.960 8.966 -8.781 1.00 0.00 H new ATOM 0 HD22 ASN A 124 0.243 8.487 -10.323 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.590 13.481 -10.422 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.557 14.827 -9.722 1.00 0.00 C ATOM 1834 C LYS A 125 -3.952 15.063 -9.056 1.00 0.00 C ATOM 1835 O LYS A 125 -4.063 15.640 -7.975 1.00 0.00 O ATOM 1836 CB LYS A 125 -2.211 15.929 -10.796 1.00 0.00 C ATOM 1837 CG LYS A 125 -3.447 16.581 -11.419 1.00 0.00 C ATOM 1838 CD LYS A 125 -3.756 17.843 -10.630 1.00 0.00 C ATOM 1839 CE LYS A 125 -2.927 19.004 -11.183 1.00 0.00 C ATOM 1840 NZ LYS A 125 -3.440 20.287 -10.631 1.00 0.00 N ATOM 0 H LYS A 125 -2.802 13.517 -11.419 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.799 14.868 -8.940 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -1.599 16.701 -10.329 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.610 15.479 -11.586 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -3.265 16.821 -12.467 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -4.295 15.896 -11.391 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -4.819 18.076 -10.697 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -3.529 17.690 -9.575 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -1.878 18.875 -10.917 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -2.980 19.017 -12.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.877 21.076 -11.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -4.435 20.410 -10.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -3.367 20.273 -9.594 1.00 0.00 H new ATOM 1854 N LYS A 126 -4.998 14.604 -9.722 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.405 14.767 -9.201 1.00 0.00 C ATOM 1856 C LYS A 126 -6.708 13.759 -8.092 1.00 0.00 C ATOM 1857 O LYS A 126 -7.628 13.958 -7.306 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.399 14.576 -10.356 1.00 0.00 C ATOM 1859 CG LYS A 126 -7.684 15.944 -11.011 1.00 0.00 C ATOM 1860 CD LYS A 126 -6.938 16.086 -12.343 1.00 0.00 C ATOM 1861 CE LYS A 126 -7.427 15.044 -13.352 1.00 0.00 C ATOM 1862 NZ LYS A 126 -7.445 15.641 -14.737 1.00 0.00 N ATOM 0 H LYS A 126 -4.934 14.117 -10.616 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.503 15.769 -8.783 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -6.990 13.885 -11.093 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.325 14.136 -9.986 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.756 16.054 -11.178 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -7.382 16.744 -10.335 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -7.090 17.088 -12.745 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -5.867 15.967 -12.180 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -6.775 14.171 -13.331 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.426 14.703 -13.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -8.429 15.799 -15.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -6.935 16.548 -14.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.983 14.989 -15.402 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.930 12.701 -8.001 1.00 0.00 N ATOM 1877 CA CYS A 127 -6.131 11.685 -6.929 1.00 0.00 C ATOM 1878 C CYS A 127 -5.333 12.137 -5.749 1.00 0.00 C ATOM 1879 O CYS A 127 -5.734 11.981 -4.629 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.624 10.332 -7.375 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.535 9.035 -6.506 1.00 0.00 S ATOM 0 H CYS A 127 -5.156 12.502 -8.635 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.191 11.591 -6.692 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.750 10.221 -8.452 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.557 10.244 -7.168 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.590 7.971 -7.250 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.188 12.737 -6.023 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.325 13.272 -4.958 1.00 0.00 C ATOM 1889 C TYR A 128 -4.124 14.386 -4.232 1.00 0.00 C ATOM 1890 O TYR A 128 -3.943 14.621 -3.047 1.00 0.00 O ATOM 1891 CB TYR A 128 -2.060 13.819 -5.640 1.00 0.00 C ATOM 1892 CG TYR A 128 -1.095 14.406 -4.658 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -0.862 13.798 -3.414 1.00 0.00 C ATOM 1894 CD2 TYR A 128 -0.414 15.564 -5.015 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.057 14.361 -2.528 1.00 0.00 C ATOM 1896 CE2 TYR A 128 0.507 16.134 -4.127 1.00 0.00 C ATOM 1897 CZ TYR A 128 0.741 15.532 -2.881 1.00 0.00 C ATOM 1898 OH TYR A 128 1.654 16.086 -2.008 1.00 0.00 O ATOM 0 H TYR A 128 -3.826 12.871 -6.967 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.031 12.524 -4.222 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.571 13.016 -6.191 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.342 14.580 -6.368 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.393 12.897 -3.144 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.595 16.023 -5.976 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.241 13.895 -1.571 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.036 17.035 -4.401 1.00 0.00 H new ATOM 0 HH TYR A 128 2.039 16.894 -2.407 1.00 0.00 H new ATOM 1908 N GLU A 129 -5.051 15.041 -4.957 1.00 0.00 N ATOM 1909 CA GLU A 129 -5.916 16.118 -4.330 1.00 0.00 C ATOM 1910 C GLU A 129 -7.130 15.455 -3.627 1.00 0.00 C ATOM 1911 O GLU A 129 -7.548 15.871 -2.544 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.422 17.067 -5.421 1.00 0.00 C ATOM 1913 CG GLU A 129 -5.264 17.932 -5.925 1.00 0.00 C ATOM 1914 CD GLU A 129 -5.788 19.314 -6.323 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -6.773 19.372 -7.041 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -5.190 20.292 -5.906 1.00 0.00 O ATOM 0 H GLU A 129 -5.234 14.869 -5.945 1.00 0.00 H new ATOM 0 HA GLU A 129 -5.329 16.678 -3.602 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -6.848 16.495 -6.246 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.217 17.700 -5.027 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -4.506 18.030 -5.148 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.785 17.454 -6.780 1.00 0.00 H new ATOM 1923 N MET A 130 -7.680 14.407 -4.228 1.00 0.00 N ATOM 1924 CA MET A 130 -8.856 13.673 -3.610 1.00 0.00 C ATOM 1925 C MET A 130 -8.409 13.191 -2.189 1.00 0.00 C ATOM 1926 O MET A 130 -9.121 13.333 -1.180 1.00 0.00 O ATOM 1927 CB MET A 130 -9.181 12.461 -4.531 1.00 0.00 C ATOM 1928 CG MET A 130 -10.688 12.112 -4.505 1.00 0.00 C ATOM 1929 SD MET A 130 -10.931 10.487 -5.254 1.00 0.00 S ATOM 1930 CE MET A 130 -12.723 10.395 -5.035 1.00 0.00 C ATOM 0 H MET A 130 -7.365 14.028 -5.121 1.00 0.00 H new ATOM 0 HA MET A 130 -9.742 14.300 -3.515 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.878 12.689 -5.553 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.601 11.595 -4.212 1.00 0.00 H new ATOM 0 HG2 MET A 130 -11.056 12.112 -3.479 1.00 0.00 H new ATOM 0 HG3 MET A 130 -11.258 12.866 -5.048 1.00 0.00 H new ATOM 0 HE1 MET A 130 -13.010 9.367 -4.812 1.00 0.00 H new ATOM 0 HE2 MET A 130 -13.022 11.042 -4.211 1.00 0.00 H new ATOM 0 HE3 MET A 130 -13.219 10.720 -5.950 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.200 12.673 -2.122 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.609 12.206 -0.833 1.00 0.00 C ATOM 1942 C ALA A 131 -6.078 13.400 -0.067 1.00 0.00 C ATOM 1943 O ALA A 131 -5.924 13.327 1.128 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.465 11.233 -1.117 1.00 0.00 C ATOM 0 H ALA A 131 -6.589 12.554 -2.930 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.373 11.701 -0.242 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.034 10.893 -0.175 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.846 10.376 -1.672 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.698 11.735 -1.706 1.00 0.00 H new ATOM 1950 N SER A 132 -5.807 14.530 -0.747 1.00 0.00 N ATOM 1951 CA SER A 132 -5.310 15.749 -0.015 1.00 0.00 C ATOM 1952 C SER A 132 -6.351 16.099 1.040 1.00 0.00 C ATOM 1953 O SER A 132 -6.012 16.570 2.123 1.00 0.00 O ATOM 1954 CB SER A 132 -5.116 16.933 -0.976 1.00 0.00 C ATOM 1955 OG SER A 132 -3.933 16.733 -1.737 1.00 0.00 O ATOM 0 H SER A 132 -5.912 14.642 -1.755 1.00 0.00 H new ATOM 0 HA SER A 132 -4.342 15.541 0.441 1.00 0.00 H new ATOM 0 HB2 SER A 132 -5.977 17.023 -1.638 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.047 17.864 -0.414 1.00 0.00 H new ATOM 0 HG SER A 132 -3.804 15.775 -1.896 1.00 0.00 H new ATOM 1961 N HIS A 133 -7.640 15.822 0.750 1.00 0.00 N ATOM 1962 CA HIS A 133 -8.702 16.091 1.772 1.00 0.00 C ATOM 1963 C HIS A 133 -8.730 14.957 2.737 1.00 0.00 C ATOM 1964 O HIS A 133 -8.882 15.179 3.913 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.087 16.242 1.189 1.00 0.00 C ATOM 1966 CG HIS A 133 -10.938 16.903 2.244 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.919 16.212 2.944 1.00 0.00 N ATOM 1968 CD2 HIS A 133 -10.936 18.176 2.762 1.00 0.00 C ATOM 1969 CE1 HIS A 133 -12.459 17.068 3.834 1.00 0.00 C ATOM 1970 NE2 HIS A 133 -11.897 18.278 3.764 1.00 0.00 N ATOM 0 H HIS A 133 -7.971 15.432 -0.133 1.00 0.00 H new ATOM 0 HA HIS A 133 -8.446 17.039 2.246 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.060 16.845 0.281 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.498 15.271 0.914 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -10.287 18.977 2.440 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -13.251 16.807 4.521 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -12.123 19.100 4.324 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.581 13.712 2.258 1.00 0.00 N ATOM 1979 CA LEU A 134 -8.584 12.552 3.216 1.00 0.00 C ATOM 1980 C LEU A 134 -7.332 12.587 4.103 1.00 0.00 C ATOM 1981 O LEU A 134 -7.248 11.878 5.097 1.00 0.00 O ATOM 1982 CB LEU A 134 -8.665 11.252 2.439 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.104 11.072 1.941 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.190 11.379 0.454 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.577 9.635 2.200 1.00 0.00 C ATOM 0 H LEU A 134 -8.462 13.470 1.274 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.455 12.624 3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -7.972 11.270 1.598 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.376 10.413 3.072 1.00 0.00 H new ATOM 0 HG LEU A 134 -10.748 11.764 2.484 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.217 11.247 0.114 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -9.878 12.408 0.276 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.536 10.702 -0.096 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.600 9.519 1.842 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -9.927 8.937 1.672 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.541 9.427 3.269 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.392 13.449 3.781 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.169 13.613 4.618 1.00 0.00 C ATOM 1999 C ARG A 135 -5.494 14.708 5.608 1.00 0.00 C ATOM 2000 O ARG A 135 -5.202 14.603 6.794 1.00 0.00 O ATOM 2001 CB ARG A 135 -3.984 14.011 3.743 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.264 12.751 3.253 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.110 12.416 4.200 1.00 0.00 C ATOM 2004 NE ARG A 135 -2.648 11.827 5.458 1.00 0.00 N ATOM 2005 CZ ARG A 135 -1.998 11.984 6.576 1.00 0.00 C ATOM 2006 NH1 ARG A 135 -2.189 13.058 7.292 1.00 0.00 N ATOM 2007 NH2 ARG A 135 -1.160 11.066 6.982 1.00 0.00 N ATOM 0 H ARG A 135 -6.427 14.052 2.959 1.00 0.00 H new ATOM 0 HA ARG A 135 -4.896 12.688 5.125 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.328 14.600 2.893 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.296 14.639 4.308 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -3.963 11.916 3.206 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -2.885 12.906 2.243 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -1.426 11.714 3.722 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.538 13.316 4.424 1.00 0.00 H new ATOM 0 HE ARG A 135 -3.523 11.302 5.444 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -2.846 13.772 6.976 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -1.682 13.184 8.168 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -1.014 10.225 6.423 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -0.652 11.191 7.858 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.180 15.742 5.126 1.00 0.00 N ATOM 2022 CA ARG A 136 -6.635 16.839 6.018 1.00 0.00 C ATOM 2023 C ARG A 136 -7.913 16.364 6.756 1.00 0.00 C ATOM 2024 O ARG A 136 -8.439 17.058 7.612 1.00 0.00 O ATOM 2025 CB ARG A 136 -6.952 18.088 5.185 1.00 0.00 C ATOM 2026 CG ARG A 136 -5.663 18.882 4.921 1.00 0.00 C ATOM 2027 CD ARG A 136 -5.905 19.923 3.813 1.00 0.00 C ATOM 2028 NE ARG A 136 -5.330 21.241 4.228 1.00 0.00 N ATOM 2029 CZ ARG A 136 -4.782 22.026 3.334 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -3.822 21.577 2.577 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -5.194 23.259 3.204 1.00 0.00 N ATOM 0 H ARG A 136 -6.436 15.855 4.145 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.854 17.088 6.737 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -7.411 17.798 4.240 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.673 18.713 5.711 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.339 19.380 5.835 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -4.862 18.204 4.626 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.445 19.591 2.882 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -6.973 20.025 3.623 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.365 21.528 5.206 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -3.498 20.615 2.681 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -3.394 22.187 1.880 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.943 23.612 3.799 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -4.766 23.869 2.507 1.00 0.00 H new ATOM 2045 N SER A 137 -8.400 15.156 6.421 1.00 0.00 N ATOM 2046 CA SER A 137 -9.610 14.588 7.069 1.00 0.00 C ATOM 2047 C SER A 137 -9.203 13.941 8.403 1.00 0.00 C ATOM 2048 O SER A 137 -10.034 13.721 9.268 1.00 0.00 O ATOM 2049 CB SER A 137 -10.234 13.519 6.124 1.00 0.00 C ATOM 2050 OG SER A 137 -9.435 12.338 6.124 1.00 0.00 O ATOM 0 H SER A 137 -7.983 14.553 5.712 1.00 0.00 H new ATOM 0 HA SER A 137 -10.344 15.372 7.259 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.247 13.282 6.449 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.309 13.917 5.112 1.00 0.00 H new ATOM 0 HG SER A 137 -8.490 12.582 6.212 1.00 0.00 H new ATOM 2056 N GLN A 138 -7.904 13.624 8.562 1.00 0.00 N ATOM 2057 CA GLN A 138 -7.404 12.972 9.831 1.00 0.00 C ATOM 2058 C GLN A 138 -7.801 11.490 9.839 1.00 0.00 C ATOM 2059 O GLN A 138 -7.728 10.831 10.869 1.00 0.00 O ATOM 2060 CB GLN A 138 -7.997 13.669 11.068 1.00 0.00 C ATOM 2061 CG GLN A 138 -7.028 13.548 12.238 1.00 0.00 C ATOM 2062 CD GLN A 138 -5.857 14.502 12.022 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -4.744 14.074 11.798 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -6.061 15.791 12.078 1.00 0.00 N ATOM 0 H GLN A 138 -7.183 13.795 7.861 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.318 13.063 9.865 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -8.189 14.719 10.849 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -8.955 13.218 11.328 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -7.537 13.784 13.173 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.667 12.523 12.322 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -6.996 16.152 12.266 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -5.285 16.437 11.933 1.00 0.00 H new ATOM 2073 N TYR A 139 -8.211 10.959 8.688 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.605 9.519 8.605 1.00 0.00 C ATOM 2075 C TYR A 139 -7.411 8.685 8.110 1.00 0.00 C ATOM 2076 O TYR A 139 -7.569 7.486 7.997 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.760 9.362 7.613 1.00 0.00 C ATOM 2078 CG TYR A 139 -11.055 9.865 8.220 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -11.433 9.481 9.517 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -11.888 10.701 7.471 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -12.642 9.935 10.055 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -13.094 11.157 8.010 1.00 0.00 C ATOM 2083 CZ TYR A 139 -13.472 10.774 9.303 1.00 0.00 C ATOM 2084 OH TYR A 139 -14.667 11.217 9.834 1.00 0.00 O ATOM 2085 OXT TYR A 139 -6.363 9.264 7.848 1.00 0.00 O ATOM 0 H TYR A 139 -8.285 11.474 7.810 1.00 0.00 H new ATOM 0 HA TYR A 139 -8.913 9.175 9.592 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.541 9.916 6.700 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.866 8.314 7.333 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.791 8.836 10.098 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.599 10.995 6.473 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -12.935 9.638 11.051 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -13.734 11.805 7.430 1.00 0.00 H new ATOM 0 HH TYR A 139 -15.121 11.791 9.183 1.00 0.00 H new